data_2l3j_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 2l3j _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' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo . . . . . 0 N--CA 1.453 -0.9 0 CA-C-O 120.094 -0.044 . . . . 0.0 112.019 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.582 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.47 ' CB ' HG23 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.425 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.517 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.464 ' CE2' HG13 ' A' ' 42' ' ' VAL . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 119.853 -0.145 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG12 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.796 0.331 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.48 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.404 ' C ' ' H ' ' A' ' 198' ' ' GLY . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 119.858 -0.143 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.456 ' H ' HD21 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.479 ' CB ' HG23 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.485 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.479 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.572 HG13 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.572 ' CE2' HG13 ' A' ' 42' ' ' VAL . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 N-CA-C 110.678 -0.547 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.462 -0.348 0 N-CA-C 114.225 0.817 . . . . 0.0 114.225 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.521 HD12 ' HZ1' ' A' ' 17' ' ' LYS . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HZ1' HD12 ' A' ' 13' ' ' LEU . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.43 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.43 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.587 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.587 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.431 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo . . . . . 0 N--CA 1.449 -1.122 0 CA-C-O 119.994 -0.086 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.443 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 . . . . . 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo . . . . . 0 N--CA 1.46 -0.479 0 N-CA-C 114.899 1.076 . . . . 0.0 114.899 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.406 ' HH ' ' HB2' ' A' ' 62' ' ' ALA . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.514 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.514 ' H ' HD23 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.481 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.509 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.451 HD12 ' HG ' ' A' ' 26' ' ' SER . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.509 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.481 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.586 HG12 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.539 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB2' ' HH ' ' A' ' 22' ' ' TYR . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.539 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.586 ' CE2' HG12 ' A' ' 42' ' ' VAL . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.455 -0.789 0 N-CA-C 111.89 -0.081 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.449 ' CG ' HG12 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 . . . . . 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt . . . . . 0 CA--C 1.526 0.033 0 CA-C-O 120.677 0.275 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.449 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.474 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 . . . . . 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo . . . . . 0 CA--C 1.537 0.645 0 CA-C-O 121.078 0.366 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.485 HD22 ' HH ' ' A' ' 22' ' ' TYR . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.485 ' HH ' HD22 ' A' ' 13' ' ' LEU . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.416 ' H ' HD23 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.485 ' HG ' HD13 ' A' ' 35' ' ' LEU . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.485 HD13 ' HG ' ' A' ' 26' ' ' SER . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.409 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' A' ' 44' ' ' GLY . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 42' ' ' VAL . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.409 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.4 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 CA-C-O 120.61 0.171 . . . . 0.0 111.77 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . 0.45 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.583 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.458 ' CG ' HG11 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.4 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.458 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.583 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 115.376 1.26 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.525 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.525 ' HB3' ' CG ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.457 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.457 ' H ' HD21 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.473 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.426 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.2 tp-100 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.426 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.473 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.442 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.46 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.46 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo . . . . . 0 N--CA 1.449 -1.13 0 N-CA-C 110.483 -0.622 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . 0.41 ' C ' ' H ' ' A' ' 173' ' ' GLY . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 171' ' ' ARG . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.469 ' CG ' HG11 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 111.487 0.18 . . . . 0.0 111.487 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.469 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 113.756 0.637 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.506 HD13 ' HZ2' ' A' ' 17' ' ' LYS . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.506 ' HZ2' HD13 ' A' ' 13' ' ' LEU . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.438 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.437 ' CE1' HD23 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.457 ' CB ' HG21 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.5 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.5 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.457 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.418 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.556 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 9.8 t-160 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.418 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . 0.439 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo . . . . . 0 N--CA 1.454 -0.814 0 N-CA-C 109.831 -0.873 . . . . 0.0 109.831 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . 0.439 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.467 ' CG ' HG12 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.291 0.091 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.467 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 113.956 0.714 . . . . 0.0 113.956 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.595 ' CD2' ' HH ' ' A' ' 22' ' ' TYR . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.595 ' HH ' ' CD2' ' A' ' 13' ' ' LEU . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.579 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.579 ' H ' HD23 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.461 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.559 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 5.3 t-160 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.559 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo . . . . . 0 N--CA 1.443 -1.451 0 CA-C-O 119.194 -0.419 . . . . 0.0 111.81 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.428 ' CG ' HG12 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.384 0.135 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.408 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.428 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.46 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.452 0.52 . . . . 0.0 113.452 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.55 HD23 ' HH ' ' A' ' 22' ' ' TYR . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HH ' HD23 ' A' ' 13' ' ' LEU . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.511 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.475 ' HG ' HD13 ' A' ' 35' ' ' LEU . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.454 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.475 HD13 ' HG ' ' A' ' 26' ' ' SER . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.454 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.436 ' CG1' ' HB3' ' A' ' 50' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.568 HG13 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.483 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 12.4 t-160 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.483 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.568 ' CE2' HG13 ' A' ' 42' ' ' VAL . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo . . . . . 0 N--CA 1.453 -0.862 0 N-CA-C 110.806 -0.498 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG12 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? . . . . . 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.463 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 113.145 0.402 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.456 ' H ' HD23 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.476 ' CB ' HG23 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.461 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.483 ' CE2' HG13 ' A' ' 42' ' ' VAL . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 . . . . . 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo . . . . . 0 N--CA 1.457 -0.666 0 N-CA-C 110.455 -0.633 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.404 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.432 ' CD1' HG12 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.858 0.361 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.432 HG12 ' CD1' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.404 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 . . . . . 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.46 -0.492 0 CA-C-O 119.813 -0.161 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.462 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.47 ' CB ' HG21 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.466 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.47 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.409 HG11 ' CE2' ' A' ' 69' ' ' PHE . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 111.913 -0.072 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.49 ' CG ' HG11 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.49 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 114.338 0.861 . . . . 0.0 114.338 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.528 HD23 ' HH ' ' A' ' 22' ' ' TYR . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.409 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.528 ' HH ' HD23 ' A' ' 13' ' ' LEU . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.503 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.453 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.4 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.409 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.409 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . 0.426 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 72.8 Cg_endo . . . . . 0 N--CA 1.454 -0.81 0 N-CA-C 111.061 -0.4 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . 0.426 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.439 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.816 0.341 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.439 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.466 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo . . . . . 0 N--CA 1.451 -0.987 0 N-CA-C 112.329 0.088 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.412 HD21 ' CE1' ' A' ' 22' ' ' TYR . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.412 ' CE1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.537 ' C ' HG22 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.471 ' CB ' HG21 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.537 HG22 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.455 HG12 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CZ ' HG12 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 N-CA-C 111.454 -0.248 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 121.262 0.554 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 111.509 -0.227 . . . . 0.0 111.509 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.502 HD23 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.502 ' H ' HD23 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.446 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.469 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.469 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.446 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.561 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.561 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.287 -0.313 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . 0.443 ' C ' HD23 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.443 HD23 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.313 0.101 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.42 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.47 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.47 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo . . . . . 0 N--CA 1.459 -0.516 0 N-CA-C 114.17 0.796 . . . . 0.0 114.17 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.429 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.439 ' CD1' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.508 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.508 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.448 ' CB ' HG21 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.409 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.415 HD12 ' HG ' ' A' ' 26' ' ' SER . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.409 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.448 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.44 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.415 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.482 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.517 ' C ' ' H ' ' A' ' 19' ' ' GLY . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.517 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.542 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.542 ' H ' HD21 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.464 ' CB ' HG23 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.494 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.494 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.428 HG13 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.418 ' CZ ' ' CB ' ' A' ' 68' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.442 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.428 ' CZ ' HG13 ' A' ' 42' ' ' VAL . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo . . . . . 0 N--CA 1.444 -1.427 0 N-CA-C 110.597 -0.578 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 121.217 0.532 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.422 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 111.706 -0.152 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' CG ' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' CD1' ' CG ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.457 ' CB ' HG21 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.48 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.48 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.457 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.542 -0.215 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG11 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.8 tptt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.278 0.085 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.483 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 108.986 -1.198 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.582 HD21 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.582 ' H ' HD21 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.439 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.411 HG22 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.767 -0.513 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.42 ' CG ' HG12 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 63.6 tttt . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.42 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.4 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.405 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.54 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.54 ' H ' HD21 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.457 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.546 HG13 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.413 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.546 ' CE2' HG13 ' A' ' 42' ' ' VAL . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo . . . . . 0 N--CA 1.447 -1.245 0 N-CA-C 111.851 -0.096 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.413 0.625 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' VAL . . . . . 0.491 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.442 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.442 HE21 HG22 ' A' ' 223' ' ' VAL . 3.4 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.442 HG22 HE21 ' A' ' 199' ' ' GLN . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo . . . . . 0 CA--C 1.528 0.224 0 N-CA-C 112.778 0.261 . . . . 0.0 112.778 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.76 178.08 48.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.42 -179.0 4.03 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.467 3.445 . . . . 0.0 110.829 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.9 m -139.97 173.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 C-N-CA 124.092 0.957 . . . . 0.0 109.327 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -146.93 151.79 42.54 Favored Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 122.974 0.51 . . . . 0.0 110.382 -176.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -76.98 -10.71 18.08 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.452 3.435 . . . . 0.0 112.019 -178.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.582 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.47 ' CB ' HG23 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.457 HG22 " H1'" ' B' ' 287' ' ' ' U' . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.425 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.562 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.517 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.64 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -145.92 59.1 5.31 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.64 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 98.3 Cg_endo -70.85 -9.13 25.12 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.621 3.547 . . . . 0.0 110.774 176.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -160.27 164.47 32.63 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.051 1.74 . . . . 0.0 107.269 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.64 155.81 35.36 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 118.188 0.449 . . . . 0.0 111.712 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.6 p -158.13 3.73 0.11 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.716 0.807 . . . . 0.0 111.126 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -154.88 157.16 37.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.849 0.459 . . . . 0.0 110.053 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.13 165.62 35.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.456 0.703 . . . . 0.0 109.857 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -157.03 -173.6 4.53 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.99 0.516 . . . . 0.0 111.649 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -142.06 16.21 2.09 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.419 0.688 . . . . 0.0 110.12 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.15 15.15 0.6 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.015 0.926 . . . . 0.0 112.699 -178.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.4 ptm -141.56 171.59 13.85 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.509 0.671 . . . . 0.0 110.839 -177.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.35 -168.31 35.0 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -144.04 163.81 32.44 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 t -146.42 -170.06 3.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.342 0.657 . . . . 0.0 109.685 -176.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.404 ' H ' HD11 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -131.98 174.49 10.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.508 0.723 . . . . 0.0 111.506 -177.614 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -149.72 176.4 10.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.051 0.453 . . . . 0.0 111.169 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.446 ' C ' ' H ' ' A' ' 90' ' ' THR . 8.8 p -145.77 0.22 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.751 0.82 . . . . 0.0 110.145 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.68 22.33 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.915 0.886 . . . . 0.0 112.239 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 88' ' ' VAL . 60.2 p -131.11 9.16 4.81 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 123.313 0.645 . . . . 0.0 110.806 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.6 -2.44 6.73 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.101 0.56 . . . . 0.0 111.659 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -148.28 170.63 17.5 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.36 0.664 . . . . 0.0 109.731 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -150.19 173.34 14.04 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.818 0.447 . . . . 0.0 110.254 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.3 m -139.84 17.38 2.49 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.697 -176.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -146.19 163.74 34.45 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 122.763 0.425 . . . . 0.0 109.977 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -157.38 179.12 9.56 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.075 0.95 . . . . 0.0 110.763 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.09 18.77 1.76 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.71 0.404 . . . . 0.0 111.272 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.15 170.75 18.19 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.007 0.523 . . . . 0.0 109.835 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -145.05 155.95 55.0 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.79 0.836 . . . . 0.0 110.592 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.87 169.96 19.06 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.241 3.294 . . . . 0.0 111.166 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -153.48 11.23 0.44 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.261 0.625 . . . . 0.0 112.359 -177.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.6 p -62.06 161.11 11.35 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -64.98 165.42 10.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.777 0.431 . . . . 0.0 112.073 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -148.83 2.35 0.6 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.774 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -155.57 168.29 27.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.46 0.573 . . . . 0.0 110.102 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 178.36 162.48 28.15 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -150.85 175.39 12.06 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.054 0.427 . . . . 0.0 111.345 -173.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -148.28 141.27 24.85 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.828 0.851 . . . . 0.0 109.192 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.1 m -59.64 127.78 85.44 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.48 -7.64 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.345 2.696 . . . . 0.0 113.386 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -156.06 177.13 11.78 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.694 0.679 . . . . 0.0 110.515 -177.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.66 -17.82 17.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.479 1.112 . . . . 0.0 112.24 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.8 p -152.99 175.48 12.92 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.288 0.635 . . . . 0.0 110.06 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -58.14 145.14 74.57 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 122.177 -0.327 . . . . 0.0 110.542 178.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.66 166.2 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.995 3.13 . . . . 0.0 110.87 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.8 162.56 3.6 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.274 3.316 . . . . 0.0 112.855 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.51 16.42 2.01 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.844 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -138.88 16.41 2.67 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.906 0.482 . . . . 0.0 111.475 -176.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -144.08 177.01 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 C-N-CA 122.895 0.478 . . . . 0.0 110.065 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -158.25 26.85 0.43 Allowed Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.2 m -139.93 28.83 2.11 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.567 0.747 . . . . 0.0 110.514 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -129.95 13.2 5.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.921 0.488 . . . . 0.0 111.359 -175.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -178.96 178.21 48.72 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -154.48 12.06 0.4 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.015 0.526 . . . . 0.0 111.288 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -142.73 29.28 1.55 Allowed 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.05 0.54 . . . . 0.0 111.348 -174.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.3 m -135.34 15.11 3.47 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.969 -0.457 . . . . 0.0 111.847 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -147.28 20.69 1.21 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 123.425 0.69 . . . . 0.0 111.136 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.5 m -136.34 16.82 3.18 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.38 0.672 . . . . 0.0 111.278 -177.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 29.5 t -153.47 171.56 18.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.117 0.567 . . . . 0.0 110.435 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 79.7 p -149.09 5.08 0.64 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.967 0.507 . . . . 0.0 111.476 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.4 166.94 33.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -157.72 6.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.22 147.52 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 121.867 -0.521 . . . . 0.0 110.417 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.0 m -151.26 8.07 0.53 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.387 0.675 . . . . 0.0 111.528 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.6 mt -137.0 17.2 3.02 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.83 0.452 . . . . 0.0 111.432 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.0 t -147.88 172.31 14.36 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.87 0.468 . . . . 0.0 110.907 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.9 17.81 2.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.351 1.06 . . . . 0.0 110.208 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.516 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 50.6 m -68.26 -26.27 1.22 Allowed Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 117.25 -1.357 . . . . 0.0 114.48 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.516 ' CD ' ' N ' ' A' ' 138' ' ' SER . 91.2 Cg_exo -48.3 166.35 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.288 2.659 . . . . 0.0 115.116 175.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 25.5 m -137.53 52.89 5.79 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.568 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -68.05 -179.86 2.41 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.57 2.847 . . . . 0.0 110.847 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.6 -178.98 5.77 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.121 0.568 . . . . 0.0 110.46 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.7 t -140.3 13.1 2.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.667 0.387 . . . . 0.0 111.932 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 50.96 26.91 2.91 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.495 1.118 . . . . 0.0 112.614 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 24.4 m -134.26 -7.21 2.62 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.591 0.756 . . . . 0.0 110.017 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -157.33 144.94 13.84 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 125.053 1.341 . . . . 0.0 108.028 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.9 150.13 4.87 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.649 2.899 . . . . 0.0 111.922 176.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.87 0.47 8.79 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.287 3.325 . . . . 0.0 112.624 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 151' ' ' ILE . 3.9 mm? -64.48 147.03 97.82 Favored Pre-proline 0 N--CA 1.451 -0.411 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -58.59 2.97 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.623 3.549 . . . . 0.0 114.464 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . 0.422 ' H ' ' C ' ' A' ' 149' ' ' LEU . 6.6 tt -145.23 145.25 26.02 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 123.387 0.675 . . . . 0.0 110.041 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -54.47 167.44 1.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.373 2.715 . . . . 0.0 111.496 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -67.54 160.84 46.13 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.1 1.866 . . . . 0.0 110.405 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.94 156.59 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.378 3.385 . . . . 0.0 113.735 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -145.66 153.0 50.33 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.298 1.039 . . . . 0.0 109.451 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.18 138.82 28.46 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 123.039 2.493 . . . . 0.0 110.475 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.18 165.78 25.42 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.39 2.727 . . . . 0.0 110.524 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.22 172.45 12.1 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.359 2.706 . . . . 0.0 110.559 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 78.8 p -143.8 10.99 1.6 Allowed 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 179.79 -28.77 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.35 174.85 10.33 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 123.496 0.718 . . . . 0.0 109.811 175.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -145.0 102.04 4.48 Favored Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -82.85 -11.5 10.13 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 124.665 3.577 . . . . 0.0 112.021 -170.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.409 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG12 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -112.22 -175.18 2.62 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 31.2 m -140.25 23.81 2.34 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -174.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -164.63 177.89 40.04 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 118.967 0.803 . . . . 0.0 111.861 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -79.77 -62.67 1.62 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 117.881 0.84 . . . . 0.0 110.247 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.1 m -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.988 0.915 . . . . 0.0 110.447 178.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -131.27 165.18 23.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.928 0.491 . . . . 0.0 109.862 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . 44.61 26.21 0.17 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -175.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.92 154.66 29.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.042 0.537 . . . . 0.0 111.472 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.48 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.404 ' C ' ' H ' ' A' ' 198' ' ' GLY . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . 0.418 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 54.43 28.38 9.48 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 83.7 mt -131.85 -166.22 1.69 Allowed 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.212 1.005 . . . . 0.0 110.209 -174.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.43 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 15.3 t-80 -140.34 -170.18 2.93 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.884 -0.51 . . . . 0.0 110.477 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.43 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 19.4 tp -144.1 -0.63 1.0 Allowed 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.985 -0.447 . . . . 0.0 111.884 -174.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.57 25.14 3.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.936 0.334 . . . . 0.0 111.126 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.57 7.49 9.5 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.934 0.494 . . . . 0.0 111.587 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -155.51 163.28 40.21 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.752 0.821 . . . . 0.0 109.921 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -157.93 8.52 0.15 Allowed 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -145.23 20.0 1.57 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.239 0.472 . . . . 0.0 111.59 -176.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -57.98 -16.61 13.02 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.95 0.5 . . . . 0.0 112.178 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -156.61 160.07 39.07 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.365 1.066 . . . . 0.0 108.818 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 81.4 t60 . . . . . 0 C--O 1.253 1.266 0 CA-C-O 117.752 -1.118 . . . . 0.0 110.358 -178.993 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.445 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 98.863 -3.837 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.445 " H5'" HO2' ' B' ' 237' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 O4'-C1'-N19 111.925 3.725 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.505 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C4'-C3'-C2' 99.475 -3.225 . 0.81 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.528 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.864 1 C4'-C3'-C2' 98.636 -4.064 . 0.793 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.528 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 O4'-C1'-N19 112.006 3.806 . 0.682 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.497 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 C4'-C3'-C2' 99.168 -3.532 . 0.821 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.497 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.365 0 C4'-C3'-C2' 98.99 -3.71 . 0.688 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.3 0 C4'-C3'-C2' 99.325 -3.375 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.553 HO2' " H5'" ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.237 0 C4'-C3'-C2' 99.367 -3.333 . 0.753 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.553 " H5'" HO2' ' B' ' 245' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.374 3.174 . 0.678 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.505 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 99.467 -3.233 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.505 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.123 -3.577 . 0.709 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.439 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.722 -2.978 . 0.782 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.439 " H5'" HO2' ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C4'-C3'-C2' 99.906 -2.794 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.403 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.417 -3.283 . 0.743 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.403 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 O4'-C1'-N19 111.36 3.16 . 0.674 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C4'-C3'-C2' 99.152 -3.548 . 0.783 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.289 -3.411 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 1 C4'-C3'-C2' 98.67 -4.03 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.441 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.265 0 C4'-C3'-C2' 99.316 -3.384 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.518 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C4'-C3'-C2' 99.472 -3.228 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.518 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.046 0 C4'-C3'-C2' 99.19 -3.51 . 0.75 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.517 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.08 -3.62 . 0.69 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.639 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C4'-C3'-C2' 99.464 -3.236 . 0.825 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.639 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.415 -3.176 0 O4'-C1'-N19 111.099 2.899 . 0.868 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.492 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.178 -3.522 . 0.827 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.492 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 99.53 -3.17 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.096 -3.604 . 0.879 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.937 0 C4'-C3'-C2' 99.234 -3.466 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.473 HO2' " H5'" ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 99.243 -3.457 . 0.613 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.473 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 P--O5' 1.616 2.281 0 C4'-C3'-C2' 99.573 -3.127 . 0.693 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.454 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.81 0 C4'-C3'-C2' 99.268 -3.432 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.454 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.21 -3.49 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C5'-C4'-C3' 111.987 -2.342 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.541 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.457 1 C5'-C4'-C3' 108.667 -4.555 OUTLIER-DELTA 0.014 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.541 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.629 3 P-O3'-C3' 124.996 4.413 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.456 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.258 1 C4'-C3'-C2' 97.696 -5.004 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.456 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.124 2.924 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.484 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 P--O5' 1.617 2.4 0 C4'-C3'-C2' 99.637 -3.063 . 0.627 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.484 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.713 1 C4'-C3'-C2' 98.48 -4.22 . 0.759 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.562 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 O4'-C1'-N19 112.224 4.024 . 0.59 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.405 HO2' " H5'" ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 99.058 -3.642 . 0.891 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.405 " H5'" HO2' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.584 1 C4'-C3'-C2' 98.613 -4.087 . 0.788 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 99.3 -3.4 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.437 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.026 0 C4'-C3'-C2' 99.012 -3.688 . 0.91 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.437 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.744 -3.956 . 0.847 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.448 HO2' " H5'" ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 C4'-C3'-C2' 99.677 -3.023 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.448 " H5'" HO2' ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.473 0 C4'-C3'-C2' 99.02 -3.68 . 0.887 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C5'-C4'-C3' 111.807 -2.462 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.28 1 O4'-C1'-N19 112.702 4.502 . 0.82 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.496 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.674 0 O4'-C1'-N19 111.803 3.603 . 0.496 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.496 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 C4'-C3'-C2' 99.581 -3.119 . 0.731 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.667 0 O4'-C1'-N19 111.218 3.018 . 0.895 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C4'-C3'-C2' 99.289 -3.411 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.611 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.387 1 O4'-C1'-N19 112.27 4.07 . 0.414 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.611 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.388 3.188 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.552 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.446 -3.254 . 0.628 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.513 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 O4'-C1'-N19 111.618 3.418 . 0.725 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.252 0 O4'-C1'-N19 111.167 2.967 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.56 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.319 0 C4'-C3'-C2' 99.322 -3.378 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.56 " H5'" HO2' ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 C4'-C3'-C2' 98.733 -3.967 . 0.601 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.291 -3.409 . 0.63 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.551 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C4'-C3'-C2' 99.908 -2.792 . 0.818 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.564 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.626 0 O4'-C1'-N19 111.511 3.311 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.564 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.352 0 C4'-C3'-C2' 99.371 -3.329 . 0.7 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.502 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C4'-C3'-C2' 99.45 -3.25 . 0.627 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.461 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.414 -3.243 1 C4'-C3'-C2' 98.467 -4.233 . 0.739 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.425 HO2' " H5'" ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.202 0 O4'-C1'-N19 112.163 3.963 . 0.722 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.425 " H5'" HO2' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.182 0 C4'-C3'-C2' 99.633 -3.067 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.458 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.26 1 C4'-C3'-C2' 98.084 -4.616 . 0.729 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.458 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.947 0 O4'-C1'-N19 111.879 3.679 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo . . . . . 0 CA--C 1.529 0.242 0 N-CA-C 112.356 0.098 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.01 -176.92 47.72 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.05 0.93 0.09 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.525 1 C-N-CA 125.6 4.2 . . . . 0.0 114.834 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.83 -12.23 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 118.489 0.586 . . . . 0.0 111.089 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.9 tp -159.02 63.02 2.26 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 123.916 0.886 . . . . 0.0 109.156 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.87 -26.05 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.408 2.072 . . . . 0.0 112.242 -171.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.456 ' H ' HD21 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.479 ' CB ' HG23 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.485 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.479 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.572 HG13 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.569 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.657 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.46 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 25.1 m-85 -149.98 46.84 0.43 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.657 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 97.6 Cg_endo -71.09 -20.37 28.77 Favored 'Trans proline' 0 N--CA 1.448 -1.147 0 C-N-CA 124.438 3.425 . . . . 0.0 112.093 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -163.75 -33.01 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 CA-C-N 117.811 0.278 . . . . 0.0 110.808 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.57 -172.38 4.12 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.202 0.601 . . . . 0.0 110.152 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.4 t -139.71 170.56 15.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.246 0.618 . . . . 0.0 109.576 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -143.68 20.79 1.83 Allowed 'General case' 0 C--N 1.339 0.127 0 C-N-CA 123.37 0.668 . . . . 0.0 111.3 -175.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.04 168.26 19.69 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-O 120.912 0.387 . . . . 0.0 111.655 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -147.22 172.61 13.57 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 123.839 0.856 . . . . 0.0 110.412 -176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mp -67.48 -11.58 58.25 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.522 0.329 . . . . 0.0 111.489 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -82.35 -7.4 59.63 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.08 -179.97 4.66 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.049 0.54 . . . . 0.0 111.301 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.17 -174.75 29.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -139.86 171.9 13.54 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.525 0.73 . . . . 0.0 110.262 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.8 t -149.21 18.76 0.96 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.767 0.427 . . . . 0.0 110.933 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 96.4 mt -134.6 169.27 17.56 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.446 0.699 . . . . 0.0 110.262 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.7 t -156.72 175.77 13.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.356 0.662 . . . . 0.0 110.618 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -143.85 7.17 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 C-N-CA 123.917 0.887 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -144.7 24.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.935 0.494 . . . . 0.0 111.867 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.2 p -134.94 25.22 3.62 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.196 0.998 . . . . 0.0 109.762 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.03 174.49 10.47 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.294 0.568 . . . . 0.0 110.516 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.16 174.17 14.57 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.529 0.681 . . . . 0.0 110.075 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.7 p -144.08 175.96 9.66 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.879 0.872 . . . . 0.0 110.016 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 83.2 p -152.34 169.62 22.09 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.627 0.771 . . . . 0.0 110.468 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -151.67 171.2 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.011 0.524 . . . . 0.0 110.622 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -142.71 11.2 1.84 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.389 0.675 . . . . 0.0 111.637 -177.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -75.21 6.53 4.25 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.559 0.344 . . . . 0.0 111.871 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -151.24 177.78 9.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.454 0.702 . . . . 0.0 109.841 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 62.8 t80 -144.55 146.93 34.26 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 99' ' ' PHE . 52.0 Cg_exo -56.03 6.81 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 125.415 4.077 . . . . 0.0 116.265 178.626 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -138.29 15.27 2.8 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.078 0.853 . . . . 0.0 110.377 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.6 p -134.21 4.72 3.48 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.858 0.463 . . . . 0.0 111.294 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.17 -14.13 62.81 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.899 0.48 . . . . 0.0 111.632 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -68.94 -179.22 1.41 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.301 0.572 . . . . 0.0 112.08 178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.0 p-10 -139.49 11.16 2.52 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.136 0.575 . . . . 0.0 111.587 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.77 169.81 42.34 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -154.44 -8.55 0.14 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.58 178.35 10.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.726 0.41 . . . . 0.0 111.182 -178.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 28.8 p -142.76 159.2 57.83 Favored Pre-proline 0 C--O 1.232 0.173 0 C-N-CA 123.886 0.875 . . . . 0.0 108.858 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 158.46 56.9 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.367 2.711 . . . . 0.0 111.372 -178.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.38 172.27 6.22 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.396 0.679 . . . . 0.0 111.032 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -129.24 20.04 5.81 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.277 0.631 . . . . 0.0 111.225 -178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.0 t -142.21 12.08 1.97 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.542 0.737 . . . . 0.0 109.475 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.459 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 39.3 tt0 -65.56 -36.2 13.97 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 71.1 Cg_exo -48.91 149.17 8.19 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.984 2.456 . . . . 0.0 112.595 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.61 164.06 36.7 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.324 2.683 . . . . 0.0 110.838 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -153.52 166.86 31.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.154 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -69.23 167.9 15.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.848 0.459 . . . . 0.0 111.015 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.8 m -144.64 168.81 9.41 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 C-N-CA 123.954 0.901 . . . . 0.0 110.195 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.11 177.35 46.38 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 67.9 p -153.28 19.38 0.56 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.182 0.593 . . . . 0.0 111.242 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -140.37 11.16 2.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.771 0.429 . . . . 0.0 110.969 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.23 18.4 0.07 OUTLIER Glycine 0 CA--C 1.522 0.507 0 N-CA-C 112.236 -0.345 . . . . 0.0 112.236 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -137.91 6.65 2.67 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.668 0.734 . . . . 0.0 111.518 -174.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -151.19 -5.65 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.263 0.625 . . . . 0.0 112.041 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.5 p -159.27 161.17 35.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.708 0.403 . . . . 0.0 111.027 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.4 t80 44.11 27.11 0.18 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.69 1.196 . . . . 0.0 113.193 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 75.7 p -104.52 8.7 35.57 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.769 0.827 . . . . 0.0 111.372 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 43.6 m -144.72 17.46 1.64 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.245 0.618 . . . . 0.0 110.536 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.6 t -146.65 26.12 1.16 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.676 0.391 . . . . 0.0 111.261 -175.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -153.29 174.65 31.94 Favored Glycine 0 CA--C 1.527 0.785 0 O-C-N 122.092 -0.38 . . . . 0.0 112.157 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.46 -6.46 43.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.998 0.919 . . . . 0.0 112.327 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.83 -13.21 11.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 123.059 0.544 . . . . 0.0 112.429 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 50.9 m -70.42 -13.89 62.32 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.668 0.387 . . . . 0.0 111.609 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.4 pp 44.4 18.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.785 1.634 . . . . 0.0 114.519 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 96.4 p -140.02 5.86 2.15 Favored 'General case' 0 CA--C 1.528 0.097 0 O-C-N 121.949 -0.47 . . . . 0.0 111.984 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -149.66 167.24 26.97 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.7 m -146.75 156.98 48.12 Favored Pre-proline 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.41 173.04 11.24 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 123.311 2.674 . . . . 0.0 110.271 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 6.3 t 41.69 60.73 8.59 Favored Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 124.593 1.157 . . . . 0.0 111.993 -177.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 143' ' ' SER . 85.2 Cg_endo -74.3 7.72 2.46 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.368 3.379 . . . . 0.0 111.66 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.42 14.75 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.504 1.122 . . . . 0.0 113.194 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 141' ' ' PRO . 74.4 p -128.38 1.61 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.572 0.749 . . . . 0.0 111.053 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.2 mp 50.56 28.93 3.71 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 124.829 1.252 . . . . 0.0 113.101 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.3 t -145.1 178.88 7.74 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 122.559 0.343 . . . . 0.0 111.246 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -147.41 157.77 44.71 Favored Pre-proline 0 C--O 1.234 0.239 0 C-N-CA 123.698 0.799 . . . . 0.0 110.357 -176.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.32 162.6 41.77 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.525 2.15 . . . . 0.0 110.574 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.61 166.63 28.83 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 123.37 2.714 . . . . 0.0 110.976 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -152.9 163.02 24.84 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 122.934 0.494 . . . . 0.0 109.96 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -54.17 163.5 3.31 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 123.856 3.038 . . . . 0.0 112.923 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 31.7 pt -61.42 156.58 51.31 Favored Pre-proline 0 CA--C 1.53 0.204 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.47 163.29 3.78 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.791 2.994 . . . . 0.0 112.377 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.24 162.6 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.287 3.325 . . . . 0.0 111.429 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.34 144.8 69.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.741 2.294 . . . . 0.0 110.466 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -69.0 153.28 96.28 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.738 -177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -72.91 161.52 43.44 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.67 2.913 . . . . 0.0 110.878 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.45 164.93 34.07 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.297 2.665 . . . . 0.0 111.233 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.61 176.88 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.619 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 15.9 t -148.95 176.16 10.66 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 123.081 0.552 . . . . 0.0 110.54 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -164.91 18.75 0.11 Allowed Glycine 0 CA--C 1.527 0.838 0 CA-C-O 119.299 -0.723 . . . . 0.0 112.035 -177.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -142.68 169.5 17.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.846 0.823 . . . . 0.0 109.826 -177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -149.83 162.57 27.79 Favored Pre-proline 0 C--O 1.237 0.408 0 C-N-CA 122.432 0.293 . . . . 0.0 110.578 -176.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -76.88 -11.12 18.22 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.715 2.943 . . . . 0.0 110.678 174.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -127.28 166.37 17.91 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.8 m -152.82 31.55 0.5 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.28 168.97 25.99 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.277 -0.963 . . . . 0.0 114.17 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.86 157.67 34.71 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.723 0.809 . . . . 0.0 110.859 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 28.5 m -58.64 -9.66 1.83 Allowed 'General case' 0 C--N 1.339 0.118 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -172.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -113.18 2.42 15.61 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.891 0.768 . . . . 0.0 111.456 -176.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -150.56 19.83 0.82 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt -60.48 158.19 12.63 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.498 1.119 . . . . 0.0 112.704 -173.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 59.9 33.74 21.58 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.0 mt -136.87 -166.66 1.94 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.473 1.109 . . . . 0.0 109.393 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.539 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 29.2 t-80 -150.47 -167.23 2.76 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.524 0.73 . . . . 0.0 109.078 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.539 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 8.6 tp -137.33 11.9 3.02 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.232 0.469 . . . . 0.0 111.466 -176.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.412 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 45.7 tp -59.95 154.96 17.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.935 -0.478 . . . . 0.0 110.47 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -146.35 18.28 1.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.79 0.436 . . . . 0.0 110.202 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . 0.412 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 68.2 m80 -138.56 174.53 10.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.858 0.463 . . . . 0.0 110.835 -177.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.0 3.07 2.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.266 0.626 . . . . 0.0 111.06 -178.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 41.31 40.47 1.22 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.76 1.224 . . . . 0.0 113.424 178.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.04 173.55 0.61 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.735 0.779 . . . . 0.0 112.063 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -141.15 7.69 2.02 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.533 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 116.952 -1.499 . . . . 0.0 109.927 -178.139 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.409 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C4'-C3'-C2' 98.718 -3.982 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.5 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.058 -3.642 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.5 " H5'" HO2' ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.243 -3.457 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.5 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.255 -3.445 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.5 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.848 1 O4'-C1'-N19 112.514 4.314 . 0.717 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.546 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.266 0 C4'-C3'-C2' 98.788 -3.912 . 0.787 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.546 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.043 0 O4'-C1'-N19 111.959 3.759 . 0.695 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.871 0 C4'-C3'-C2' 99.337 -3.363 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.988 -2.712 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 O4'-C1'-N19 111.778 3.578 . 0.552 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.913 -3.787 . 0.854 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.415 HO2' " H5'" ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C4'-C3'-C2' 98.906 -3.794 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.415 " H5'" HO2' ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.87 0 C4'-C3'-C2' 99.474 -3.226 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.498 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.974 0 C4'-C3'-C2' 99.674 -3.026 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.498 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 98.881 -3.819 . 0.766 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 98.716 -3.984 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.528 -3.172 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 O4'-C1'-N19 111.241 3.041 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.068 0 C4'-C3'-C2' 98.964 -3.736 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.429 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.05 -3.65 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.464 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.344 -3.356 . 0.823 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.56 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.395 -3.305 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.573 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.16 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.581 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.043 -3.657 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.581 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.05 0 O4'-C1'-N19 110.907 2.707 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.494 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.146 -3.554 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.494 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C4'-C3'-C2' 98.876 -3.824 . 0.72 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 98.787 -3.913 . 0.925 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.556 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.18 -3.52 . 0.796 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.556 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.948 0 O4'-C1'-N19 111.51 3.31 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.522 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 C4'-C3'-C2' 98.866 -3.834 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.432 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.593 1 C4'-C3'-C2' 98.283 -4.417 . 0.745 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.432 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.625 -3.075 . 0.725 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C5'-C4'-C3' 111.981 -2.346 . 0.703 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.476 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.621 2.833 1 C5'-C4'-C3' 108.67 -4.553 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.476 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.645 2 C5'-C4'-C3' 108.606 -4.596 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.403 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.405 -3.963 0 C4'-C3'-C2' 99.596 -3.104 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.403 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.278 0 O4'-C1'-N19 110.818 2.618 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.242 0 C4'-C3'-C2' 98.717 -3.983 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.596 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.263 1 C4'-C3'-C2' 98.568 -4.132 . 0.801 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.596 " H5'" HO2' ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 112.002 3.802 . 0.604 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 C4'-C3'-C2' 98.911 -3.789 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 1 C4'-C3'-C2' 98.686 -4.014 . 0.779 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 99.735 -2.965 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.053 -3.647 . 0.937 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.458 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 C4'-C3'-C2' 98.939 -3.761 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.458 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.437 -3.263 . 0.761 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.417 " H5'" HO2' ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.093 -3.607 . 0.883 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 100.136 -2.564 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.469 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.011 1 O4'-C1'-N19 113.185 4.985 . 0.564 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.678 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C5'-C4'-O4' 113.21 2.865 . 0.484 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.678 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 C4'-C3'-C2' 99.963 -2.737 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.606 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.053 0 C4'-C3'-C2' 99.634 -3.066 . 0.796 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.425 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 98.916 -3.784 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.744 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.806 3.606 . 0.507 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.744 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.14 2.94 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 C4'-C3'-C2' 99.611 -3.089 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.469 HO2' " H5'" ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 98.978 -3.722 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.469 " H5'" HO2' ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.638 3.438 . 0.827 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.119 0 C4'-C3'-C2' 99.009 -3.691 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.333 -3.367 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 C4'-C3'-C2' 99.291 -3.409 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.598 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.776 -2.924 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.598 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.423 -3.277 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.6 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 98.856 -3.844 . 0.661 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.6 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 O4'-C1'-N19 111.677 3.477 . 0.695 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.433 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 C4'-C3'-C2' 98.611 -4.089 . 0.805 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.433 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 1 O4'-C1'-N19 112.508 4.308 . 0.818 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.472 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C4'-C3'-C2' 98.844 -3.856 . 0.866 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.822 1 C4'-C3'-C2' 97.5 -5.2 . 0.784 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.452 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 O4'-C1'-N19 111.644 3.444 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo . . . . . 0 N--CA 1.482 0.838 0 N-CA-C 112.897 0.307 . . . . 0.0 112.897 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.8 -179.85 48.72 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.57 171.41 0.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.295 3.33 . . . . 0.0 113.06 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.0 m -136.24 167.82 23.65 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 C-N-CA 123.919 0.888 . . . . 0.0 109.224 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.7 tt 45.46 59.95 14.06 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 111.186 -174.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.27 -29.6 23.63 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.884 3.056 . . . . 0.0 114.225 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.521 HD12 ' HZ1' ' A' ' 17' ' ' LYS . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HZ1' HD12 ' A' ' 13' ' ' LEU . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.43 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.43 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.587 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.587 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.437 HG22 " H1'" ' B' ' 287' ' ' ' U' . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.431 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.456 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.645 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -148.43 55.23 2.04 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.645 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 85.6 Cg_endo -71.89 -23.41 22.2 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.881 3.054 . . . . 0.0 113.355 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -159.2 17.25 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.215 -0.303 . . . . 0.0 111.648 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.07 177.83 8.67 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.812 -0.555 . . . . 0.0 111.158 -175.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 71.2 p -153.66 19.55 0.53 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.832 0.853 . . . . 0.0 111.14 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -144.71 162.04 37.7 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -176.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.58 -174.12 4.52 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.267 0.627 . . . . 0.0 110.369 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -142.45 -178.04 5.56 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.283 0.633 . . . . 0.0 111.37 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.4 tp -140.31 145.4 37.17 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.685 0.794 . . . . 0.0 109.895 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -160.9 -172.04 3.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.331 0.652 . . . . 0.0 110.249 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -141.41 165.82 26.45 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.073 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 170.86 -171.49 43.84 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.4 ptt-85 -147.65 159.58 43.63 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 122.308 0.243 . . . . 0.0 110.749 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.7 t -158.0 177.6 11.15 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.085 0.554 . . . . 0.0 110.081 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.02 8.79 0.84 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 124.824 1.25 . . . . 0.0 112.93 -176.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.8 p -59.57 164.95 3.18 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.94 177.04 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.105 0 C-N-CA 124.268 1.027 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -145.92 175.05 10.73 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.043 0.537 . . . . 0.0 109.656 -177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -140.22 12.85 2.4 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -174.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.6 8.97 0.94 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.736 -0.602 . . . . 0.0 111.66 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -145.14 177.94 8.42 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.234 0.614 . . . . 0.0 109.971 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.8 t -144.47 177.33 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.022 0.529 . . . . 0.0 111.578 -175.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 50.0 m -144.53 -170.55 3.41 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.633 0.773 . . . . 0.0 110.019 -175.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -141.44 169.41 17.65 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.987 0.515 . . . . 0.0 109.953 -177.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -143.22 -176.81 5.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.289 0.636 . . . . 0.0 110.158 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.58 170.18 16.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.2 0.6 . . . . 0.0 109.668 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -154.35 173.46 16.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.972 0.509 . . . . 0.0 110.403 -177.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -142.66 154.31 62.73 Favored Pre-proline 0 C--O 1.233 0.187 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.98 170.37 16.99 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.02 2.48 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -144.58 13.95 1.56 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.314 0.646 . . . . 0.0 110.556 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.8 p -139.63 6.6 2.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.279 0.632 . . . . 0.0 110.803 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 20.6 tp -72.54 173.46 8.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.601 . . . . 0.0 110.456 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -128.49 16.99 6.48 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.935 0.894 . . . . 0.0 111.149 -178.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 67.0 t30 48.06 26.5 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.608 1.163 . . . . 0.0 113.142 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.8 174.89 47.38 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -145.66 8.26 1.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.245 0.618 . . . . 0.0 110.922 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.11 -4.16 1.53 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.895 0.878 . . . . 0.0 110.663 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.7 t -166.25 146.52 5.31 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.82 172.53 15.15 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.046 2.497 . . . . 0.0 109.907 173.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -150.73 -31.91 0.18 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -157.76 -4.43 0.09 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 t -157.45 166.12 33.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.863 0.363 . . . . 0.0 110.136 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -151.75 157.71 34.38 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.567 0.747 . . . . 0.0 109.111 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.9 154.78 72.01 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.938 2.425 . . . . 0.0 109.929 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.88 173.61 13.24 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.179 3.252 . . . . 0.0 111.749 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -147.08 -6.95 0.48 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.399 0.68 . . . . 0.0 111.088 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -155.84 147.62 23.1 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.2 p -160.56 164.69 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.171 0.189 . . . . 0.0 110.733 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -177.59 -26.48 0.04 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 9.3 t 57.15 171.69 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.014 1.325 . . . . 0.0 113.203 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 43.86 25.09 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 17.14 0.07 OUTLIER Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.581 -0.7 . . . . 0.0 112.218 -176.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.14 117.32 7.32 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -154.37 -6.43 0.15 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.706 0.402 . . . . 0.0 110.898 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 36.0 t -158.99 160.66 36.22 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.095 0.958 . . . . 0.0 109.353 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -159.73 173.2 16.39 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.783 0.325 . . . . 0.0 111.22 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 61.5 m -140.27 11.3 2.35 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.544 1.138 . . . . 0.0 110.566 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.6 p -155.34 170.01 22.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.065 0.946 . . . . 0.0 109.402 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.1 m -142.61 4.58 1.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.026 0.53 . . . . 0.0 112.12 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 163.67 -8.76 0.08 OUTLIER Glycine 0 CA--C 1.529 0.968 0 CA-C-N 118.303 0.501 . . . . 0.0 113.247 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -153.26 173.15 15.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.516 0.727 . . . . 0.0 110.883 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.66 158.09 12.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.069 0.547 . . . . 0.0 109.584 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 84.3 p -149.05 15.61 0.93 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.0 tp -148.74 157.31 43.35 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.395 0.678 . . . . 0.0 109.516 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.9 m -61.89 164.71 6.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.948 0.404 . . . . 0.0 111.553 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.69 4.15 1.0 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.743 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.4 p -156.46 158.5 31.47 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -72.44 165.15 33.52 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.433 2.755 . . . . 0.0 110.461 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.9 p -152.49 137.91 11.3 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.92 7.7 2.32 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.91 3.073 . . . . 0.0 112.877 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 50.31 25.07 1.7 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.065 0.946 . . . . 0.0 112.089 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.8 m 54.96 16.51 1.51 Allowed 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 124.757 1.223 . . . . 0.0 113.558 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.36 170.53 14.86 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.1 p -138.81 4.4 2.31 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 123.851 0.86 . . . . 0.0 110.614 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -67.5 157.35 86.13 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 123.44 0.696 . . . . 0.0 110.59 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.36 165.69 29.64 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.051 2.501 . . . . 0.0 110.276 175.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.49 164.41 35.71 Favored 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.716 2.944 . . . . 0.0 110.629 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.75 132.18 91.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.07 140.35 34.35 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 122.298 1.998 . . . . 0.0 110.526 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 9.3 tp -162.08 140.95 7.14 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.99 149.65 72.01 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.4 2.067 . . . . 0.0 109.981 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.99 148.79 28.73 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.612 2.875 . . . . 0.0 112.58 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -78.46 169.26 20.22 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.975 3.117 . . . . 0.0 109.918 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -149.24 152.32 35.73 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.24 163.85 36.87 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.486 2.791 . . . . 0.0 110.249 177.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.92 142.1 34.56 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.503 2.802 . . . . 0.0 111.884 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -78.73 1.1 9.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 124.267 3.311 . . . . 0.0 111.98 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.0 p -144.6 24.15 1.56 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.974 0.51 . . . . 0.0 110.375 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -138.33 -160.52 8.48 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 123.724 0.678 . . . . 0.0 111.836 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -135.74 178.87 6.71 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.709 0.404 . . . . 0.0 110.076 -176.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -52.99 146.11 20.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 123.029 0.532 . . . . 0.0 111.662 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -70.51 -17.85 33.9 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 123.883 3.055 . . . . 0.0 111.935 -175.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.433 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.61 170.7 12.93 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 46.5 m -153.38 161.72 42.03 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.102 0.961 . . . . 0.0 110.205 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.47 174.81 25.06 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 123.502 0.572 . . . . 0.0 111.813 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -78.17 -97.76 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.824 -0.221 . . . . 0.0 111.138 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 48.3 m -149.81 -1.4 0.43 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.219 0.608 . . . . 0.0 110.984 176.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -124.01 4.8 8.64 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.38 0.272 . . . . 0.0 110.845 -176.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 22.57 1.11 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt -58.57 154.78 13.52 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 124.175 0.99 . . . . 0.0 112.482 -172.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.443 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . 0.433 ' HE3' ' P ' ' B' ' 292' ' ' ' C' . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.45 34.64 22.69 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -137.31 -165.68 1.8 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.07 0.948 . . . . 0.0 110.254 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -147.47 -177.52 5.75 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 123.485 0.714 . . . . 0.0 109.468 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 9.6 tp -145.21 6.33 1.13 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 118.389 0.54 . . . . 0.0 112.099 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.8 mt -136.23 164.9 27.01 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.704 -0.622 . . . . 0.0 111.291 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -143.45 170.84 15.04 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.12 0.968 . . . . 0.0 110.115 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 65.7 t60 -157.77 171.94 19.39 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.866 0.866 . . . . 0.0 108.912 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -60.14 160.57 8.02 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.394 0.278 . . . . 0.0 110.582 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.13 -176.69 5.66 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.86 0.464 . . . . 0.0 110.112 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -146.35 -177.84 5.83 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.684 0.794 . . . . 0.0 110.523 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -144.76 168.83 19.27 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.821 0.448 . . . . 0.0 110.548 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 116.786 -1.578 . . . . 0.0 110.441 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.364 -3.336 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.486 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 O4'-C1'-N19 111.678 3.478 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.521 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 O4'-C1'-N19 111.75 3.55 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.598 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.035 0 C4'-C3'-C2' 99.567 -3.133 . 0.801 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.598 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 O4'-C1'-N19 112.541 4.341 . 0.675 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.548 " H5'" HO2' ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.242 1 C4'-C3'-C2' 98.635 -4.065 . 0.708 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.496 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 98.758 -3.942 . 0.632 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.969 0 C4'-C3'-C2' 99.556 -3.144 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.77 -2.93 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 98.947 -3.753 . 0.54 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 O4'-C1'-N19 110.997 2.797 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 C4'-C3'-C2' 98.855 -3.845 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 1 C4'-C3'-C2' 98.659 -4.041 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.173 0 C4'-C3'-C2' 99.634 -3.066 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.51 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 P--O5' 1.615 2.22 0 O4'-C1'-N19 111.11 2.91 . 0.758 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.51 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 C4'-C3'-C2' 99.457 -3.243 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.595 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.602 1 C4'-C3'-C2' 98.698 -4.002 . 0.754 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.595 " H5'" HO2' ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.674 1 C4'-C3'-C2' 98.671 -4.029 . 0.672 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.473 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 98.953 -3.747 . 0.795 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.457 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.253 -3.447 . 0.743 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.517 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.093 0 C4'-C3'-C2' 98.965 -3.735 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.517 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.089 0 C4'-C3'-C2' 99.376 -3.324 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.574 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 O4'-C1'-N19 111.664 3.464 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.574 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C5'-C4'-C3' 110.846 -3.102 . 0.781 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.764 -2.936 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.524 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.168 -3.532 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.524 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.212 1 C4'-C3'-C2' 98.64 -4.06 . 0.729 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.481 -3.219 . 0.907 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.449 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.073 0 C4'-C3'-C2' 100.116 -2.584 . 0.816 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.514 HO2' " H5'" ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 O4'-C1'-N19 111.758 3.558 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.514 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.88 -3.82 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.521 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.358 -3.342 . 0.737 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.521 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C3'-C2'-C1' 104.125 2.916 . 0.715 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.879 1 C5'-C4'-C3' 108.043 -4.972 . 0.166 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.501 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.257 1 C5'-C4'-C3' 108.654 -4.564 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.501 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.111 3 P-O3'-C3' 124.729 4.191 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.449 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.392 0 C4'-C3'-C2' 98.927 -3.773 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.466 HO2' " H5'" ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 O4'-C1'-N19 112.397 4.197 . 0.706 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.466 " H5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.053 -3.647 . 0.58 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 98.911 -3.789 . 0.705 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.462 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C5'-C4'-O4' 113.093 2.781 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.462 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.949 0 C4'-C3'-C2' 99.496 -3.204 . 0.918 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.504 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.481 1 C4'-C3'-C2' 98.147 -4.553 . 0.897 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.504 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.329 -3.371 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.433 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C4'-C3'-C2' 99.106 -3.594 . 0.936 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.433 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 C4'-C3'-C2' 98.78 -3.92 . 0.839 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.964 0 C4'-C3'-C2' 99.794 -2.906 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.446 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.066 0 C4'-C3'-C2' 98.98 -3.72 . 0.903 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.446 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 100.316 -2.384 . 0.876 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.33 1 O4'-C1'-N19 112.813 4.613 . 0.851 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.603 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.424 0 C4'-C3'-C2' 99.283 -3.417 . 0.438 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.603 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.663 -3.037 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.412 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 98.921 -3.779 . 0.881 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.401 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C4'-C3'-C2' 99.383 -3.317 . 0.856 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.61 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 O4'-C1'-N19 111.519 3.319 . 0.595 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.624 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.715 -2.985 . 0.68 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.624 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.387 3.187 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 O4'-C1'-N19 111.55 3.35 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.841 -2.859 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 O4'-C1'-N19 111.486 3.286 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.582 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.795 1 C4'-C3'-C2' 98.59 -4.11 . 0.659 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.582 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.988 0 C4'-C3'-C2' 99.68 -3.02 . 0.561 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.853 0 O4'-C1'-N19 111.332 3.132 . 0.862 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.523 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 100.178 -2.522 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.523 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.095 0 C4'-C3'-C2' 98.893 -3.807 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.442 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 112.055 3.855 . 0.717 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.442 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.46 1 C4'-C3'-C2' 98.195 -4.505 . 0.754 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.557 1 O4'-C1'-N19 112.473 4.273 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.449 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.415 -3.129 0 C4'-C3'-C2' 99.385 -3.315 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.464 HO2' " H5'" ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 1 C4'-C3'-C2' 98.409 -4.291 . 0.764 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.464 " H5'" HO2' ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.135 1 O4'-C1'-N19 112.502 4.302 . 0.783 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 C--O 1.234 0.288 0 N-CA-C 112.742 0.247 . . . . 0.0 112.742 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.33 179.27 48.63 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.886 -0.886 . . . . 0.0 110.886 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.01 -26.2 18.07 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 123.856 3.037 . . . . 0.0 113.149 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.5 p -161.78 153.27 3.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 122.996 0.519 . . . . 0.0 110.133 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.77 158.27 26.9 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -53.35 -33.76 67.65 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.904 3.07 . . . . 0.0 114.899 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.406 ' HH ' ' HB2' ' A' ' 62' ' ' ALA . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.514 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.514 ' H ' HD23 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.481 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.509 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.451 HD12 ' HG ' ' A' ' 26' ' ' SER . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.509 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.481 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.586 HG12 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.574 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.539 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB2' ' HH ' ' A' ' 22' ' ' TYR . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.539 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.708 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -146.94 53.51 1.69 Allowed Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.708 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 74.3 Cg_endo -69.36 -17.35 39.41 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.413 3.408 . . . . 0.0 112.608 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -159.33 -14.94 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 O-C-N 122.054 -0.404 . . . . 0.0 110.836 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.66 29.01 0.6 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.85 1.26 . . . . 0.0 113.071 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.6 m -143.52 21.53 1.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.781 0.433 . . . . 0.0 111.563 -175.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -134.38 14.3 3.8 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.02 0.528 . . . . 0.0 111.996 -175.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.47 161.18 43.14 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.826 0.85 . . . . 0.0 110.069 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 p80 -148.88 10.58 0.81 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.542 0.337 . . . . 0.0 111.745 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -149.61 165.64 31.69 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.48 0.312 . . . . 0.0 110.337 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.99 168.49 25.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.272 0.629 . . . . 0.0 110.029 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 ptm -67.73 170.05 8.55 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.162 -0.336 . . . . 0.0 110.786 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -173.69 31.08 0.1 OUTLIER Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.588 -0.339 . . . . 0.0 112.54 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -134.85 165.93 24.15 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 122.292 -0.534 . . . . 0.0 110.362 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.8 m -144.56 160.78 40.58 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 mp -62.36 159.71 14.77 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.181 0.592 . . . . 0.0 110.912 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -75.71 1.41 14.75 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.492 0.717 . . . . 0.0 112.291 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.2 m -142.93 174.89 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.398 0.679 . . . . 0.0 110.397 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -149.84 172.56 14.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.168 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 50.4 p -140.12 177.53 7.92 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.096 0.559 . . . . 0.0 110.376 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -146.6 176.13 10.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.01 0.524 . . . . 0.0 110.117 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -145.61 166.45 25.72 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.004 0.522 . . . . 0.0 110.979 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -153.42 -179.61 7.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.402 0.681 . . . . 0.0 109.558 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 93.2 p -146.57 169.36 19.13 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 123.736 0.814 . . . . 0.0 110.512 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.9 167.25 29.75 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 120.875 0.369 . . . . 0.0 110.715 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -146.69 176.25 10.0 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.14 161.48 41.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.856 0.462 . . . . 0.0 110.044 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -153.59 1.54 0.25 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 122.914 0.485 . . . . 0.0 111.774 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -150.73 144.27 17.13 Favored Pre-proline 0 N--CA 1.452 -0.356 0 O-C-N 122.085 -0.384 . . . . 0.0 110.033 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.53 167.54 1.98 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.533 2.822 . . . . 0.0 113.642 178.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.12 10.85 0.8 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.655 176.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 t -156.02 -175.52 5.47 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.074 0.95 . . . . 0.0 109.215 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.4 mt -135.98 -177.27 4.62 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.575 1.15 . . . . 0.0 109.924 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -135.83 171.2 14.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.395 0.678 . . . . 0.0 110.054 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -140.66 18.67 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.926 0.49 . . . . 0.0 112.007 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.13 174.6 42.38 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -147.28 -173.45 4.26 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.468 1.107 . . . . 0.0 109.713 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -131.66 7.28 4.44 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.829 0.452 . . . . 0.0 110.97 -177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.3 p -142.87 146.59 38.25 Favored Pre-proline 0 C--O 1.231 0.128 0 C-N-CA 123.656 0.782 . . . . 0.0 109.417 178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.55 154.95 27.73 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.449 2.766 . . . . 0.0 111.591 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -160.43 114.97 2.2 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.896 0.878 . . . . 0.0 108.839 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm 45.86 39.1 5.03 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.621 0.768 . . . . 0.0 111.567 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -130.65 11.34 5.24 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.534 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 13.3 pt-20 -144.29 28.4 0.07 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 123.561 0.744 . . . . 0.0 112.834 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 74.3 Cg_endo -70.35 158.32 56.55 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.066 1.844 . . . . 0.0 111.238 -177.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -74.12 178.45 6.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.815 3.01 . . . . 0.0 111.574 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -136.85 14.39 3.11 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.971 0.908 . . . . 0.0 110.089 177.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -153.57 176.24 12.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.801 1.24 . . . . 0.0 108.691 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.9 t -50.97 137.19 9.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 123.328 0.651 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.41 -19.56 0.09 OUTLIER Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 99.6 p -68.2 163.27 23.11 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 117.889 0.845 . . . . 0.0 111.478 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -153.41 25.35 0.53 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.865 0.466 . . . . 0.0 110.673 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -122.87 20.88 7.6 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -140.28 18.74 2.41 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.601 0.361 . . . . 0.0 111.109 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -144.96 164.38 31.31 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.834 0.853 . . . . 0.0 109.514 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.8 m -154.09 160.92 42.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.557 0.743 . . . . 0.0 110.117 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -153.7 8.3 0.37 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.628 0.771 . . . . 0.0 111.457 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 87.9 p -151.28 8.56 0.54 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 95.4 p -155.62 169.9 23.24 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.054 0.454 . . . . 0.0 110.928 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 88.9 p -77.69 13.35 1.33 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.864 0.865 . . . . 0.0 112.993 179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -61.04 -14.55 39.42 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 123.476 0.56 . . . . 0.0 113.313 -178.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -154.35 162.47 41.15 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.697 0.799 . . . . 0.0 109.56 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.21 0.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 123.253 0.621 . . . . 0.0 110.898 -178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.6 t -76.3 -25.41 54.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.036 0.38 . . . . 0.0 110.715 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.489 HD11 ' H ' ' A' ' 136' ' ' SER . 0.1 OUTLIER -157.72 167.69 29.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.614 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.489 ' H ' HD11 ' A' ' 135' ' ' LEU . 23.3 t -158.87 163.85 36.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.885 0.474 . . . . 0.0 109.782 177.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.0 166.35 33.28 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.389 0.676 . . . . 0.0 110.598 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.1 m -150.96 151.81 30.46 Favored Pre-proline 0 C--N 1.339 0.143 0 C-N-CA 123.137 0.575 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.63 5.32 5.29 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.462 3.441 . . . . 0.0 111.048 173.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.4 m -140.46 166.28 24.32 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 124.799 1.239 . . . . 0.0 109.306 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -49.95 168.89 0.15 Allowed 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.908 3.072 . . . . 0.0 113.209 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 17.79 3.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.384 0.674 . . . . 0.0 110.958 -175.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 71.5 p -132.61 5.74 4.01 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.731 0.813 . . . . 0.0 110.878 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 40.2 tp -148.87 -4.31 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.343 1.057 . . . . 0.0 110.256 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.2 m -148.35 175.54 11.02 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.653 1.181 . . . . 0.0 108.126 -176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -136.92 161.59 60.68 Favored Pre-proline 0 N--CA 1.456 -0.15 0 O-C-N 121.843 -0.536 . . . . 0.0 110.484 -178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -49.06 153.88 3.79 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 124.014 3.142 . . . . 0.0 113.112 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -71.78 166.17 30.3 Favored 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 123.959 3.106 . . . . 0.0 109.893 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.91 156.18 31.05 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 122.882 0.473 . . . . 0.0 110.03 -177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.4 176.05 8.53 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.986 2.457 . . . . 0.0 110.708 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.06 144.32 23.36 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 123.121 0.569 . . . . 0.0 109.69 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.41 154.34 4.19 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.249 2.633 . . . . 0.0 113.3 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.03 167.63 25.51 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.985 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.31 177.49 5.91 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.687 2.925 . . . . 0.0 111.613 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . 0.689 ' H ' ' CD ' ' A' ' 156' ' ' PRO . 84.3 m-85 -139.01 -27.41 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -176.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . 0.689 ' CD ' ' H ' ' A' ' 155' ' ' PHE . 77.0 Cg_exo -51.86 153.96 10.75 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.411 2.074 . . . . 0.0 113.41 177.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.23 169.5 21.38 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 124.158 3.239 . . . . 0.0 110.662 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -54.57 -16.05 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.639 2.893 . . . . 0.0 113.757 177.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 57.0 m 45.28 32.48 1.0 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 124.692 1.197 . . . . 0.0 111.928 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -179.03 -157.27 19.2 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -51.3 147.82 5.38 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.014 0.526 . . . . 0.0 110.417 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -83.39 147.75 53.86 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.531 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.25 -10.63 11.15 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.013 3.142 . . . . 0.0 111.89 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.447 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.449 ' CG ' HG12 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -119.99 172.74 7.53 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 23.1 t -145.25 165.82 27.27 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 82.46 -174.4 53.27 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -174.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -131.14 -53.56 1.04 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 117.382 0.591 . . . . 0.0 111.702 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.1 p -167.24 -33.01 0.02 OUTLIER 'General case' 0 C--N 1.339 0.109 0 C-N-CA 122.787 0.435 . . . . 0.0 111.167 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -64.12 -23.32 67.28 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.157 0.503 . . . . 0.0 109.774 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.33 155.04 26.11 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.228 -1.768 . . . . 0.0 106.228 173.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -155.82 158.28 37.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.316 0.507 . . . . 0.0 111.122 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.449 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.474 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 56.59 35.75 26.55 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.3 mt -137.11 -165.3 1.73 Allowed 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 124.147 0.979 . . . . 0.0 111.06 -176.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.613 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 11.1 t-80 -140.58 -169.15 2.72 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.747 0.819 . . . . 0.0 110.107 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.613 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.2 tp -127.97 170.57 12.71 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.054 0.541 . . . . 0.0 109.7 -176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 228' ' ' LEU . 88.0 mt -54.52 130.92 41.55 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.252 0.621 . . . . 0.0 110.907 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -154.92 13.08 0.39 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.384 0.674 . . . . 0.0 109.985 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -141.62 4.57 1.75 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 122.097 -0.377 . . . . 0.0 111.673 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -77.37 4.07 11.69 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.075 -0.39 . . . . 0.0 110.916 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -61.16 159.07 12.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.653 0.781 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 26.7 p80 -157.63 175.36 14.02 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.952 0.501 . . . . 0.0 110.204 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -151.64 162.78 40.41 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.143 0.577 . . . . 0.0 109.596 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.252 1.204 0 CA-C-O 117.674 -1.155 . . . . 0.0 110.731 179.616 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.487 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.334 -3.366 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.487 " H5'" HO2' ' B' ' 237' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 98.996 -3.704 . 0.699 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.349 -3.351 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.516 -3.184 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.479 HO2' " H5'" ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 O4'-C1'-N19 112.399 4.199 . 0.689 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.485 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.05 -3.65 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.485 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.019 -3.681 . 0.613 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.954 0 C4'-C3'-C2' 99.274 -3.426 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 N19-C1'-C2' 108.745 -2.909 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 99.803 -2.897 . 0.568 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.477 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 C4'-C3'-C2' 99.36 -3.34 . 0.84 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.477 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.098 0 C4'-C3'-C2' 99.11 -3.59 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.425 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.513 -3.187 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.483 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.788 0 C4'-C3'-C2' 99.58 -3.12 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.483 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 O4'-C1'-N19 111.858 3.658 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 C4'-C3'-C2' 99.194 -3.506 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 N19-C1'-C2' 108.926 -2.796 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 99.038 -3.662 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.306 -3.394 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.453 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C4'-C3'-C2' 98.797 -3.903 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.453 " H5'" HO2' ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.966 0 C4'-C3'-C2' 99.477 -3.223 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.554 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 99.507 -3.193 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.554 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.945 3.745 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.304 -3.396 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.193 0 C4'-C3'-C2' 99.332 -3.368 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.811 1 C4'-C3'-C2' 98.697 -4.003 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.41 HO2' " H5'" ' B' ' 264' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.778 -2.922 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.41 " H5'" HO2' ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.926 -3.774 . 0.902 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.52 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.105 -3.595 . 0.758 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.52 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.343 1 O4'-C1'-N19 112.457 4.257 . 0.545 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.493 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 C5'--C4' 1.537 2.074 0 C5'-C4'-O4' 113.604 3.146 . 0.731 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.567 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.534 -3.166 . 0.781 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.567 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 N19-C1'-C2' 109.374 -2.516 . 0.723 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C5'-C4'-C3' 109.979 -3.681 . 0.088 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.121 1 C4'-C3'-C2' 98.364 -4.336 . 0.404 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.08 1 C5'-C4'-C3' 108.43 -4.713 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.407 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.355 0 C4'-C3'-C2' 99.413 -3.287 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.407 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 111.655 3.455 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.51 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 98.703 -3.997 . 0.698 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.51 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 98.84 -3.86 . 0.699 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.574 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 112.046 3.846 . 0.54 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.492 " H5'" HO2' ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.843 0 O4'-C1'-N19 110.807 2.607 . 0.946 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.436 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.128 1 C4'-C3'-C2' 98.695 -4.005 . 0.845 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.436 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C4'-C3'-C2' 99.456 -3.244 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.844 0 C4'-C3'-C2' 99.013 -3.687 . 0.926 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C4'-C3'-C2' 99.288 -3.412 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.954 -2.746 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.007 0 C4'-C3'-C2' 99.301 -3.399 . 0.904 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C4'-C3'-C2' 100.249 -2.451 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.474 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.408 -3.71 1 O4'-C1'-N19 113.014 4.814 . 0.612 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.474 " H5'" HO2' ' B' ' 286' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C4'-C3'-C2' 99.196 -3.504 . 0.624 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.536 HO2' " H5'" ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C4'-C3'-C2' 99.613 -3.087 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.536 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.909 0 C4'-C3'-C2' 99.388 -3.312 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.601 HO2' " H5'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 98.867 -3.833 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.603 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C4'-C3'-C2' 99.101 -3.599 . 0.523 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.603 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C4'-C3'-C2' 99.854 -2.846 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.576 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.431 -3.269 . 0.609 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.228 0 O4'-C1'-N19 111.91 3.71 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.434 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 O4'-C1'-N19 112.108 3.908 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.434 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 P--O5' 1.621 2.788 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.05 -3.65 . 0.675 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.407 HO2' " H5'" ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 O4'-C1'-N19 112.223 4.023 . 0.644 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.447 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.958 -2.742 . 0.888 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.488 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 100.572 -2.128 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.488 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C4'-C3'-C2' 99.167 -3.533 . 0.614 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.454 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.229 -3.471 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.454 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.497 1 C4'-C3'-C2' 98.205 -4.495 . 0.814 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.11 2 O4'-C1'-N19 112.483 4.283 . 0.836 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.491 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.248 -3.452 . 0.831 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.491 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 C4'-C3'-C2' 97.84 -4.86 . 0.691 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 O4'-C1'-N19 112.167 3.967 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo . . . . . 0 N--CA 1.471 0.162 0 N-CA-C 112.533 0.166 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.89 176.09 47.89 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 120.174 -0.237 . . . . 0.0 112.541 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.8 171.4 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 1 C-N-CA 125.426 4.084 . . . . 0.0 113.853 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.47 177.68 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.602 0.761 . . . . 0.0 110.37 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -139.18 78.66 27.98 Favored Pre-proline 0 N--CA 1.454 -0.243 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -51.46 -23.81 15.12 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 124.284 3.323 . . . . 0.0 111.705 175.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.485 HD22 ' HH ' ' A' ' 22' ' ' TYR . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.485 ' HH ' HD22 ' A' ' 13' ' ' LEU . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.416 ' H ' HD23 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.485 ' HG ' HD13 ' A' ' 35' ' ' LEU . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.485 HD13 ' HG ' ' A' ' 26' ' ' SER . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.409 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' A' ' 44' ' ' GLY . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 42' ' ' VAL . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.409 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.4 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.554 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -147.89 64.2 8.15 Favored Pre-proline 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -74.87 -5.07 16.34 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.128 3.219 . . . . 0.0 111.405 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -155.34 164.0 39.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.43 0.692 . . . . 0.0 109.506 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.91 16.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.511 0.324 . . . . 0.0 111.815 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -138.84 -3.45 1.63 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -153.78 2.95 0.27 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.272 0.487 . . . . 0.0 111.366 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.66 -11.43 60.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 121.894 -0.504 . . . . 0.0 111.568 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 47.49 25.23 0.59 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 124.887 1.275 . . . . 0.0 113.372 -176.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.1 mt -145.34 172.42 13.19 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.821 1.248 . . . . 0.0 109.814 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.48 23.25 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.339 0.656 . . . . 0.0 110.391 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.9 ptm -147.83 -179.86 7.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.451 0.701 . . . . 0.0 110.518 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -158.15 -174.21 27.56 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -74.61 19.84 0.13 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.605 1.162 . . . . 0.0 112.589 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.4 p -57.3 166.01 1.29 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.113 0.565 . . . . 0.0 111.853 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 pp -152.06 -174.1 4.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.521 0.729 . . . . 0.0 110.505 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.8 p -144.86 171.72 14.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.657 0.741 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.472 HG21 ' H ' ' A' ' 90' ' ' THR . 10.8 p -153.18 168.07 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.471 0.709 . . . . 0.0 109.295 -177.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -144.88 15.29 1.55 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.75 0.42 . . . . 0.0 111.266 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.472 ' H ' HG21 ' A' ' 88' ' ' VAL . 70.2 p -78.14 21.32 0.34 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.205 1.002 . . . . 0.0 112.817 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -139.88 159.76 41.45 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.706 0.402 . . . . 0.0 110.553 -176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -152.25 170.53 19.8 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -154.74 171.18 19.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.0 m -145.24 174.74 10.82 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.314 0.578 . . . . 0.0 111.363 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -150.11 167.94 25.37 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -56.86 144.65 32.48 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.33 0.652 . . . . 0.0 111.358 -177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.62 15.37 0.77 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.933 0.493 . . . . 0.0 111.88 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.4 t70 62.63 2.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.527 1.531 . . . . 0.0 113.032 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 34.9 t80 31.02 64.11 1.0 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.539 1.536 . . . . 0.0 113.084 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -71.67 1.24 5.9 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 124.096 3.197 . . . . 0.0 112.42 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.7 -1.25 3.57 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 122.093 -0.379 . . . . 0.0 111.389 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -146.68 175.73 10.39 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.873 0.869 . . . . 0.0 110.016 177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -134.86 -1.25 2.73 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.603 0.361 . . . . 0.0 111.952 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 41.5 t80 49.16 23.36 0.76 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.43 1.092 . . . . 0.0 113.359 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -148.4 13.81 0.97 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.565 0.346 . . . . 0.0 111.024 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.86 172.47 43.77 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -156.75 -172.02 3.89 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.269 0.628 . . . . 0.0 109.766 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.84 -9.8 10.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.242 1.017 . . . . 0.0 112.021 178.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -59.83 156.12 37.32 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.07 0.548 . . . . 0.0 111.223 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -73.91 177.36 8.24 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.497 2.798 . . . . 0.0 111.619 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -147.61 170.1 18.22 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.337 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -141.7 162.5 35.32 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-O 121.435 0.636 . . . . 0.0 111.645 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -154.73 -1.63 0.17 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.841 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.417 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 31.0 mp0 -68.57 -41.8 24.12 Favored Pre-proline 0 N--CA 1.448 -0.527 0 C-N-CA 124.219 1.007 . . . . 0.0 112.754 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 94.2 Cg_endo -76.72 162.23 32.89 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.263 1.975 . . . . 0.0 111.109 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.12 174.17 11.78 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.288 3.325 . . . . 0.0 111.423 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -143.51 12.63 1.73 Allowed 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.155 0.582 . . . . 0.0 110.911 178.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -149.99 151.68 33.71 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.407 0.683 . . . . 0.0 109.248 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -148.48 174.09 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 C-N-CA 123.015 0.526 . . . . 0.0 110.62 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -169.5 12.3 0.05 OUTLIER Glycine 0 CA--C 1.531 1.043 0 CA-C-O 119.588 -0.562 . . . . 0.0 112.207 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t 55.66 -178.59 0.04 OUTLIER 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.446 1.099 . . . . 0.0 112.161 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 54.0 p30 -150.7 13.45 0.72 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.411 0.684 . . . . 0.0 110.941 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -172.9 7.71 0.03 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.935 -0.369 . . . . 0.0 112.951 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -151.86 178.62 9.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.097 0.948 . . . . 0.0 109.008 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.74 -1.73 0.87 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.19 0.596 . . . . 0.0 111.599 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 75.3 m -147.58 167.17 25.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.496 0.718 . . . . 0.0 110.211 178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -159.98 162.88 34.44 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.349 0.66 . . . . 0.0 110.37 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 81.6 p -159.7 171.31 19.79 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.532 0.733 . . . . 0.0 110.403 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 81.3 p -155.02 173.28 16.8 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.023 0.529 . . . . 0.0 110.304 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 40.3 m 46.84 28.57 0.85 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.037 0.935 . . . . 0.0 112.884 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.95 178.92 39.85 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.708 -0.957 . . . . 0.0 110.708 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -147.94 166.79 26.61 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.077 0.551 . . . . 0.0 110.482 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.76 145.18 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.192 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.7 m 46.71 26.58 0.56 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.486 1.114 . . . . 0.0 113.721 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -142.79 4.71 1.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 117.989 0.359 . . . . 0.0 111.245 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 44.9 m -142.47 15.46 2.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.89 0.476 . . . . 0.0 111.018 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.96 13.99 1.03 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.888 0.475 . . . . 0.0 110.901 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -58.8 146.86 74.05 Favored Pre-proline 0 CA--C 1.531 0.246 0 O-C-N 122.055 -0.403 . . . . 0.0 110.75 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.59 -26.67 56.22 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.005 3.137 . . . . 0.0 113.811 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -149.62 153.88 37.23 Favored Pre-proline 0 C--O 1.232 0.164 0 C-N-CA 123.158 0.583 . . . . 0.0 110.022 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -78.64 1.0 9.47 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.94 3.093 . . . . 0.0 111.56 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.09 -172.29 0.06 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.483 1.113 . . . . 0.0 112.558 -176.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.1 t -152.95 176.04 12.28 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.182 0.593 . . . . 0.0 110.002 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.88 6.57 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.947 0.899 . . . . 0.0 110.531 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.5 t -154.79 151.32 28.52 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 13.9 pt20 -159.65 35.55 0.05 OUTLIER Pre-proline 0 CA--C 1.545 0.759 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 61.5 Cg_endo -67.24 162.7 37.38 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.203 1.935 . . . . 0.0 110.847 -177.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.28 153.77 4.36 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.472 3.448 . . . . 0.0 113.7 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.62 68.08 5.6 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.71 166.79 27.61 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.827 3.018 . . . . 0.0 110.615 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.1 pt -144.19 158.48 54.95 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.292 0.637 . . . . 0.0 110.177 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.78 162.2 3.9 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.832 3.021 . . . . 0.0 113.222 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.44 158.88 3.52 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 124.267 3.311 . . . . 0.0 112.353 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.38 170.8 18.37 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.534 2.822 . . . . 0.0 110.3 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 42.41 50.53 5.36 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.951 0.9 . . . . 0.0 113.168 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.02 161.57 45.46 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.474 2.783 . . . . 0.0 111.068 -177.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.79 161.08 46.17 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.972 2.448 . . . . 0.0 109.939 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.3 154.89 56.38 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.991 3.127 . . . . 0.0 110.609 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 56.4 m -147.24 9.01 0.94 Allowed 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.426 0.69 . . . . 0.0 110.433 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.48 -168.26 40.22 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -139.96 168.82 18.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.935 0.894 . . . . 0.0 109.592 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -59.2 142.39 86.09 Favored Pre-proline 0 CA--C 1.531 0.23 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo -75.86 -10.45 19.84 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 124.077 3.185 . . . . 0.0 111.77 -178.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . 0.45 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.583 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.458 ' CG ' HG11 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.41 171.91 10.07 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -159.47 161.37 35.43 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.057 0.543 . . . . 0.0 109.998 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 98.5 171.78 32.0 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -79.89 170.31 16.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.867 0.467 . . . . 0.0 110.398 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.9 m -63.72 -0.77 1.09 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.708 0.803 . . . . 0.0 112.766 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 51.8 p-80 -128.67 11.05 6.16 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.298 0.499 . . . . 0.0 110.718 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.6 20.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.91 157.61 14.91 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.96 1.304 . . . . 0.0 113.373 -172.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.4 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.458 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.583 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 55.99 25.35 8.66 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.0 mt -123.06 -167.07 1.54 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.51 1.124 . . . . 0.0 111.01 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.537 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 25.1 t-80 -143.18 -175.61 4.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.537 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 3.3 tp -136.88 17.3 3.04 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 52.52 -155.32 0.18 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.326 1.05 . . . . 0.0 111.033 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.99 15.97 7.35 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.698 0.799 . . . . 0.0 110.869 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 52.23 21.08 1.52 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.93 1.292 . . . . 0.0 113.132 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.6 t60 -59.89 153.68 20.41 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.798 -0.564 . . . . 0.0 110.185 176.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . 0.427 ' C ' ' H ' ' A' ' 235' ' ' HIS . 7.9 t60 -73.58 166.51 23.12 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.974 0.416 . . . . 0.0 111.659 -177.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -74.32 16.67 0.23 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.701 0.8 . . . . 0.0 111.897 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 233' ' ' HIS . 71.6 t60 -65.25 -5.93 8.33 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.872 0.869 . . . . 0.0 112.55 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 54.9 t60 . . . . . 0 C--O 1.25 1.122 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.201 -179.596 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 C4'-C3'-C2' 99.308 -3.392 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.464 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.394 0 C4'-C3'-C2' 99.24 -3.46 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.522 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.468 0 C4'-C3'-C2' 99.824 -2.876 . 0.833 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.522 " H5'" HO2' ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.19 -3.51 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.764 1 O4'-C1'-N19 112.264 4.064 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 98.962 -3.738 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.421 HO2' " H5'" ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.172 -3.528 . 0.699 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.421 " H5'" HO2' ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C4'-C3'-C2' 99.44 -3.26 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 99.011 -3.689 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 O4'-C1'-N19 111.789 3.589 . 0.408 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.509 0 O4'-C1'-N19 111.644 3.444 . 0.789 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 C4'-C3'-C2' 99.717 -2.983 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.427 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.479 3.279 . 0.82 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.504 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.351 -3.349 . 0.74 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.552 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.235 -3.465 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.552 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.332 -3.368 . 0.658 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.507 -3.193 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 99.04 -3.66 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.602 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 C4'-C3'-C2' 99.2 -3.5 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.602 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 99.103 -3.597 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.467 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 98.879 -3.821 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.575 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.315 -3.385 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.576 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.493 1 C4'-C3'-C2' 98.494 -4.206 . 0.713 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.576 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C5'-C4'-C3' 109.968 -3.688 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.554 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.802 3.602 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.405 " H5'" HO2' ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.013 -3.687 . 0.804 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 99.092 -3.608 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.035 -3.665 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 C4'-C3'-C2' 99.19 -3.51 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.478 -3.222 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.361 0 C4'-C3'-C2' 99.462 -3.238 . 0.693 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.113 1 C4'-C3'-C2' 98.549 -4.151 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.421 1 C4'-C3'-C2' 98.607 -4.093 . 0.741 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.567 0 C5'-C4'-C3' 111.61 -2.594 . 0.6 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.416 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.54 2.304 1 C5'-C4'-C3' 108.067 -4.955 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.584 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.239 1 P-O3'-C3' 125.039 4.449 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.616 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.624 3.111 1 C4'-C3'-C2' 97.174 -5.526 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.631 HO2' " C5'" ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.41 -3.577 0 N19-C1'-C2' 119.673 3.921 . 0.377 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.631 " C5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 99.163 -3.537 . 0.5 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 1 C4'-C3'-C2' 98.637 -4.063 . 0.866 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.554 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.945 0 N19-C1'-C2' 107.748 -3.532 . 0.603 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.45 HO2' " H5'" ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.501 0 O4'-C1'-N19 110.769 2.569 . 0.925 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.478 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.16 1 C4'-C3'-C2' 98.312 -4.388 . 0.824 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.478 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 C4'-C3'-C2' 99.376 -3.324 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.409 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 98.966 -3.734 . 0.886 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.462 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.716 0 C4'-C3'-C2' 99.402 -3.298 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.477 HO2' " H5'" ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.879 -2.821 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.477 " H5'" HO2' ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 99.167 -3.533 . 0.867 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.425 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 100.393 -2.307 . 0.856 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.463 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.846 1 O4'-C1'-N19 112.998 4.798 . 0.571 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.463 " H5'" HO2' ' B' ' 286' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C4'-C3'-C2' 98.932 -3.768 . 0.561 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.555 HO2' " H5'" ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 C4'-C3'-C2' 99.998 -2.702 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.555 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C4'-C3'-C2' 99.222 -3.478 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.623 HO2' " H5'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 O4'-C1'-N19 111.824 3.624 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.633 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 O4'-C1'-N19 111.102 2.902 . 0.346 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.633 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.623 -3.077 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.551 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.54 -3.16 . 0.576 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.484 HO2' " H5'" ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.659 3.459 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.484 " H5'" HO2' ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 O4'-C1'-N19 111.814 3.614 . 0.725 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.605 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 C4'-C3'-C2' 99.299 -3.401 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.614 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 C4'-C3'-C2' 99.148 -3.552 . 0.671 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.614 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.693 0 O4'-C1'-N19 111.282 3.082 . 0.502 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.245 0 C4'-C3'-C2' 99.757 -2.943 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.524 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.47 -3.23 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.524 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.014 -3.686 . 0.69 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 C4'-C3'-C2' 98.898 -3.802 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.422 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.82 1 C4'-C3'-C2' 98.315 -4.385 . 0.775 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.422 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 O4'-C1'-N19 112.106 3.906 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.452 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.259 -3.441 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.452 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.542 1 C4'-C3'-C2' 97.792 -4.908 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.439 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.273 0 O4'-C1'-N19 111.382 3.182 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo . . . . . 0 N--CA 1.476 0.484 0 CA-C-O 119.745 -0.189 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.31 -179.46 45.86 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 120.079 -0.29 . . . . 0.0 112.422 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.38 179.97 5.87 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 124.769 3.646 . . . . 0.0 110.993 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -141.77 11.03 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.344 0.657 . . . . 0.0 111.897 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -152.32 153.58 31.03 Favored Pre-proline 0 CA--C 1.535 0.389 0 O-C-N 121.96 -0.462 . . . . 0.0 111.412 -177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.67 -25.32 41.3 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 124.02 3.147 . . . . 0.0 115.376 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.525 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.525 ' HB3' ' CG ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.457 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.457 ' H ' HD21 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.473 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.426 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.2 tp-100 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.426 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.473 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.442 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.413 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.46 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.46 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -150.01 63.18 6.08 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.63 -22.67 17.81 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.569 2.846 . . . . 0.0 112.68 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -165.22 -15.42 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -156.22 177.94 10.87 Favored 'General case' 0 CA--C 1.527 0.061 0 CA-C-O 121.116 0.484 . . . . 0.0 111.36 -175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 46.4 m -140.36 3.51 1.94 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.457 1.103 . . . . 0.0 110.616 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -143.03 169.43 17.59 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.602 0.761 . . . . 0.0 110.403 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -153.6 14.88 0.5 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.585 0.354 . . . . 0.0 111.869 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.86 165.12 29.04 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 122.615 0.366 . . . . 0.0 110.74 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -156.41 156.27 33.55 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.43 176.53 10.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.353 0.661 . . . . 0.0 109.806 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -131.7 11.15 4.78 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.691 0.796 . . . . 0.0 111.115 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -175.49 175.98 47.3 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -142.23 167.87 21.09 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.379 0.672 . . . . 0.0 109.906 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.2 p -144.31 11.38 1.51 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.013 0.925 . . . . 0.0 110.234 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.53 -179.1 7.1 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.452 0.701 . . . . 0.0 110.698 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 51.2 m -139.87 168.87 18.83 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.312 1.045 . . . . 0.0 109.935 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.4 m -143.22 170.01 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.646 0.778 . . . . 0.0 110.882 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -156.13 167.37 30.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.904 0.882 . . . . 0.0 109.773 -177.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.8 p -69.41 154.17 42.44 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.301 -0.249 . . . . 0.0 110.476 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -159.93 166.65 29.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.231 0.613 . . . . 0.0 109.867 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -152.44 176.84 11.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.173 0.589 . . . . 0.0 110.685 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.5 t -149.33 178.0 9.17 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.945 0.498 . . . . 0.0 110.734 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 96' ' ' GLN . 49.7 m -138.61 10.63 2.7 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.945 0.898 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.12 5.21 0.73 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.887 0.875 . . . . 0.0 112.206 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' H ' ' C ' ' A' ' 94' ' ' SER . 81.0 mt-30 -136.24 18.99 3.17 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.763 0.825 . . . . 0.0 110.618 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.64 171.77 14.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.159 0.584 . . . . 0.0 111.485 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -156.11 161.95 40.31 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.367 0.667 . . . . 0.0 110.353 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -153.8 110.33 2.53 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.69 160.54 37.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.776 2.318 . . . . 0.0 110.726 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.75 27.36 0.33 Allowed 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 110.249 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 p -130.74 24.05 5.03 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.304 0.641 . . . . 0.0 111.667 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.54 172.24 12.96 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.303 0.641 . . . . 0.0 111.657 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.62 175.26 11.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.376 0.67 . . . . 0.0 109.721 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -140.77 9.18 2.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.991 0.516 . . . . 0.0 111.554 -177.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.08 -0.93 55.07 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.32 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -71.92 4.53 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.916 0.858 . . . . 0.0 112.674 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -144.57 138.46 27.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.001 0.52 . . . . 0.0 109.964 -178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 75.2 p -151.35 163.63 22.97 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.164 0.585 . . . . 0.0 109.906 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -55.18 -12.9 5.96 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.786 2.991 . . . . 0.0 113.479 175.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -77.02 -5.5 49.0 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.198 0.599 . . . . 0.0 111.749 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -138.42 0.24 2.06 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -159.22 145.94 16.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.151 0.58 . . . . 0.0 109.757 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 35.18 59.35 2.54 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.789 1.236 . . . . 0.0 113.396 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.84 155.67 7.9 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.728 2.286 . . . . 0.0 112.65 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -74.15 172.11 16.65 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.592 2.861 . . . . 0.0 110.426 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -61.88 -17.64 57.29 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.825 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -70.54 -0.4 8.44 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 122.965 0.506 . . . . 0.0 111.414 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.6 t -138.92 19.31 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 124.409 1.083 . . . . 0.0 108.343 -177.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.72 10.58 6.73 Favored Glycine 0 CA--C 1.534 1.229 0 N-CA-C 111.792 -0.523 . . . . 0.0 111.792 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.9 t -153.2 169.01 24.06 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.516 0.727 . . . . 0.0 110.065 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -146.43 174.86 11.01 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.153 0.581 . . . . 0.0 110.27 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -176.8 38.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.1 166.1 23.84 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 117.2 0.5 . . . . 0.0 110.953 -175.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -148.99 167.26 26.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.391 0.676 . . . . 0.0 109.998 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 88.9 p -151.46 -179.59 7.52 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.182 0.593 . . . . 0.0 111.113 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -147.49 169.47 19.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.877 0.871 . . . . 0.0 110.009 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.0 p -156.43 -178.75 7.56 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.006 0.432 . . . . 0.0 111.463 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -140.92 17.02 2.3 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.306 1.042 . . . . 0.0 110.598 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.9 m -146.39 175.26 10.68 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 124.492 1.117 . . . . 0.0 109.344 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -169.4 10.67 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 CA-C-O 119.599 -0.556 . . . . 0.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.47 158.77 28.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.106 0.953 . . . . 0.0 111.08 178.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.8 m -148.18 167.34 4.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 124.039 0.936 . . . . 0.0 109.724 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 85.1 p -152.01 6.56 0.45 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.76 0.424 . . . . 0.0 111.802 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.5 tp -154.2 152.6 30.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.164 0.586 . . . . 0.0 109.908 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.7 t -155.21 168.09 28.2 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.07 6.59 0.88 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.486 0.715 . . . . 0.0 111.008 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -67.94 166.7 21.37 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 124.166 0.986 . . . . 0.0 111.161 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.02 -177.66 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 125.075 3.85 . . . . 0.0 113.605 173.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.1 p -133.51 143.16 46.78 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.416 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.34 158.23 3.93 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 124.138 3.226 . . . . 0.0 113.572 177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.22 17.42 0.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.162 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.3 m -140.77 -178.26 5.45 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.419 0.687 . . . . 0.0 109.664 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 70.8 mt 55.79 14.61 1.37 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.063 0.945 . . . . 0.0 112.568 -176.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 32.3 p -142.1 0.26 1.35 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.31 1.044 . . . . 0.0 110.589 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -76.11 164.88 57.29 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 123.934 0.894 . . . . 0.0 109.911 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -51.82 162.47 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 124.002 3.135 . . . . 0.0 112.557 174.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.32 -8.06 22.04 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.405 2.736 . . . . 0.0 112.327 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.9 mt 33.63 64.48 1.49 Allowed Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 125.408 1.483 . . . . 0.0 112.439 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.02 -4.87 15.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.22 2.613 . . . . 0.0 112.291 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 26.3 pt -144.22 149.17 44.06 Favored Pre-proline 0 C--O 1.235 0.308 0 C-N-CA 123.108 0.563 . . . . 0.0 109.684 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -76.18 163.21 33.08 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 123.589 2.86 . . . . 0.0 110.9 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.75 167.73 26.42 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.538 2.826 . . . . 0.0 109.756 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.55 161.62 45.17 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.731 2.288 . . . . 0.0 110.538 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -153.86 160.99 30.32 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 110.124 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.89 152.54 9.81 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.469 3.446 . . . . 0.0 112.788 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.89 167.28 27.71 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.252 2.634 . . . . 0.0 111.006 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.87 176.31 7.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 123.428 2.752 . . . . 0.0 110.254 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 22.9 t -148.0 171.64 15.49 Favored 'General case' 0 C--O 1.232 0.14 0 O-C-N 122.077 -0.389 . . . . 0.0 111.081 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.12 29.05 0.19 Allowed Glycine 0 CA--C 1.532 1.148 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -136.77 -167.99 2.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.847 1.259 . . . . 0.0 108.962 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -130.22 82.12 66.64 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-O 121.667 0.746 . . . . 0.0 110.326 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -83.4 -12.32 9.14 Favored 'Trans proline' 0 N--CA 1.449 -1.13 1 C-N-CA 125.66 4.24 . . . . 0.0 110.483 -175.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . 0.41 ' C ' ' H ' ' A' ' 173' ' ' GLY . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 171' ' ' ARG . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.469 ' CG ' HG11 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.54 169.35 17.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 32.8 t -155.76 163.64 39.59 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.76 177.43 18.91 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 123.45 0.548 . . . . 0.0 112.383 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.98 164.22 26.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 122.871 0.469 . . . . 0.0 110.149 176.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.2 m -63.34 4.61 0.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.037 0.935 . . . . 0.0 113.41 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -138.8 16.97 2.68 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.82 1.21 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.935 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -57.74 166.57 1.35 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.158 0.583 . . . . 0.0 111.487 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.469 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 50.79 24.47 1.75 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.27 102.7 5.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.465 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 20.4 t-80 -65.07 -175.37 0.2 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.244 1.018 . . . . 0.0 111.5 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.465 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 14.3 tp -133.38 9.02 4.0 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 99.1 mt -132.24 9.16 4.4 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.796 -0.565 . . . . 0.0 111.865 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.26 173.82 5.33 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.149 0.431 . . . . 0.0 110.369 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -146.69 165.45 29.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.193 0.52 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -82.95 5.66 21.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.327 1.051 . . . . 0.0 112.065 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -140.19 155.07 47.08 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.576 -0.703 . . . . 0.0 109.553 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -146.28 21.39 1.37 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.945 0.498 . . . . 0.0 111.904 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -132.78 25.69 4.34 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 123.207 0.603 . . . . 0.0 110.657 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.902 179.525 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.166 0 C5'-C4'-O4' 114.097 3.498 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.461 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 O4'-C1'-N19 111.693 3.493 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.461 " H5'" HO2' ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.143 2.943 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.527 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.157 0 C4'-C3'-C2' 99.567 -3.133 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.527 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.406 4.206 . 0.592 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.56 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 C4'-C3'-C2' 98.773 -3.927 . 0.72 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.56 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.057 0 O4'-C1'-N19 111.984 3.784 . 0.696 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 C4'-C3'-C2' 99.135 -3.565 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.44 HO2' " H5'" ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.752 -2.948 . 0.732 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.568 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.398 0 C4'-C3'-C2' 99.176 -3.524 . 0.667 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.568 " H5'" HO2' ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C4'-C3'-C2' 99.517 -3.183 . 0.722 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.344 -3.356 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.661 -3.039 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 C4'-C3'-C2' 99.406 -3.294 . 0.728 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.517 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 C4'-C3'-C2' 99.033 -3.667 . 0.813 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.517 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 99.23 -3.47 . 0.654 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.463 -3.237 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 0 C4'-C3'-C2' 99.162 -3.538 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.588 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.019 0 C4'-C3'-C2' 99.595 -3.105 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.588 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.591 0 C4'-C3'-C2' 99.998 -2.702 . 0.749 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.461 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.991 0 C4'-C3'-C2' 99.392 -3.308 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.495 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.336 -3.364 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.608 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.217 0 C4'-C3'-C2' 98.957 -3.743 . 0.793 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.608 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.737 -2.963 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.529 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 O4'-C1'-N19 111.354 3.154 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-C2' 99.118 -3.582 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.81 1 C4'-C3'-C2' 98.138 -4.562 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.485 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.365 -3.335 . 0.874 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.485 " H5'" HO2' ' B' ' 264' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 100.341 -2.359 . 0.755 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.448 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.545 -3.155 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.531 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 N19-C1'-C2' 108.824 -2.86 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.531 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.295 -3.405 . 0.716 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.965 1 O4'-C1'-N19 112.203 4.003 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.461 0 C5'-C4'-C3' 112.13 -2.247 . 0.417 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C5'-C4'-C3' 107.578 -5.281 . 0.394 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.498 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.182 2 C5'-C4'-C3' 108.459 -4.694 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.574 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.747 -2.953 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.717 HO2' " H5'" ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.885 1 N19-C1'-C2' 121.254 4.908 . 0.417 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.717 " H5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 C5'--C4' 1.544 2.622 0 O4'-C1'-N19 111.994 3.794 . 0.545 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.475 -3.225 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.534 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.003 0 C4'-C3'-C2' 99.819 -2.881 . 0.572 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.534 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.413 -3.319 0 C4'-C3'-C2' 99.179 -3.521 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.741 1 C4'-C3'-C2' 98.51 -4.19 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.215 -3.485 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.45 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C4'-C3'-C2' 98.801 -3.899 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.45 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.795 -2.905 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.443 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 100.174 -2.526 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.469 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.404 -3.296 . 0.829 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.469 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C5'-C4'-C3' 111.797 -2.468 . 0.885 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 1 O4'-C1'-N19 113.072 4.872 . 0.553 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.629 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.173 -3.527 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.629 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 C5'-C4'-C3' 112.141 -2.24 . 0.764 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.546 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.388 0 O4'-C1'-N19 111.721 3.521 . 0.776 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.475 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 O4'-C1'-N19 111.741 3.541 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.637 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.764 0 O4'-C1'-N19 111.616 3.416 . 0.544 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.637 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 C4'-C3'-C2' 98.878 -3.822 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.542 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.8 0 C4'-C3'-C2' 99.635 -3.065 . 0.641 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.362 1 O4'-C1'-N19 112.329 4.129 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.41 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 C4'-C3'-C2' 99.092 -3.608 . 0.84 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.554 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.397 0 O4'-C1'-N19 111.681 3.481 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.558 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.849 -3.851 . 0.641 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.558 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.867 -3.833 . 0.542 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 111.163 2.963 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.808 -2.892 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.534 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C4'-C3'-C2' 98.839 -3.861 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.534 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.362 0 C4'-C3'-C2' 98.924 -3.776 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.465 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C4'-C3'-C2' 98.712 -3.988 . 0.758 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.888 3.688 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 99.379 -3.321 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.426 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.617 2.352 1 C4'-C3'-C2' 98.202 -4.498 . 0.813 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.426 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.535 0 O4'-C1'-N19 111.41 3.21 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo . . . . . 0 CA--C 1.53 0.303 0 N-CA-C 112.699 0.231 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.7 -64.49 0.07 OUTLIER Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.383 -178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.08 -7.17 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.693 3.595 . . . . 0.0 114.495 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.62 11.85 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.814 0.846 . . . . 0.0 110.811 -177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.9 tp -150.56 69.83 8.77 Favored Pre-proline 0 N--CA 1.454 -0.249 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.3 -25.37 9.82 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 124.514 3.476 . . . . 0.0 113.756 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.506 HD13 ' HZ2' ' A' ' 17' ' ' LYS . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.506 ' HZ2' HD13 ' A' ' 13' ' ' LEU . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.438 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.437 ' CE1' HD23 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.457 ' CB ' HG21 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.5 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.5 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.457 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.418 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.556 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 9.8 t-160 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.69 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -146.87 57.83 3.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.69 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -72.84 -15.23 26.66 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 124.103 3.202 . . . . 0.0 114.351 -175.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -155.55 -13.71 0.11 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.716 0.689 . . . . 0.0 112.389 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -153.68 171.42 18.85 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.5 t -157.99 161.89 38.16 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.15 14.22 0.7 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.48 1.112 . . . . 0.0 109.449 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.01 -178.32 6.22 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.443 1.097 . . . . 0.0 109.836 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -147.41 177.74 8.99 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.033 0.533 . . . . 0.0 110.564 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.97 157.46 43.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.322 0.649 . . . . 0.0 109.359 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.17 179.55 8.0 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.365 0.666 . . . . 0.0 110.751 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 76.0 mtm -142.75 177.97 7.96 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.338 0.655 . . . . 0.0 110.167 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.85 179.32 38.37 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.359 0.504 . . . . 0.0 112.404 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -138.38 169.24 18.13 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.475 0.71 . . . . 0.0 109.531 -177.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -156.29 179.17 9.49 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.622 0.769 . . . . 0.0 110.039 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 pp -143.41 177.85 8.16 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.987 0.515 . . . . 0.0 110.691 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.6 p -155.35 -176.95 6.2 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.594 0.358 . . . . 0.0 110.648 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.6 p -139.61 156.63 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -148.49 20.24 1.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.796 0.438 . . . . 0.0 110.814 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -145.87 175.3 10.52 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 122.927 0.491 . . . . 0.0 110.203 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.3 176.39 10.03 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.448 0.699 . . . . 0.0 110.678 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -150.13 -178.73 6.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.021 0.928 . . . . 0.0 110.324 -177.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.8 p -137.56 176.75 8.43 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.182 0.593 . . . . 0.0 110.364 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.7 m -143.39 -177.11 5.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.913 0.485 . . . . 0.0 110.695 -177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -53.5 157.52 2.09 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.296 1.038 . . . . 0.0 112.009 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -133.97 -176.18 4.09 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.931 0.892 . . . . 0.0 110.114 -173.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.32 172.15 13.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.088 0.47 . . . . 0.0 110.448 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -153.43 170.96 19.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.965 0.506 . . . . 0.0 110.376 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -142.8 152.72 59.91 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.32 173.69 14.08 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.788 2.992 . . . . 0.0 111.384 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -149.08 146.31 27.66 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.101 0.561 . . . . 0.0 109.716 177.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.3 t -163.49 178.07 8.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.954 0.502 . . . . 0.0 109.88 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.1 mp -64.2 -177.16 0.26 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.816 1.246 . . . . 0.0 110.639 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -135.2 164.15 28.34 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.298 0.639 . . . . 0.0 109.956 -177.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -146.43 -179.68 6.92 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.682 0.393 . . . . 0.0 110.618 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -163.55 -174.68 33.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -141.67 22.27 2.15 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.614 0.765 . . . . 0.0 110.595 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -135.01 172.28 13.23 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 123.294 0.637 . . . . 0.0 109.94 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 49.5 p -140.89 158.21 65.66 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 123.076 0.55 . . . . 0.0 109.803 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -74.23 165.63 31.44 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.591 2.861 . . . . 0.0 111.462 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -85.85 22.12 1.74 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.83 0.852 . . . . 0.0 111.025 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -110.58 6.49 21.9 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -69.09 171.53 8.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.141 0.577 . . . . 0.0 110.842 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -154.21 153.48 28.33 Favored Pre-proline 0 N--CA 1.456 -0.144 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.226 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.07 163.86 34.36 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 123.67 2.914 . . . . 0.0 111.419 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.35 174.63 12.51 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.333 3.355 . . . . 0.0 110.844 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.23 29.86 1.16 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.205 0.526 . . . . 0.0 111.298 -179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -129.23 161.84 29.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.156 0.582 . . . . 0.0 109.998 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.26 6.79 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.29 0.636 . . . . 0.0 110.584 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.27 -179.75 41.96 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.874 -0.891 . . . . 0.0 110.874 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.1 t -61.11 155.64 20.01 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.827 0.851 . . . . 0.0 111.096 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -157.04 175.78 13.63 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.246 0.618 . . . . 0.0 110.797 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 168.49 41.29 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -159.57 -179.71 8.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.016 0.526 . . . . 0.0 109.818 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -134.44 16.71 3.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.2 m -142.85 -179.23 6.22 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.111 0.964 . . . . 0.0 109.643 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -149.97 171.02 17.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.745 0.307 . . . . 0.0 111.178 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.7 p -152.57 178.56 9.46 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.008 0.923 . . . . 0.0 110.235 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 45.6 m -55.66 140.44 41.37 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.664 0.269 . . . . 0.0 111.166 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 13.2 t -158.85 178.35 10.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.769 0.828 . . . . 0.0 109.56 -178.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -172.65 178.94 44.47 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -144.21 11.84 1.55 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.217 0.607 . . . . 0.0 111.084 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 49.4 t -59.26 156.93 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 123.701 0.8 . . . . 0.0 109.898 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.6 p -139.63 4.49 2.15 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.019 0.528 . . . . 0.0 112.036 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.96 126.3 26.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.0 p -162.51 178.5 8.54 Favored 'General case' 0 C--O 1.23 0.039 0 O-C-N 121.95 -0.469 . . . . 0.0 110.96 -177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.62 175.54 12.68 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.418 0.687 . . . . 0.0 109.719 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.6 m -60.9 156.31 47.79 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 122.803 0.441 . . . . 0.0 110.517 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -51.62 158.26 4.41 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 123.858 3.039 . . . . 0.0 113.061 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.2 m -61.44 158.58 37.76 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.506 0.722 . . . . 0.0 110.82 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.89 171.42 16.63 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.083 2.522 . . . . 0.0 110.933 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.19 168.72 23.81 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.223 0.609 . . . . 0.0 110.233 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.5 m -75.5 6.47 4.64 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.179 0.591 . . . . 0.0 112.045 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.413 ' C ' ' H ' ' A' ' 146' ' ' GLN . 97.6 mt -138.06 152.64 49.01 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.931 0.492 . . . . 0.0 109.75 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 10.4 m 59.06 0.02 0.16 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.272 1.029 . . . . 0.0 112.871 -176.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.413 ' H ' ' C ' ' A' ' 144' ' ' LEU . 77.1 mt-30 -148.56 160.47 36.14 Favored Pre-proline 0 C--O 1.237 0.398 0 C-N-CA 124.137 0.975 . . . . 0.0 109.013 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.32 135.4 46.29 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.469 2.779 . . . . 0.0 111.824 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -78.68 -10.37 15.73 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.499 2.799 . . . . 0.0 111.05 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 34.9 tp -155.4 71.45 5.55 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 123.923 0.889 . . . . 0.0 109.204 -176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.14 -31.78 29.7 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.921 3.08 . . . . 0.0 113.04 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 50.5 mt -148.82 128.19 6.33 Favored Pre-proline 0 C--N 1.343 0.31 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.21 151.39 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.494 2.796 . . . . 0.0 112.001 176.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.86 159.19 31.2 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.996 2.464 . . . . 0.0 110.706 177.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.27 168.91 1.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.879 3.053 . . . . 0.0 112.745 172.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -151.75 162.9 25.35 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.98 155.48 5.91 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.381 3.387 . . . . 0.0 113.406 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.77 164.04 35.68 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.774 2.983 . . . . 0.0 111.041 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -73.04 177.95 7.12 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.88 3.053 . . . . 0.0 111.262 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 18.6 m -134.06 16.55 3.83 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.709 0.803 . . . . 0.0 110.847 -178.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.95 -175.9 39.82 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -54.6 144.08 22.72 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 117.452 0.626 . . . . 0.0 110.853 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -67.7 162.85 54.18 Favored Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.439 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo -71.12 -12.42 30.23 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.584 2.189 . . . . 0.0 109.831 -174.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . 0.439 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.467 ' CG ' HG12 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -133.09 151.14 52.04 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 30.9 t -166.05 163.27 18.23 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.619 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 122.48 175.62 14.77 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 123.835 0.731 . . . . 0.0 111.725 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -72.77 162.99 28.8 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 14.8 m -60.94 -13.81 18.44 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -119.74 13.99 12.5 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 122.561 0.344 . . . . 0.0 111.188 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -146.7 17.12 1.28 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -57.88 153.89 13.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.526 1.131 . . . . 0.0 110.904 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.467 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 58.09 34.61 24.38 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.8 mt -138.05 -164.93 1.7 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.927 0.891 . . . . 0.0 109.813 -175.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.529 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 22.7 t-80 -146.08 -167.3 2.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.529 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.3 tp -139.95 7.78 2.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 117.827 0.285 . . . . 0.0 111.175 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 20.1 tp -151.62 16.11 0.69 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.92 0.488 . . . . 0.0 110.646 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -139.46 25.69 2.4 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.359 0.664 . . . . 0.0 111.388 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -64.31 -2.56 2.25 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -149.96 155.19 39.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.571 0.623 . . . . 0.0 109.858 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 -155.99 -9.58 0.11 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -70.69 150.6 45.8 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.74 -0.6 . . . . 0.0 110.726 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -157.55 -13.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.109 -177.575 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.435 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.034 -3.666 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.435 " H5'" HO2' ' B' ' 237' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 112.049 3.849 . 0.719 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.586 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.992 0 C4'-C3'-C2' 99.482 -3.218 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.586 " H5'" HO2' ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.075 -3.625 . 0.732 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.639 3.439 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.427 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C4'-C3'-C2' 99.152 -3.548 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.427 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.798 -3.902 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.414 HO2' " H5'" ' B' ' 245' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C4'-C3'-C2' 98.976 -3.724 . 0.763 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.414 " H5'" HO2' ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.38 0 C4'-C3'-C2' 99.187 -3.513 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C4'-C3'-C2' 99.565 -3.135 . 0.659 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.527 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 98.738 -3.962 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.527 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 C4'-C3'-C2' 98.596 -4.104 . 0.686 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.467 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 C4'-C3'-C2' 99.374 -3.326 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.467 " H5'" HO2' ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.572 0 C4'-C3'-C2' 99.761 -2.939 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 99.17 -3.53 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.461 HO2' " H5'" ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.15 -3.55 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.536 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.561 -3.139 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.594 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C4'-C3'-C2' 99.493 -3.207 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.594 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 O4'-C1'-N19 111.406 3.206 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 C4'-C3'-C2' 99.162 -3.538 . 0.676 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.453 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.182 -3.518 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.534 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.109 -3.591 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.534 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.922 1 O4'-C1'-N19 112.553 4.353 . 0.811 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.533 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 99.677 -3.023 . 0.759 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 110.924 2.724 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.573 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.941 0 C4'-C3'-C2' 98.717 -3.983 . 0.871 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.573 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.194 -3.506 . 0.7 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.477 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.069 0 C4'-C3'-C2' 99.556 -3.144 . 0.885 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.563 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.505 0 C4'-C3'-C2' 98.956 -3.744 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.563 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 C4'-C3'-C2' 99.719 -2.981 . 0.617 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.523 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.396 -3.304 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.447 " H2'" ' C6 ' ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.852 0 C4'-C3'-C2' 99.136 -3.564 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.447 ' C6 ' " H2'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.211 -3.489 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 C5'-C4'-C3' 111.444 -2.704 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.505 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.857 1 C5'-C4'-C3' 108.024 -4.984 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.505 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 3 P-O3'-C3' 125.004 4.42 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.465 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.407 -3.825 0 C4'-C3'-C2' 98.956 -3.744 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.465 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 100.115 -2.585 . 0.67 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.511 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.596 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.654 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.531 1 C4'-C3'-C2' 98.198 -4.502 . 0.706 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.654 " H5'" HO2' ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 111.675 3.475 . 0.622 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.505 " H5'" HO2' ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C5'-C4'-O4' 113.168 2.834 . 0.891 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.453 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 O4'-C1'-N19 111.729 3.529 . 0.839 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.453 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.316 -3.384 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.401 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 98.998 -3.702 . 0.913 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.446 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.063 1 C4'-C3'-C2' 98.544 -4.156 . 0.797 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.446 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.712 -2.988 . 0.818 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.185 0 C4'-C3'-C2' 99.155 -3.545 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 99.239 -3.461 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.096 1 O4'-C1'-N19 113.651 5.451 . 0.826 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.606 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C5'-C4'-O4' 113.465 3.046 . 0.369 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.606 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.354 0 O4'-C1'-N19 110.62 2.42 . 0.846 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.112 0 C4'-C3'-C2' 99.795 -2.905 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.289 1 C4'-C3'-C2' 98.079 -4.621 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.414 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.45 -3.25 . 0.461 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.598 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 110.959 2.759 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.598 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.891 0 O4'-C1'-N19 111.875 3.675 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.439 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.895 3.695 . 0.692 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.152 0 O4'-C1'-N19 110.929 2.729 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.631 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 O4'-C1'-N19 111.362 3.162 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.631 " H5'" HO2' ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 98.704 -3.996 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C4'-C3'-C2' 99.152 -3.548 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.572 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 O4'-C1'-N19 110.871 2.671 . 0.88 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.572 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 110.976 2.776 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.556 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.26 0 C4'-C3'-C2' 99.2 -3.5 . 0.566 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.556 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C4'-C3'-C2' 98.984 -3.716 . 0.694 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.473 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C4'-C3'-C2' 98.953 -3.747 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.473 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.832 0 O4'-C1'-N19 112.009 3.809 . 0.836 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.474 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.718 -2.982 . 0.795 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.474 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.784 1 C4'-C3'-C2' 97.653 -5.047 . 0.74 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.454 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.973 1 O4'-C1'-N19 112.209 4.009 . 0.76 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.529 0.273 0 N-CA-C 113.042 0.362 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.48 176.44 44.71 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -52.49 -31.84 50.4 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 124.507 3.471 . . . . 0.0 114.991 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.3 p -154.32 -8.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.4 tp 44.45 70.42 1.95 Allowed Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.207 1.003 . . . . 0.0 111.589 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.62 -26.1 12.27 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 124.664 3.576 . . . . 0.0 113.956 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.595 ' CD2' ' HH ' ' A' ' 22' ' ' TYR . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.595 ' HH ' ' CD2' ' A' ' 13' ' ' LEU . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.579 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.579 ' H ' HD23 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.461 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.583 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.559 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 5.3 t-160 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.559 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -145.62 62.06 8.21 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -72.49 -23.0 20.63 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 124.088 3.192 . . . . 0.0 112.862 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -158.81 9.07 0.13 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.117 0.567 . . . . 0.0 110.627 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 170.96 5.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 122.936 0.494 . . . . 0.0 111.341 -178.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 78' ' ' ALA . 46.2 m -109.36 -1.93 18.14 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.495 0.718 . . . . 0.0 110.965 -176.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -76.11 16.89 0.39 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.644 0.778 . . . . 0.0 111.338 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.405 ' H ' ' C ' ' A' ' 76' ' ' SER . . . -131.26 13.2 5.1 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.494 1.117 . . . . 0.0 110.578 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.8 t60 -146.16 170.94 15.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.16 0.984 . . . . 0.0 109.427 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.1 tp -153.33 155.87 37.3 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 122.233 -0.292 . . . . 0.0 110.976 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.09 16.56 1.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.147 0.579 . . . . 0.0 110.784 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.4 tpt -146.11 164.59 31.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.29 -167.64 34.06 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.31 -0.471 . . . . 0.0 112.611 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -137.76 -173.73 3.58 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.27 1.028 . . . . 0.0 108.697 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -140.28 164.49 29.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.511 0.672 . . . . 0.0 111.406 -178.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -153.48 -176.18 5.69 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.679 1.192 . . . . 0.0 110.143 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 t -140.66 -0.09 1.58 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.849 0.459 . . . . 0.0 111.565 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -66.31 143.57 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -156.68 156.24 33.1 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -162.01 176.37 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -59.86 158.73 10.09 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.154 0.582 . . . . 0.0 110.582 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.8 p90 -155.59 7.67 0.24 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -144.22 166.4 25.15 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.288 0.566 . . . . 0.0 110.752 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 95.0 p -161.79 -172.09 3.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.506 0.722 . . . . 0.0 110.52 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -123.21 9.17 9.19 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.876 0.471 . . . . 0.0 111.128 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 44.78 36.4 1.82 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.962 1.305 . . . . 0.0 113.007 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.28 166.66 1.1 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.209 0.528 . . . . 0.0 111.461 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -150.75 171.53 17.03 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.42 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -142.88 154.2 61.86 Favored Pre-proline 0 N--CA 1.454 -0.229 0 C-N-CA 124.155 0.982 . . . . 0.0 109.015 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.6 171.41 15.43 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.816 3.011 . . . . 0.0 111.922 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -151.82 28.36 0.61 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.032 0.533 . . . . 0.0 110.557 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.9 p -127.88 3.69 5.98 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.414 0.686 . . . . 0.0 111.456 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.2 173.31 14.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.543 0.737 . . . . 0.0 110.747 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.51 22.71 2.16 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.921 0.488 . . . . 0.0 111.113 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.7 t30 51.46 28.33 4.41 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.125 0.97 . . . . 0.0 111.237 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.16 -174.21 38.12 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -140.52 -178.33 5.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.189 0.595 . . . . 0.0 110.631 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -137.7 2.6 2.44 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.981 0.512 . . . . 0.0 110.808 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.3 p -69.89 157.83 88.74 Favored Pre-proline 0 N--CA 1.457 -0.122 0 O-C-N 122.007 -0.433 . . . . 0.0 110.774 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -72.97 179.04 5.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.972 2.448 . . . . 0.0 111.223 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -149.11 163.23 38.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.755 0.422 . . . . 0.0 109.872 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 97.0 mttt 50.34 17.66 0.36 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.578 1.151 . . . . 0.0 112.458 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 t -158.59 177.24 11.43 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.305 1.042 . . . . 0.0 108.621 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 41.01 56.76 8.47 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.859 1.263 . . . . 0.0 113.085 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.61 156.27 66.75 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.252 2.635 . . . . 0.0 111.112 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -77.36 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.422 3.414 . . . . 0.0 112.612 -177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.04 156.57 40.21 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.441 0.564 . . . . 0.0 110.991 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -160.73 173.6 15.17 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.702 0.801 . . . . 0.0 109.838 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.54 157.54 4.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.186 0.594 . . . . 0.0 109.484 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.48 ' C ' ' H ' ' A' ' 122' ' ' ASN . . . 172.3 -171.07 44.03 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.7 m -69.29 20.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.083 0.953 . . . . 0.0 112.663 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.48 ' H ' ' C ' ' A' ' 120' ' ' GLY . 39.7 p-10 -136.65 20.08 3.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 110.376 -176.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -161.82 -161.21 11.63 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -143.41 159.46 42.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -72.91 -6.46 45.31 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.5 m 51.59 24.83 2.47 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.857 0.863 . . . . 0.0 111.775 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.485 ' C ' ' H ' ' A' ' 129' ' ' SER . 46.4 t80 -65.06 177.05 1.08 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.552 1.141 . . . . 0.0 111.29 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' SER . . . . . 0.42 ' N ' ' CG ' ' A' ' 127' ' ' PHE . 41.7 m -68.52 18.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.462 1.105 . . . . 0.0 112.318 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' SER . . . . . 0.485 ' H ' ' C ' ' A' ' 127' ' ' PHE . 49.9 m -142.31 -172.02 3.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.589 1.156 . . . . 0.0 109.728 -177.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.3 t -134.55 13.21 3.76 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.84 0.856 . . . . 0.0 111.213 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 177.41 178.01 46.71 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -142.12 17.46 2.09 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.304 1.042 . . . . 0.0 110.263 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.8 14.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.159 0 C-N-CA 123.158 0.583 . . . . 0.0 110.716 -176.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 78.6 p -144.17 173.94 11.31 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.899 0.88 . . . . 0.0 110.936 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.05 166.22 7.93 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.071 0.548 . . . . 0.0 110.81 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 24.1 t -151.28 -179.61 7.5 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.524 1.13 . . . . 0.0 109.103 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.5 158.7 9.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.667 0.387 . . . . 0.0 111.569 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.5 p -156.63 164.79 20.37 Favored Pre-proline 0 N--CA 1.464 0.246 0 C-N-CA 123.819 0.848 . . . . 0.0 109.783 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.83 161.96 2.84 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.965 3.11 . . . . 0.0 113.247 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.6 p -153.81 144.29 15.8 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.38 -15.55 8.68 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.122 3.215 . . . . 0.0 115.431 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -68.59 169.84 10.31 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.267 0.485 . . . . 0.0 111.471 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.8 p -150.28 2.76 0.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.48 159.94 33.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.606 -0.684 . . . . 0.0 109.509 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.3 p -142.56 3.5 1.49 Allowed 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -143.25 147.83 42.06 Favored Pre-proline 0 CA--C 1.531 0.222 0 O-C-N 121.715 -0.616 . . . . 0.0 109.733 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -79.02 169.25 19.55 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 123.574 2.85 . . . . 0.0 110.916 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.52 166.42 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.063 3.175 . . . . 0.0 112.404 171.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.401 ' N ' ' CD ' ' A' ' 150' ' ' PRO . 95.1 mt -141.04 47.12 0.99 Allowed Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 123.576 0.751 . . . . 0.0 112.071 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 149' ' ' LEU . 58.3 Cg_endo -67.38 149.32 80.63 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.535 2.157 . . . . 0.0 110.159 178.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 25.3 pt -147.51 49.86 0.84 Allowed Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 123.374 0.67 . . . . 0.0 112.54 -174.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.98 157.83 59.73 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 122.23 1.953 . . . . 0.0 110.542 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.06 122.97 10.1 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.374 2.716 . . . . 0.0 111.292 -174.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -85.2 8.9 4.36 Favored 'Trans proline' 0 N--CA 1.45 -1.046 0 C-N-CA 124.341 3.361 . . . . 0.0 111.985 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -54.44 132.84 62.81 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 118.445 0.566 . . . . 0.0 112.008 -174.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -78.91 167.9 21.52 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 123.696 2.931 . . . . 0.0 110.265 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.14 164.37 34.2 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 123.604 2.87 . . . . 0.0 109.835 175.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.25 162.75 41.17 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 123.301 2.667 . . . . 0.0 110.865 -178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 54.4 m -150.75 174.14 13.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.91 0.884 . . . . 0.0 110.071 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -176.55 22.98 0.05 OUTLIER Glycine 0 CA--C 1.529 0.941 0 CA-C-O 119.74 -0.478 . . . . 0.0 112.394 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -140.53 19.22 2.37 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-N 117.72 0.76 . . . . 0.0 111.827 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -50.06 112.91 3.02 Favored Pre-proline 0 CA--C 1.531 0.249 0 C-N-CA 123.37 0.668 . . . . 0.0 112.199 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -83.42 -11.04 9.65 Favored 'Trans proline' 0 N--CA 1.443 -1.451 0 C-N-CA 124.008 3.139 . . . . 0.0 111.81 -172.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.446 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.428 ' CG ' HG12 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.86 169.11 18.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 54.8 m -151.82 147.74 27.0 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 146.47 -174.36 26.38 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.86 12.11 3.39 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.445 0.698 . . . . 0.0 111.299 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 51.0 m 106.42 -8.61 0.01 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 127.78 2.432 . . . . 0.0 112.35 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -121.92 5.98 9.87 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.339 0.4 . . . . 0.0 111.327 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.66 17.04 1.01 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -58.28 143.33 44.99 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.197 1.399 . . . . 0.0 110.981 -174.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.408 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.428 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.46 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 58.19 40.38 24.95 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.8 mt -135.77 -175.07 3.84 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.61 0.764 . . . . 0.0 110.844 -175.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -138.69 18.25 2.69 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 19.0 tp 55.55 29.43 13.43 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.474 0.71 . . . . 0.0 112.026 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 56.8 tp -148.68 137.46 21.43 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.061 0.545 . . . . 0.0 109.858 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -145.27 1.53 0.96 Allowed 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 123.358 0.411 . . . . 0.0 111.0 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -65.18 161.03 20.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.012 0.434 . . . . 0.0 110.722 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -156.89 173.29 17.22 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.64 0.776 . . . . 0.0 110.794 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -146.85 169.98 17.98 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 121.234 0.54 . . . . 0.0 110.29 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -146.89 8.47 0.97 Allowed 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.625 0.77 . . . . 0.0 110.536 178.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -152.97 173.39 15.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.488 0.715 . . . . 0.0 110.088 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.692 179.241 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.473 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 114.069 3.478 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.473 " H5'" HO2' ' B' ' 237' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 O4'-C1'-N19 111.342 3.142 . 0.749 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.562 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 100.244 -2.456 . 0.804 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.562 " H5'" HO2' ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.617 -3.083 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.502 HO2' " H5'" ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.568 0 O4'-C1'-N19 112.12 3.92 . 0.794 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.502 " H5'" HO2' ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 C4'-C3'-C2' 99.342 -3.358 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.46 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.633 0 C4'-C3'-C2' 99.03 -3.67 . 0.692 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.427 HO2' " H5'" ' B' ' 245' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 N19-C1'-C2' 108.769 -2.894 . 0.741 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.427 " H5'" HO2' ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.239 -3.461 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.552 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.366 -3.334 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.552 " H5'" HO2' ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 O4'-C1'-N19 111.26 3.06 . 0.699 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.224 0 C4'-C3'-C2' 99.144 -3.556 . 0.726 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.463 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 C4'-C3'-C2' 98.914 -3.786 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.537 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 99.929 -2.771 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.537 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C4'-C3'-C2' 98.73 -3.97 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.812 -2.888 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.397 -3.303 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.447 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.236 0 C4'-C3'-C2' 98.703 -3.997 . 0.742 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.447 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.012 -3.688 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.094 0 C4'-C3'-C2' 99.118 -3.582 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.242 -3.458 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.572 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C4'-C3'-C2' 99.629 -3.071 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.572 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.465 1 O4'-C1'-N19 112.363 4.163 . 0.729 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C5'-C4'-C3' 110.377 -3.415 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C4'-C3'-C2' 99.27 -3.43 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 C4'-C3'-C2' 99.625 -3.075 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 99.163 -3.537 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.43 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C4'-C3'-C2' 99.199 -3.501 . 0.875 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.43 " H5'" HO2' ' B' ' 264' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.51 -3.19 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.504 HO2' " H5'" ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 O4'-C1'-N19 111.474 3.274 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.528 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C4'-C3'-C2' 99.292 -3.408 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.567 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.686 -3.014 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.567 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C3'-C2'-C1' 104.347 3.163 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . 0.481 ' N2 ' ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.45 1 C5'-C4'-C3' 108.769 -4.487 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.518 ' C6 ' " O5'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C3'-C2'-C1' 104.626 3.473 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.476 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.994 3 P-O3'-C3' 125.007 4.423 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.627 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.541 0 C4'-C3'-C2' 98.913 -3.787 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.681 HO2' " C5'" ' B' ' 275' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.403 -4.15 1 N19-C1'-C2' 121.602 5.126 . 0.2 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.681 " C5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C4'-C3'-C2' 99.465 -3.235 . 0.412 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.511 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.274 0 C4'-C3'-C2' 99.027 -3.673 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.583 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.414 -3.234 0 C4'-C3'-C2' 99.992 -2.708 . 0.538 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.52 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 C4'-C3'-C2' 99.395 -3.305 . 0.92 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.401 " H5'" HO2' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 98.877 -3.823 . 0.869 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.175 -3.525 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.108 -3.592 . 0.897 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.433 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.415 -3.285 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.433 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.335 -3.365 . 0.855 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.422 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.012 0 C4'-C3'-C2' 99.996 -2.704 . 0.904 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.422 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.212 0 C4'-C3'-C2' 99.971 -2.729 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.321 1 O4'-C1'-N19 112.815 4.615 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-O4' 113.549 3.106 . 0.589 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 110.614 2.414 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.453 HO2' " H5'" ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C4'-C3'-C2' 99.307 -3.393 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.453 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 98.946 -3.754 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.446 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C4'-C3'-C2' 99.416 -3.284 . 0.539 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 O4'-C1'-N19 111.862 3.662 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C4'-C3'-C2' 99.213 -3.487 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.402 HO2' " H5'" ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.369 -3.331 . 0.646 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.402 " H5'" HO2' ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 100.217 -2.483 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.977 0 C4'-C3'-C2' 99.376 -3.324 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.431 -3.269 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.41 HO2' " H5'" ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 O4'-C1'-N19 111.699 3.499 . 0.706 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.472 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.898 2.698 . 0.869 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.513 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.141 0 C4'-C3'-C2' 100.093 -2.607 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.513 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.442 0 C4'-C3'-C2' 99.277 -3.423 . 0.634 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.409 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.415 -3.163 0 C4'-C3'-C2' 99.187 -3.513 . 0.682 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.476 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.753 1 C4'-C3'-C2' 98.631 -4.069 . 0.784 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.476 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C4'-C3'-C2' 99.183 -3.517 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.454 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C4'-C3'-C2' 99.95 -2.75 . 0.833 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.49 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.512 1 C4'-C3'-C2' 97.965 -4.735 . 0.782 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.49 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.003 1 O4'-C1'-N19 112.297 4.097 . 0.816 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.474 0.352 0 N-CA-C 112.587 0.187 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.89 -176.53 42.48 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.24 -14.12 3.91 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.836 3.69 . . . . 0.0 114.062 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -76.07 -20.02 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.822 0.449 . . . . 0.0 110.915 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.69 63.61 4.06 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.763 0.825 . . . . 0.0 109.217 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.58 -26.1 44.21 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.765 2.977 . . . . 0.0 113.452 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.55 HD23 ' HH ' ' A' ' 22' ' ' TYR . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HH ' HD23 ' A' ' 13' ' ' LEU . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.511 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.475 ' HG ' HD13 ' A' ' 35' ' ' LEU . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.454 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' CG1' " H1'" ' B' ' 287' ' ' ' U' . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.475 HD13 ' HG ' ' A' ' 26' ' ' SER . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.454 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.436 ' CG1' ' HB3' ' A' ' 50' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.568 HG13 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.623 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.483 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 12.4 t-160 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.483 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.689 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.408 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 22.5 m-85 -146.38 50.69 1.05 Allowed Pre-proline 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.689 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 79.0 Cg_endo -70.63 -24.77 25.33 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.329 3.352 . . . . 0.0 113.032 -176.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -161.01 11.38 0.09 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.454 0.57 . . . . 0.0 112.136 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.19 170.72 17.81 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.935 0.494 . . . . 0.0 111.078 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -140.51 23.77 2.3 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.222 1.009 . . . . 0.0 109.977 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -121.79 17.67 11.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.165 0.986 . . . . 0.0 110.5 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 80' ' ' LEU . . . -64.64 -3.48 3.23 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.011 0.524 . . . . 0.0 112.29 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -69.86 7.99 0.8 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.892 0.877 . . . . 0.0 111.451 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 78' ' ' ALA . 27.8 tp -131.57 14.46 4.95 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.542 1.137 . . . . 0.0 109.328 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.21 -178.61 5.93 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.915 0.886 . . . . 0.0 110.073 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -147.86 171.61 15.46 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 121.201 0.524 . . . . 0.0 110.74 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 177.9 -175.35 47.47 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -150.92 172.41 15.71 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.066 0.547 . . . . 0.0 110.453 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -148.05 176.79 9.9 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.885 0.874 . . . . 0.0 108.99 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -117.27 166.81 11.84 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.354 0.662 . . . . 0.0 110.373 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.1 t -151.83 -179.68 7.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.4 m -138.78 169.19 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.993 0.425 . . . . 0.0 111.218 -175.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.16 -174.47 4.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.271 1.028 . . . . 0.0 108.779 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.4 p -128.87 169.13 14.97 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.757 0.423 . . . . 0.0 110.026 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.71 166.41 32.26 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -151.97 174.96 13.01 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.33 0.652 . . . . 0.0 110.723 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -148.97 -176.85 5.5 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.631 0.772 . . . . 0.0 109.658 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.7 p -140.54 169.86 16.87 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.354 0.662 . . . . 0.0 110.332 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -153.22 168.25 26.62 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -148.49 149.73 32.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -158.22 -178.24 7.15 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.509 0.724 . . . . 0.0 109.55 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -150.46 149.06 29.5 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 122.93 0.492 . . . . 0.0 110.202 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -154.29 144.8 15.92 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.676 0.791 . . . . 0.0 109.425 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -69.62 171.83 13.61 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.775 2.316 . . . . 0.0 111.74 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -150.28 168.51 23.85 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.138 0.575 . . . . 0.0 110.302 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.1 p -66.7 -5.44 11.86 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.268 0.627 . . . . 0.0 112.36 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.5 tp -152.15 147.54 26.56 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.437 0.695 . . . . 0.0 109.318 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -154.83 15.12 0.42 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.904 0.482 . . . . 0.0 110.811 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 50.46 33.33 7.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.965 0.506 . . . . 0.0 111.22 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -140.39 -174.66 14.01 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -145.3 179.9 7.08 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.779 0.431 . . . . 0.0 110.849 -173.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -149.09 161.75 41.32 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.8 m -138.76 73.02 41.23 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 123.6 0.76 . . . . 0.0 109.645 -177.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.72 9.55 1.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 124.903 3.735 . . . . 0.0 113.127 -173.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -140.05 163.63 32.18 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.423 0.556 . . . . 0.0 111.499 -178.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -72.51 1.39 8.17 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -177.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.8 m -59.41 163.81 3.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.449 0.7 . . . . 0.0 111.509 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.27 136.03 91.36 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -50.63 150.64 11.75 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.309 2.673 . . . . 0.0 112.976 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.38 3.27 6.45 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.255 3.303 . . . . 0.0 112.356 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -65.6 146.25 55.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 122.149 -0.345 . . . . 0.0 111.327 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -150.81 -174.11 4.68 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.966 0.907 . . . . 0.0 109.844 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -57.36 172.6 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 123.592 0.757 . . . . 0.0 112.263 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -151.35 -165.11 12.63 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 30.2 m -131.93 18.82 4.59 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.06 0.544 . . . . 0.0 112.146 -175.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 50.1 28.61 3.1 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.875 0.87 . . . . 0.0 112.21 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -156.59 29.36 0.56 Allowed Glycine 0 CA--C 1.53 0.998 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -142.65 165.24 27.92 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.76 0.824 . . . . 0.0 110.095 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.91 168.87 25.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.05 0.452 . . . . 0.0 110.582 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.8 p -157.24 -176.32 5.9 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.059 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -139.36 168.78 19.05 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.269 0.628 . . . . 0.0 109.564 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.3 p -149.12 8.92 0.74 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 26.8 t -64.84 -19.48 65.89 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.004 -0.435 . . . . 0.0 111.381 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 78.7 p -160.98 167.19 27.01 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.545 0.738 . . . . 0.0 109.808 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.12 -166.84 37.18 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -61.23 171.25 1.4 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.362 0.601 . . . . 0.0 110.652 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 9.9 p -134.56 13.7 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.064 0.546 . . . . 0.0 111.622 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.9 t -139.61 163.99 31.11 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.101 0.56 . . . . 0.0 110.295 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -151.63 12.77 0.62 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.323 0.649 . . . . 0.0 110.213 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 34.6 m -61.86 162.17 9.31 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.117 0.567 . . . . 0.0 111.45 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.83 -177.72 6.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.255 0.622 . . . . 0.0 109.815 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 t -150.95 145.52 18.26 Favored Pre-proline 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 109.591 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.54 -5.12 15.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.555 2.837 . . . . 0.0 112.478 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.8 m -146.04 159.67 45.57 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 122.96 0.504 . . . . 0.0 110.238 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.96 -11.4 3.63 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.996 3.131 . . . . 0.0 114.23 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.95 -178.14 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.57 1.148 . . . . 0.0 112.912 -175.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 78.5 p -143.36 6.62 1.5 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 32.9 tp -65.43 -9.23 23.69 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.903 0.481 . . . . 0.0 111.742 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 46.1 p -100.21 0.44 40.39 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.4 1.08 . . . . 0.0 111.096 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.481 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 28.1 pt20 -152.19 36.08 0.09 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.527 0.731 . . . . 0.0 112.793 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.481 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 90.9 Cg_endo -72.73 168.17 25.25 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.447 2.098 . . . . 0.0 109.895 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.15 140.37 49.19 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.263 1.975 . . . . 0.0 109.294 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 81.6 mt -147.82 158.28 42.74 Favored Pre-proline 0 N--CA 1.456 -0.147 0 C-N-CA 123.422 0.689 . . . . 0.0 110.511 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -71.57 174.21 11.33 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.535 2.823 . . . . 0.0 110.179 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 28.9 pt -141.91 157.98 63.15 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.642 0.777 . . . . 0.0 109.32 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 169.35 16.29 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.04 2.494 . . . . 0.0 111.07 177.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.95 161.46 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 124.629 3.552 . . . . 0.0 112.984 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.8 -0.08 6.43 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 123.56 2.84 . . . . 0.0 112.338 -178.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -141.64 144.81 34.66 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.28 150.12 34.32 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.497 2.798 . . . . 0.0 112.803 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.54 152.15 16.94 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 124.054 3.169 . . . . 0.0 112.66 175.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -75.18 1.24 8.04 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.787 2.991 . . . . 0.0 112.404 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.1 p -145.62 19.14 1.5 Allowed 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 123.363 0.665 . . . . 0.0 110.297 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -157.67 37.67 0.54 Allowed Glycine 0 C--N 1.335 0.508 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -175.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -54.38 -23.42 15.55 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.35 0.66 . . . . 0.0 112.21 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -148.27 151.03 36.18 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.194 0.598 . . . . 0.0 110.092 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -75.18 -15.27 20.44 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.744 2.963 . . . . 0.0 110.806 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG12 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -121.88 168.71 11.56 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 24.4 m -151.95 31.45 0.56 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -170.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -153.89 169.14 32.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 119.269 0.941 . . . . 0.0 113.995 -178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -73.65 165.56 24.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.33 0.652 . . . . 0.0 111.127 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 21.9 m -60.1 -2.01 0.38 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -124.14 6.86 8.52 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 119.255 0.934 . . . . 0.0 111.463 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -149.53 17.3 0.91 Allowed 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -60.7 155.51 18.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.053 1.341 . . . . 0.0 112.802 -173.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.463 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.62 32.17 21.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.5 -171.28 2.51 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.436 0.694 . . . . 0.0 110.44 -175.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -142.76 21.32 1.98 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.521 0.2 . . . . 0.0 111.025 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 20.3 tp 63.59 11.82 6.01 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.534 1.134 . . . . 0.0 112.042 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 3.1 pp -148.42 177.68 9.24 Favored 'General case' 0 C--N 1.342 0.267 0 O-C-N 121.586 -0.696 . . . . 0.0 110.987 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -149.34 177.6 9.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.412 0.685 . . . . 0.0 110.35 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -143.28 6.57 1.52 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.672 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -82.36 -14.65 54.93 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 119.58 -0.247 . . . . 0.0 111.238 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 44.32 25.65 0.13 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.458 1.103 . . . . 0.0 113.971 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -73.7 6.98 2.73 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.528 0.731 . . . . 0.0 112.155 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -139.25 16.55 2.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.866 -0.521 . . . . 0.0 110.898 -177.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.844 -177.295 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.468 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 98.79 -3.91 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.545 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.694 0 C4'-C3'-C2' 99.091 -3.609 . 0.701 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.545 " H5'" HO2' ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.373 -3.327 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.52 -3.18 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 O4'-C1'-N19 112.155 3.955 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.039 -3.661 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 98.803 -3.897 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.435 HO2' " H5'" ' B' ' 245' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.751 0 C4'-C3'-C2' 99.726 -2.974 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.435 " H5'" HO2' ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.606 -3.094 . 0.755 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.329 -3.371 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.877 3.677 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.474 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.747 3.547 . 0.806 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.474 " H5'" HO2' ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.742 0 C4'-C3'-C2' 99.41 -3.29 . 0.736 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.47 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.132 -3.568 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.47 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.099 -3.601 . 0.59 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.551 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.014 -3.686 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.551 " H5'" HO2' ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.242 -3.458 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C4'-C3'-C2' 99.123 -3.577 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.433 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.208 0 C4'-C3'-C2' 99.399 -3.301 . 0.759 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.454 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C4'-C3'-C2' 99.655 -3.045 . 0.834 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.523 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C4'-C3'-C2' 98.854 -3.846 . 0.876 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.523 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 C5'--C4' 1.539 2.207 1 O4'-C1'-N19 113.437 5.237 . 0.783 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 O4'-C1'-N19 111.548 3.348 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 1 C4'-C3'-C2' 98.697 -4.003 . 0.803 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.518 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C4'-C3'-C2' 98.34 -4.36 . 0.783 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.518 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 99.499 -3.201 . 0.706 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.477 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 C4'-C3'-C2' 99.265 -3.435 . 0.93 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.536 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.831 -2.869 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.536 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.375 -3.325 . 0.701 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.563 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.611 -3.089 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.563 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.032 0 C4'-C3'-C2' 99.352 -3.348 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.489 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.948 1 C4'-C3'-C2' 98.172 -4.528 . 0.728 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.508 1 C5'-C4'-C3' 107.776 -5.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.479 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.038 1 P-O3'-C3' 125.131 4.526 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.479 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.411 -3.476 0 C3'-C2'-C1' 105.081 3.979 OUTLIER-DELTA 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.455 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.333 1 C4'-C3'-C2' 98.104 -4.596 . 0.0 OUTLIER beta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.455 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.118 0 C4'-C3'-C2' 99.432 -3.268 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.45 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C4'-C3'-C2' 99.277 -3.423 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.45 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 98.747 -3.953 . 0.787 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.623 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.412 -3.432 1 C4'-C3'-C2' 98.599 -4.101 . 0.626 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.481 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.089 2.889 . 0.873 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.202 1 C4'-C3'-C2' 98.095 -4.605 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C4'-C3'-C2' 99.949 -2.751 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.334 -3.366 . 0.878 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.413 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.075 0 C4'-C3'-C2' 99.362 -3.338 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.413 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.022 0 C4'-C3'-C2' 99.635 -3.065 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.415 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.404 -3.296 . 0.867 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.415 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.153 0 C4'-C3'-C2' 100.201 -2.499 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.938 1 O4'-C1'-N19 112.553 4.353 . 0.557 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.631 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.32 3.12 . 0.519 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.631 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C5'-C4'-C3' 111.311 -2.793 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.528 -3.172 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.926 0 O4'-C1'-N19 111.478 3.278 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 C4'-C3'-C2' 99.368 -3.332 . 0.436 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.516 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-O4' 113.033 2.738 . 0.621 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.516 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 99.05 -3.65 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.426 HO2' " H5'" ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O4'-C1'-N19 111.713 3.513 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.426 " H5'" HO2' ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 O4'-C1'-N19 111.477 3.277 . 0.716 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.413 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 99.0 -3.7 . 0.793 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.53 -3.17 . 0.665 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.131 1 O4'-C1'-N19 112.465 4.265 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.483 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 O4'-C1'-N19 111.774 3.574 . 0.81 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.483 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 99.808 -2.892 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.537 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.563 -3.137 . 0.723 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.537 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C4'-C3'-C2' 99.228 -3.472 . 0.73 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 98.797 -3.903 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.464 4.264 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C4'-C3'-C2' 99.415 -3.285 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.455 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 98.727 -3.973 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.455 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.821 3.621 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 N--CA 1.473 0.271 0 CA-C-O 120.462 0.109 . . . . 0.0 111.878 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 173.34 43.43 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -75.68 -179.74 5.43 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.95 3.767 . . . . 0.0 111.088 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.8 t -138.91 151.9 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 124.034 0.934 . . . . 0.0 108.89 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.03 153.63 29.95 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.734 0.413 . . . . 0.0 110.903 -177.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.6 -12.66 29.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.419 2.746 . . . . 0.0 113.145 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD23 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.456 ' H ' HD23 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.476 ' CB ' HG23 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.461 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.636 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.709 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -145.15 58.76 5.42 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.709 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 86.8 Cg_endo -70.55 -9.02 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.235 1 C-N-CA 125.502 4.135 . . . . 0.0 112.514 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -154.07 171.47 19.05 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 122.929 0.492 . . . . 0.0 110.558 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.37 19.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.147 0.979 . . . . 0.0 112.217 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.8 p -140.07 -179.51 6.01 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.491 0.717 . . . . 0.0 111.14 -174.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.18 153.63 11.55 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.155 0.582 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.43 179.04 8.92 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.939 0.896 . . . . 0.0 110.409 -178.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -142.75 168.72 19.06 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 122.456 0.302 . . . . 0.0 110.418 -176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 82' ' ' MET . 19.3 tp -147.8 23.62 1.1 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.939 0.496 . . . . 0.0 110.896 -177.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.42 15.3 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.071 0.948 . . . . 0.0 112.658 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' MET . . . . . 0.47 ' H ' ' C ' ' A' ' 80' ' ' LEU . 3.3 ppp? -138.83 12.56 2.68 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.538 0.735 . . . . 0.0 111.299 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -117.86 174.59 15.33 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -157.65 177.87 10.91 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 t -144.45 167.25 22.95 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 121.37 0.605 . . . . 0.0 110.287 177.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 pp -152.51 180.0 8.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.576 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.8 t -152.07 166.76 30.63 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 122.985 0.514 . . . . 0.0 110.496 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.9 m -145.75 -176.07 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.108 0 C-N-CA 123.749 0.82 . . . . 0.0 109.272 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -142.02 167.79 21.28 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 122.849 0.46 . . . . 0.0 111.184 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.7 p -142.31 6.34 1.7 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.565 0.746 . . . . 0.0 111.044 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -151.14 149.31 29.32 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.55 0.74 . . . . 0.0 109.206 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -160.37 174.38 14.23 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 59.8 p -77.42 12.78 1.41 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.964 0.905 . . . . 0.0 112.367 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 37.5 t -57.97 164.59 2.18 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.61 0.764 . . . . 0.0 111.408 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -142.66 4.79 1.54 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.693 0.797 . . . . 0.0 111.37 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.47 -1.43 6.57 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.392 0.677 . . . . 0.0 111.017 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.53 9.7 1.0 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.938 0.895 . . . . 0.0 113.342 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 55.0 -166.89 0.09 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.073 0.949 . . . . 0.0 112.09 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -139.63 155.5 71.57 Favored Pre-proline 0 C--N 1.341 0.2 0 C-N-CA 123.419 0.688 . . . . 0.0 109.891 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -70.36 173.39 11.57 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 124.257 3.305 . . . . 0.0 111.632 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.23 174.39 12.44 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.085 0.554 . . . . 0.0 110.701 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 75.9 p -142.62 15.36 1.98 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.629 0.772 . . . . 0.0 111.225 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 49.0 tp -57.71 151.29 17.77 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.89 0.376 . . . . 0.0 110.968 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -151.73 164.52 36.8 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.543 0.737 . . . . 0.0 109.686 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 48.6 p30 -154.95 179.06 9.49 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 122.828 0.451 . . . . 0.0 110.729 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.59 -170.67 39.44 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -142.64 169.37 17.7 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.144 0.497 . . . . 0.0 111.445 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -152.88 165.68 34.69 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 58.2 p -57.03 154.56 19.04 Favored Pre-proline 0 C--O 1.233 0.227 0 O-C-N 121.75 -0.594 . . . . 0.0 110.599 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.89 162.43 2.59 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.572 2.848 . . . . 0.0 113.319 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -150.88 158.42 44.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.713 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -146.3 -176.09 5.03 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.687 0.795 . . . . 0.0 109.946 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.1 m -137.76 23.59 2.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.141 0.576 . . . . 0.0 111.607 -176.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.54 153.67 28.21 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.437 0.295 . . . . 0.0 110.648 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.49 163.35 38.39 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.538 2.825 . . . . 0.0 111.423 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.06 120.38 4.19 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.815 3.677 . . . . 0.0 112.941 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -156.03 8.79 0.24 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.997 0.519 . . . . 0.0 110.8 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -151.62 175.27 12.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.351 1.06 . . . . 0.0 109.632 -176.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.1 m -141.77 172.35 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 C-N-CA 123.538 0.735 . . . . 0.0 109.548 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -168.97 -13.46 0.02 OUTLIER Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -72.1 0.08 10.49 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.461 0.63 . . . . 0.0 111.586 174.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -152.41 166.83 30.7 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.176 0.59 . . . . 0.0 110.275 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.22 -2.03 0.03 OUTLIER Glycine 0 CA--C 1.525 0.695 0 C-N-CA 123.7 0.666 . . . . 0.0 112.264 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -72.17 -3.88 25.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 117.412 0.606 . . . . 0.0 112.034 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -60.93 140.12 57.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.274 0.488 . . . . 0.0 109.693 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.0 p -91.68 -3.3 56.45 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.088 0.555 . . . . 0.0 110.906 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 49.45 27.56 2.07 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.111 0.965 . . . . 0.0 112.111 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.8 m 50.34 25.07 1.71 Allowed 'General case' 0 C--N 1.342 0.271 0 C-N-CA 124.286 1.035 . . . . 0.0 112.012 -177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.8 m -139.36 8.65 2.44 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.642 0.777 . . . . 0.0 111.923 -178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 86.1 p 44.37 30.28 0.46 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.666 1.186 . . . . 0.0 112.829 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -166.18 -168.05 27.76 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.72 163.57 32.53 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.685 0.394 . . . . 0.0 110.229 -176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.52 169.54 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 123.541 0.736 . . . . 0.0 111.754 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.8 p -151.59 22.4 0.71 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.976 0.911 . . . . 0.0 109.675 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.9 tp -131.37 5.91 4.44 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.424 0.69 . . . . 0.0 110.54 -173.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.7 p -151.46 163.02 39.93 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.411 0.684 . . . . 0.0 110.629 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.44 168.7 25.79 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.477 0.311 . . . . 0.0 110.902 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 69.3 m -145.17 163.66 31.27 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.213 0.605 . . . . 0.0 109.993 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -50.53 160.27 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 124.38 3.386 . . . . 0.0 113.401 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.47 ' N ' ' HD3' ' A' ' 141' ' ' PRO . 27.5 m -138.45 38.08 0.33 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.47 ' HD3' ' N ' ' A' ' 140' ' ' VAL . 71.3 Cg_exo -48.17 162.54 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.753 2.302 . . . . 0.0 112.559 173.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.18 2.38 1.69 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.435 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 17.3 t -155.22 -175.22 5.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 177.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 26.4 tp -155.93 169.68 23.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.464 0.706 . . . . 0.0 109.934 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 3.0 m 52.97 35.15 18.55 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.956 0.902 . . . . 0.0 112.18 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -145.39 158.12 51.5 Favored Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 122.089 -0.382 . . . . 0.0 110.337 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.67 164.46 35.36 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.171 2.581 . . . . 0.0 109.902 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.11 179.18 5.15 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 124.013 3.142 . . . . 0.0 110.676 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 23.2 tp -145.39 136.6 12.59 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -51.52 155.75 6.99 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 123.409 2.74 . . . . 0.0 112.666 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 10.1 tp -64.81 140.47 98.07 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.851 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -54.12 166.71 1.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.4 2.734 . . . . 0.0 111.108 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.53 156.1 54.28 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.394 2.063 . . . . 0.0 110.672 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.83 -176.99 1.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.547 2.831 . . . . 0.0 111.735 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -129.44 153.8 80.65 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 109.689 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.49 135.34 47.56 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.767 . . . . 0.0 111.598 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.518 ' C ' ' H ' ' A' ' 159' ' ' SER . 89.3 Cg_endo -76.27 174.0 13.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.795 2.997 . . . . 0.0 109.64 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.48 7.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.464 1 C-N-CA 125.485 4.124 . . . . 0.0 114.331 172.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' SER . . . . . 0.518 ' H ' ' C ' ' A' ' 157' ' ' PRO . 86.1 p -147.54 -175.94 5.05 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.582 0.753 . . . . 0.0 109.502 -177.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.65 169.2 40.55 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.024 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.2 mtmm -142.6 16.57 2.0 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.808 0.443 . . . . 0.0 110.828 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 43.6 t30 46.79 81.7 0.25 Allowed Pre-proline 0 C--O 1.234 0.28 0 C-N-CA 124.384 1.073 . . . . 0.0 111.356 -175.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -79.7 -13.23 13.29 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.766 3.644 . . . . 0.0 110.455 -169.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.404 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.432 ' CG ' HG12 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.4 168.49 18.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 88.6 p -162.86 164.92 25.8 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.826 0.85 . . . . 0.0 110.01 177.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 119.48 -156.1 15.89 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.614 -0.594 . . . . 0.0 111.614 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.08 172.1 11.73 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.969 1.308 . . . . 0.0 108.816 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.2 m -60.45 -8.12 2.52 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -175.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -125.58 11.17 7.91 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.896 0.478 . . . . 0.0 111.11 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -152.14 16.68 0.65 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.436 0.295 . . . . 0.0 110.542 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -57.87 153.37 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.171 0.988 . . . . 0.0 111.106 -177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.432 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . 0.423 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.404 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.1 42.22 22.68 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.3 mt -136.84 -168.54 2.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.151 0.98 . . . . 0.0 110.953 -175.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -136.51 162.99 31.56 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 14.1 tp -152.93 29.71 0.51 Allowed 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.801 -169.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.453 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 37.4 tp -140.67 166.21 25.36 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.744 0.817 . . . . 0.0 109.054 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -137.31 6.57 2.81 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . 0.453 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 28.1 t-80 -63.17 153.69 33.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -68.23 163.73 22.14 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 -156.95 174.46 15.48 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.075 0.464 . . . . 0.0 110.704 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -149.37 173.48 13.48 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.422 0.689 . . . . 0.0 109.661 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -151.33 171.67 17.11 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.717 0.294 . . . . 0.0 110.98 -176.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.0 t60 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 116.983 -1.484 . . . . 0.0 109.513 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 C5'-C4'-O4' 113.993 3.423 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 O4'-C1'-N19 111.856 3.656 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C4'-C3'-C2' 99.084 -3.616 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.579 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.182 -3.518 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.579 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 O4'-C1'-N19 112.299 4.099 . 0.672 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.51 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 98.839 -3.861 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.51 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 98.946 -3.754 . 0.658 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.408 " H5'" HO2' ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.775 -2.925 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.847 0 C4'-C3'-C2' 99.879 -2.821 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.512 -3.188 . 0.569 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 99.28 -3.42 . 0.865 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.094 -3.606 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 N19-C1'-C2' 109.021 -2.737 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.504 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.928 0 C4'-C3'-C2' 99.368 -3.332 . 0.806 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.504 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.564 0 C4'-C3'-C2' 99.453 -3.247 . 0.67 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.533 3.333 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.497 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.0 0 C4'-C3'-C2' 99.816 -2.884 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.497 " H5'" HO2' ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.642 0 C4'-C3'-C2' 99.633 -3.067 . 0.764 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.482 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.397 -3.303 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 99.208 -3.492 . 0.766 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.45 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.793 -2.907 . 0.869 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.456 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.626 -3.074 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.532 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 1 O4'-C1'-N19 112.585 4.385 . 0.712 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.532 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C4'-C3'-C2' 99.838 -2.862 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.53 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.605 0 C4'-C3'-C2' 99.414 -3.286 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.316 -3.384 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C4'-C3'-C2' 98.63 -4.07 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.47 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 99.426 -3.274 . 0.896 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.522 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 99.869 -2.831 . 0.781 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.522 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.682 -3.018 . 0.776 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.511 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 O4'-C1'-N19 111.568 3.368 . 0.743 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.465 -3.235 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.213 0 C4'-C3'-C2' 99.428 -3.272 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.139 0 N19-C1'-C2' 108.36 -3.15 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.441 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.62 2.728 1 C4'-C3'-O3' 121.225 4.087 OUTLIER-EPSILON 0.112 1a . 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.524 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.642 3 C3'-C2'-C1' 105.963 4.959 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.407 -3.861 0 C4'-C3'-C2' 100.128 -2.572 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.13 -3.57 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.537 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 P--O5' 1.618 2.521 0 C4'-C3'-C2' 99.421 -3.279 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.537 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 P--O5' 1.616 2.303 0 C4'-C3'-C2' 99.512 -3.188 . 0.659 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.636 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.042 -3.658 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.488 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.22 -3.48 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.42 " H5'" HO2' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.071 1 C4'-C3'-C2' 97.998 -4.702 . 0.809 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.412 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.19 -3.51 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 98.891 -3.809 . 0.9 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.091 -3.609 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 0 C4'-C3'-C2' 99.926 -2.774 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.451 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.105 0 C4'-C3'-C2' 99.337 -3.363 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.451 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 100.364 -2.336 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.821 4.621 . 0.585 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.845 0 O4'-C1'-N19 111.596 3.396 . 0.603 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C4'-C3'-C2' 100.455 -2.245 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.448 HO2' " H5'" ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.382 3.182 . 0.855 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.448 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 99.2 -3.5 . 0.795 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.704 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 C4'-C3'-C2' 99.618 -3.082 . 0.51 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.704 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-C3' 111.219 -2.854 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.593 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.363 -3.337 . 0.678 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.415 HO2' " H5'" ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.995 -3.705 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.495 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 99.359 -3.341 . 0.737 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.495 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.389 -3.311 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.51 0 C4'-C3'-C2' 98.932 -3.768 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.481 HO2' " H5'" ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.018 -3.682 . 0.664 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.606 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.481 3.281 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.606 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C4'-C3'-C2' 99.745 -2.955 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.577 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.266 -3.434 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.577 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C4'-C3'-C2' 99.026 -3.674 . 0.695 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.452 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.015 -3.685 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.452 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.962 1 O4'-C1'-N19 112.393 4.193 . 0.756 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 O4'-C1'-N19 111.578 3.378 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.89 1 C4'-C3'-C2' 97.904 -4.796 . 0.752 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.908 0 O4'-C1'-N19 112.183 3.983 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 112.791 0.266 . . . . 0.0 112.791 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.9 177.06 48.36 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.11 154.56 62.23 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.511 2.808 . . . . 0.0 111.223 -178.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.81 7.46 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.336 0.654 . . . . 0.0 109.966 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.18 155.92 34.97 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.72 0.808 . . . . 0.0 109.566 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -73.82 -14.69 24.14 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.394 2.73 . . . . 0.0 112.344 -175.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.462 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.47 ' CB ' HG21 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.466 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.47 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.409 HG11 ' CE2' ' A' ' 69' ' ' PHE . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.424 HD22 ' HB1' ' A' ' 75' ' ' ALA . 10.0 t-20 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.584 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -148.62 64.07 7.52 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.21 -4.11 14.84 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 124.043 3.162 . . . . 0.0 111.462 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -150.54 29.45 0.69 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.057 0.543 . . . . 0.0 110.747 -176.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.424 ' HB1' HD22 ' A' ' 43' ' ' ASN . . . 62.39 16.32 8.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.139 0.976 . . . . 0.0 113.498 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.2 m -141.35 167.27 22.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.7 143.71 55.75 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.722 0.296 . . . . 0.0 110.448 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -156.97 9.16 0.2 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.177 0.591 . . . . 0.0 111.452 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -155.29 168.45 27.01 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 121.969 -0.457 . . . . 0.0 110.74 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.48 -174.68 0.9 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.797 0.839 . . . . 0.0 109.66 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.08 155.92 49.03 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.09 0.471 . . . . 0.0 109.944 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.9 mtm -147.66 166.18 28.21 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 171.08 177.89 41.23 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -152.63 167.36 29.15 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 124.201 1.0 . . . . 0.0 110.537 177.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.0 p -142.6 177.84 8.02 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 122.866 0.466 . . . . 0.0 111.084 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -149.4 -178.63 6.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.878 0.871 . . . . 0.0 110.7 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.3 m -132.21 26.52 4.52 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 122.996 0.518 . . . . 0.0 111.464 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.0 p -56.88 155.92 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.43 0.692 . . . . 0.0 110.877 179.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -139.25 7.27 2.39 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.283 0.633 . . . . 0.0 111.351 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.6 p -72.63 -5.19 35.69 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.882 0.473 . . . . 0.0 111.426 177.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 49.98 28.89 3.12 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.08 0.952 . . . . 0.0 112.031 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -145.24 160.59 41.24 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 121.974 -0.454 . . . . 0.0 111.171 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.6 m -69.2 167.47 16.17 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.133 0.973 . . . . 0.0 111.373 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.4 p -146.35 175.42 10.54 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.229 0.612 . . . . 0.0 109.879 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -155.48 168.19 27.93 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.176 0.59 . . . . 0.0 110.693 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -70.59 -3.76 19.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.996 0.518 . . . . 0.0 111.776 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.96 163.74 5.58 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.567 0.747 . . . . 0.0 111.874 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -95.94 -0.5 50.68 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.76 0.424 . . . . 0.0 111.847 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 39.01 59.19 5.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 123.956 0.902 . . . . 0.0 112.726 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.95 172.48 11.77 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.833 3.022 . . . . 0.0 110.137 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -149.28 174.57 12.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.432 0.293 . . . . 0.0 110.99 -176.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -150.76 168.09 25.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.889 178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.77 -3.26 55.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.995 0.518 . . . . 0.0 110.829 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 50.55 17.5 0.38 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.097 1.359 . . . . 0.0 113.349 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -146.02 167.95 22.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.933 0.893 . . . . 0.0 109.894 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 174.03 -170.05 43.14 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -145.12 166.2 26.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.472 0.709 . . . . 0.0 110.059 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -149.26 162.96 38.98 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.903 0.481 . . . . 0.0 110.036 -175.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.7 t -148.25 145.33 20.29 Favored Pre-proline 0 N--CA 1.451 -0.384 0 C-N-CA 123.381 0.672 . . . . 0.0 110.113 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.01 6.64 3.69 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 124.049 3.166 . . . . 0.0 111.823 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.06 145.46 16.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.105 0.411 . . . . 0.0 111.787 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -158.35 153.52 25.54 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.6 m -143.52 165.87 26.36 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.935 0.398 . . . . 0.0 111.057 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -146.87 138.72 13.53 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -177.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.72 166.52 25.83 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.04 2.493 . . . . 0.0 111.314 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.67 -174.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 1 C-N-CA 125.523 4.149 . . . . 0.0 113.877 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -131.12 -179.52 5.39 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.218 -178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -133.54 4.53 3.66 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.867 0.467 . . . . 0.0 111.804 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.2 p -158.33 162.53 1.41 Allowed 'Isoleucine or valine' 0 CA--C 1.526 0.057 0 C-N-CA 124.471 1.108 . . . . 0.0 108.296 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 171.58 -0.8 0.03 OUTLIER Glycine 0 CA--C 1.525 0.68 0 CA-C-O 119.704 -0.498 . . . . 0.0 113.493 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.4 t -152.55 165.94 33.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 110.612 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -153.1 10.8 0.46 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.103 0.561 . . . . 0.0 110.392 -179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.65 22.69 0.13 Allowed Glycine 0 CA--C 1.529 0.922 0 O-C-N 121.638 -0.664 . . . . 0.0 112.625 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -141.67 13.36 2.12 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 117.716 0.758 . . . . 0.0 111.518 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -152.68 163.12 40.28 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.071 0.548 . . . . 0.0 109.723 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 32.3 t -151.92 165.72 33.7 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.933 0.493 . . . . 0.0 110.115 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -155.8 174.14 15.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.223 0.609 . . . . 0.0 110.337 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 47.84 27.77 1.2 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.052 0.941 . . . . 0.0 113.059 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 50.9 m -142.98 178.37 7.73 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.084 0.554 . . . . 0.0 110.62 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -149.02 176.09 10.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.502 ' C ' ' H ' ' A' ' 133' ' ' VAL . . . 178.41 -171.16 43.45 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -175.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.08 24.04 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.904 1.282 . . . . 0.0 112.164 178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.502 ' H ' ' C ' ' A' ' 131' ' ' GLY . 27.5 m -124.13 -1.54 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.746 0.819 . . . . 0.0 111.533 -177.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.4 m 41.55 39.51 1.12 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.11 -10.87 7.0 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 26.5 t -157.54 170.48 22.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -146.34 3.78 0.9 Allowed 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.084 0.554 . . . . 0.0 111.015 179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.438 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 42.2 m -145.98 41.15 0.28 Allowed Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 123.59 0.756 . . . . 0.0 111.715 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 138' ' ' SER . 45.0 Cg_endo -78.81 4.32 6.56 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.649 2.233 . . . . 0.0 112.38 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 42.3 t -56.04 -43.73 99.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.48 10.04 3.2 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 123.213 2.608 . . . . 0.0 111.448 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.57 20.49 2.36 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.402 0.681 . . . . 0.0 110.991 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 77.5 p -64.53 -4.27 3.89 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.269 0.627 . . . . 0.0 111.936 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 tp -147.78 151.15 35.54 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.7 p -146.87 173.22 12.61 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.337 0.655 . . . . 0.0 110.168 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.402 ' N ' ' HD3' ' A' ' 147' ' ' PRO . 77.5 mt-30 -141.35 61.97 14.81 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 122.836 0.454 . . . . 0.0 111.041 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.402 ' HD3' ' N ' ' A' ' 146' ' ' GLN . 76.8 Cg_exo -50.74 156.22 4.75 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.728 2.952 . . . . 0.0 112.826 177.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.34 172.95 13.91 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.529 2.819 . . . . 0.0 109.976 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.5 tp -146.97 71.5 12.28 Favored Pre-proline 0 CA--C 1.535 0.378 0 O-C-N 121.941 -0.474 . . . . 0.0 111.47 -178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.06 163.88 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.638 2.892 . . . . 0.0 111.353 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.1 tt -148.55 141.15 15.07 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 122.562 0.345 . . . . 0.0 110.468 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.78 166.31 2.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.527 2.818 . . . . 0.0 112.239 172.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -51.59 148.84 19.81 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.698 2.932 . . . . 0.0 112.133 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -74.63 174.64 12.29 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.681 2.921 . . . . 0.0 110.995 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -60.61 158.04 33.53 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.55 145.76 28.4 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.585 2.857 . . . . 0.0 112.472 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.47 161.7 41.8 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.812 3.008 . . . . 0.0 110.851 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.67 -13.8 19.94 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.969 3.113 . . . . 0.0 111.221 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 87.7 p -156.48 176.11 13.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.084 0.554 . . . . 0.0 110.35 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -175.08 170.68 43.82 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.45 163.84 36.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.11 0.564 . . . . 0.0 110.944 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -69.44 117.72 55.44 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 123.078 0.551 . . . . 0.0 110.23 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.08 -13.44 11.37 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 124.456 3.437 . . . . 0.0 111.913 -171.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.49 ' CG ' HG11 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -76.98 176.85 8.25 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 68.3 m -145.52 27.67 1.22 Allowed 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.432 0.693 . . . . 0.0 111.354 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.37 -171.02 14.68 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -139.56 0.82 1.88 Allowed 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.167 -0.921 . . . . 0.0 113.091 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 69.1 m 114.46 -10.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.849 2.46 . . . . 0.0 111.628 174.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -86.96 -32.17 20.24 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -144.7 151.86 39.54 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm -153.39 147.6 25.75 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 119.813 -0.755 . . . . 0.0 112.389 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . 0.415 ' CZ ' " H5'" ' B' ' 247' ' ' ' U' . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.49 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . 0.468 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 56.22 31.79 19.08 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 78.8 mt -139.26 -168.9 2.55 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.565 1.146 . . . . 0.0 110.097 -174.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -148.87 171.49 16.22 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.973 -0.455 . . . . 0.0 110.025 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.45 9.75 0.75 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.214 1.006 . . . . 0.0 111.822 -179.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 50.6 tp -140.93 146.64 37.66 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.292 0.637 . . . . 0.0 109.838 178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -139.83 20.79 2.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.796 0.838 . . . . 0.0 109.749 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 62.1 m80 -140.42 -177.98 5.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.0 0.52 . . . . 0.0 110.069 -174.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -143.74 28.57 1.43 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.478 0.711 . . . . 0.0 109.96 -175.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -69.27 -2.98 12.06 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -64.19 168.38 5.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.88 0.472 . . . . 0.0 110.998 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -70.56 -7.59 45.04 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.165 0.586 . . . . 0.0 112.089 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.635 -1.174 . . . . 0.0 110.54 -178.934 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.401 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.92 1 C4'-C3'-C2' 98.627 -4.073 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.491 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 99.186 -3.514 . 0.674 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.491 " H5'" HO2' ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 O4'-C1'-N19 110.891 2.691 . 0.795 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.531 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 98.74 -3.96 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.531 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.385 1 O4'-C1'-N19 112.209 4.009 . 0.687 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.528 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.568 3.368 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.528 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.817 3.617 . 0.609 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.434 HO2' " H5'" ' B' ' 245' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.434 " H5'" HO2' ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.347 -3.353 . 0.795 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.554 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.216 0 N19-C1'-C2' 108.196 -3.253 . 0.737 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.554 " H5'" HO2' ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.048 0 O4'-C1'-N19 111.38 3.18 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.544 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.133 -3.567 . 0.698 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.424 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.898 0 C4'-C3'-C2' 99.283 -3.417 . 0.834 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.444 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C4'-C3'-C2' 100.098 -2.602 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.444 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.551 0 C4'-C3'-C2' 98.802 -3.898 . 0.827 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.569 -3.131 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.417 -3.283 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.607 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.132 -3.568 . 0.752 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.607 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C4'-C3'-C2' 100.047 -2.653 . 0.632 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.721 -2.979 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.438 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.207 0 C4'-C3'-C2' 99.789 -2.911 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.438 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C4'-C3'-C2' 98.789 -3.911 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.577 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 O4'-C1'-N19 112.25 4.05 . 0.728 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.577 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.006 0 C4'-C3'-C2' 99.017 -3.683 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.535 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 C4'-C3'-C2' 98.581 -4.119 . 0.817 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.421 " H5'" HO2' ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.02 1 C4'-C3'-C2' 98.58 -4.12 . 0.822 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.072 0 C4'-C3'-C2' 99.513 -3.187 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.537 -3.163 . 0.912 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.535 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.875 0 C4'-C3'-C2' 99.76 -2.94 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.535 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.377 3.177 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.485 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.862 3.662 . 0.624 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.428 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.368 -3.332 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.428 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.125 -3.575 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.04 0 N19-C1'-C2' 108.461 -3.087 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.401 " H4'" " C5'" ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 2 C4'-C3'-O3' 121.535 4.206 . 0.328 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.401 " C5'" " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.415 -3.15 1 P-O3'-C3' 125.075 4.479 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.444 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.036 1 C4'-C3'-C2' 98.438 -4.262 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.444 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 O4'-C1'-N19 111.416 3.216 . 0.581 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.196 0 C4'-C3'-C2' 99.135 -3.565 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.521 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 O4'-C1'-N19 111.677 3.477 . 0.747 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.584 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.625 0 C4'-C3'-C2' 99.109 -3.591 . 0.694 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.473 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 98.926 -3.774 . 0.912 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.404 " H5'" HO2' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.01 1 C4'-C3'-C2' 98.607 -4.093 . 0.833 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.552 0 C4'-C3'-C2' 99.481 -3.219 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.415 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.415 1 C4'-C3'-C2' 98.57 -4.13 . 0.883 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.541 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 98.88 -3.82 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.541 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.589 -3.111 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.434 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 C4'-C3'-C2' 99.896 -2.804 . 0.933 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.434 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.824 -2.876 . 0.887 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.454 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 1 O4'-C1'-N19 113.46 5.26 . 0.519 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.624 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.623 3.007 0 C5'-C4'-O4' 113.788 3.277 . 0.475 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.624 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C5'-C4'-C3' 111.155 -2.897 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.499 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.218 0 C4'-C3'-C2' 99.001 -3.699 . 0.836 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.566 HO2' " H5'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.346 2 O4'-C1'-N19 112.419 4.219 . 0.798 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.566 " H5'" HO2' ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 110.815 2.615 . 0.404 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.627 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 O4'-C1'-N19 111.335 3.135 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.627 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.023 -3.677 . 0.746 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.51 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.77 3.57 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.472 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 O4'-C1'-N19 111.145 2.945 . 0.855 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.574 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.954 -3.746 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.574 " H5'" HO2' ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.113 -3.587 . 0.627 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C4'-C3'-C2' 99.119 -3.581 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 100.169 -2.531 . 0.866 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.553 HO2' " C5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 99.828 -2.872 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.553 " C5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 P--O5' 1.617 2.44 0 C4'-C3'-C2' 98.989 -3.711 . 0.528 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.456 0 C4'-C3'-C2' 99.06 -3.64 . 0.637 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.245 -3.455 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 112.154 3.954 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C4'-C3'-C2' 99.531 -3.169 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 97.968 -4.732 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.472 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.353 0 O4'-C1'-N19 111.882 3.682 . 0.73 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 CA--C 1.529 0.257 0 CA-C-O 120.36 0.067 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.93 54.72 0.12 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.511 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.31 155.96 65.91 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.449 2.766 . . . . 0.0 111.142 -176.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.7 p -159.4 151.81 6.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 123.267 0.627 . . . . 0.0 109.348 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -160.85 162.66 22.33 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 122.834 0.454 . . . . 0.0 109.92 178.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.11 -39.61 79.55 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.246 2.63 . . . . 0.0 114.338 -178.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.528 HD23 ' HH ' ' A' ' 22' ' ' TYR . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.409 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.528 ' HH ' HD23 ' A' ' 13' ' ' LEU . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.503 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.453 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.4 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.481 ' HZ1' ' P ' ' B' ' 278' ' ' ' U' . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.562 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.409 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.409 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -148.03 63.68 7.65 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -69.88 -42.58 3.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.248 2.632 . . . . 0.0 110.712 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -173.25 -18.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.732 0.813 . . . . 0.0 110.637 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.401 ' C ' ' H ' ' A' ' 77' ' ' GLU . . . -153.83 -176.34 5.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.254 0.621 . . . . 0.0 110.93 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.3 p -67.84 20.12 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.715 1.606 . . . . 0.0 113.757 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.401 ' H ' ' C ' ' A' ' 75' ' ' ALA . 44.2 mt-10 -59.25 -14.45 11.09 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.607 0.64 . . . . 0.0 112.343 -177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.07 -16.75 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.856 0.462 . . . . 0.0 111.71 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -75.37 -0.36 19.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.22 0.608 . . . . 0.0 111.332 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.2 mt -131.73 22.1 4.63 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.055 0.942 . . . . 0.0 109.657 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.73 -178.6 6.18 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.24 1.016 . . . . 0.0 110.3 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -58.97 165.19 2.53 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.218 0.533 . . . . 0.0 111.817 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -171.16 -173.13 37.98 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -56.46 158.01 4.68 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.642 0.777 . . . . 0.0 112.584 -178.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.8 m -149.65 152.94 36.23 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.205 1.002 . . . . 0.0 108.737 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.9 tp -152.63 137.71 17.31 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.5 t -155.55 7.66 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.274 0.358 . . . . 0.0 111.24 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.51 142.25 15.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.105 0 CA-C-O 120.944 0.402 . . . . 0.0 110.678 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -151.24 17.62 0.74 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.344 0.658 . . . . 0.0 110.673 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.4 p -140.27 -179.56 6.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.506 1.122 . . . . 0.0 110.868 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -145.22 168.41 20.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.461 0.705 . . . . 0.0 109.815 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.51 159.11 10.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.27 0.557 . . . . 0.0 111.163 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.4 p -73.1 171.49 12.82 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.196 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.7 m -79.87 11.1 3.49 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.122 0.569 . . . . 0.0 111.835 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.56 167.92 2.41 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.356 1.063 . . . . 0.0 111.378 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -146.05 152.96 40.18 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.93 15.86 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -141.84 143.48 33.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.946 0.499 . . . . 0.0 110.126 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -157.48 165.79 17.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 122.949 0.5 . . . . 0.0 109.957 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.91 173.93 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.675 3.583 . . . . 0.0 115.19 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -130.86 17.19 5.18 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.95 0.9 . . . . 0.0 110.248 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 41.0 p -131.94 15.35 4.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.93 0.892 . . . . 0.0 109.93 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp -149.95 165.92 31.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.041 0.936 . . . . 0.0 108.918 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -150.27 166.79 28.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.624 0.25 . . . . 0.0 111.032 -176.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -152.67 -15.48 0.16 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.419 ' C ' ' H ' ' A' ' 108' ' ' GLU . . . 156.23 -1.6 0.15 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.645 -0.66 . . . . 0.0 112.996 -177.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -71.46 23.8 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.071 0.949 . . . . 0.0 112.415 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.419 ' H ' ' C ' ' A' ' 106' ' ' GLY . 34.1 mt-10 60.35 6.35 1.02 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.123 0.969 . . . . 0.0 112.566 -173.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.524 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 27.3 p -78.63 -13.65 0.21 Allowed Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 115.713 1.745 . . . . 0.0 115.713 175.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 109' ' ' THR . 55.6 Cg_exo -52.4 -14.73 3.19 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.093 2.529 . . . . 0.0 115.272 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.4 124.37 20.44 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.243 0.474 . . . . 0.0 110.782 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -159.04 174.36 15.04 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.591 0.756 . . . . 0.0 111.136 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.9 m -145.67 155.13 42.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.108 0.963 . . . . 0.0 109.122 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -147.92 156.69 44.12 Favored Pre-proline 0 N--CA 1.455 -0.207 0 C-N-CA 122.86 0.464 . . . . 0.0 110.284 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.91 166.84 27.72 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.367 2.711 . . . . 0.0 110.469 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.76 177.03 6.72 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.927 3.084 . . . . 0.0 111.325 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -143.1 22.2 1.9 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.582 0.353 . . . . 0.0 110.301 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -139.92 170.9 15.01 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.728 0.299 . . . . 0.0 110.275 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.02 174.76 4.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 C-N-CA 122.925 0.49 . . . . 0.0 110.776 -176.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.14 -16.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.1 t -155.81 153.25 29.5 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.762 0.825 . . . . 0.0 109.35 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -156.53 -3.0 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.493 0.317 . . . . 0.0 111.367 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.09 29.26 0.04 OUTLIER Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.31 10.75 1.91 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.895 0.478 . . . . 0.0 111.403 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.58 -179.93 1.52 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.107 0.48 . . . . 0.0 111.123 175.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.0 p -143.03 27.67 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.262 0.625 . . . . 0.0 110.82 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -114.53 5.01 15.37 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.2 p -152.49 172.32 16.73 Favored 'General case' 0 N--CA 1.458 -0.062 0 CA-C-O 121.068 0.461 . . . . 0.0 110.619 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.6 m -147.03 -177.32 5.6 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 0.0 109.741 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 92.5 p -149.05 -178.94 6.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.363 0.601 . . . . 0.0 111.44 -177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -101.74 24.89 29.91 Favored Glycine 0 CA--C 1.53 1.003 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -136.52 26.14 3.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.628 0.771 . . . . 0.0 110.344 -177.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.7 p -136.46 20.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 122.942 0.497 . . . . 0.0 109.935 -177.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.0 m 53.83 31.26 12.8 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.794 0.838 . . . . 0.0 112.673 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 44.9 tp -52.3 144.54 12.65 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.222 0.609 . . . . 0.0 110.828 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.3 m -64.2 170.37 3.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.313 0.645 . . . . 0.0 111.58 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -150.87 170.02 20.31 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.198 0.599 . . . . 0.0 110.475 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -150.97 157.8 35.23 Favored Pre-proline 0 C--O 1.23 0.065 0 C-N-CA 123.181 0.592 . . . . 0.0 110.251 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.85 161.33 42.68 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.918 2.412 . . . . 0.0 111.297 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.82 161.28 40.92 Favored Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 124.02 0.928 . . . . 0.0 110.149 -176.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.51 170.47 14.93 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.544 2.163 . . . . 0.0 110.532 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.04 170.36 17.31 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.108 0.48 . . . . 0.0 111.27 -178.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.4 t -151.31 -172.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.106 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -137.5 -177.69 4.9 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -177.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 2.5 m -136.74 18.21 3.07 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.936 0.494 . . . . 0.0 111.006 -175.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 85.7 mt-30 -138.81 39.43 0.38 Allowed Pre-proline 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 0.0 111.898 -178.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 92.2 Cg_endo -71.73 166.66 28.8 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.922 2.415 . . . . 0.0 110.183 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.79 165.52 29.41 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.268 2.645 . . . . 0.0 110.089 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.8 mp -62.23 147.47 91.08 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.16 170.77 19.03 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.767 2.978 . . . . 0.0 110.92 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.3 mm -139.25 131.6 15.35 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.06 152.86 9.88 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.964 3.11 . . . . 0.0 112.902 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.2 155.68 63.93 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.951 3.101 . . . . 0.0 110.902 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.82 -13.02 16.55 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.313 3.342 . . . . 0.0 113.984 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -155.28 154.25 28.23 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.03 0.532 . . . . 0.0 110.116 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.03 155.77 64.25 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.6 2.866 . . . . 0.0 110.892 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.44 158.37 54.26 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.493 2.795 . . . . 0.0 111.147 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -80.37 11.46 2.86 Favored 'Trans proline' 0 N--CA 1.454 -0.794 1 C-N-CA 125.508 4.138 . . . . 0.0 111.972 178.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 71.9 p -61.73 169.73 2.32 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.577 0.751 . . . . 0.0 112.575 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.07 -175.21 38.83 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -70.31 -11.18 60.73 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.891 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 60.5 168.66 0.08 OUTLIER Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.95 0.9 . . . . 0.0 110.999 -178.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.426 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 72.8 Cg_endo -74.97 -11.47 21.54 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.686 1.59 . . . . 0.0 111.061 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . 0.426 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.439 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.16 168.13 17.98 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.0 t -163.04 164.04 25.7 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.67 175.12 18.6 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 123.445 0.466 . . . . 0.0 112.354 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.82 167.6 21.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.97 0.508 . . . . 0.0 110.115 175.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 43.3 m -61.62 -8.0 3.98 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -130.93 13.82 5.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 118.071 0.396 . . . . 0.0 110.626 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 20.42 1.13 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.06 157.86 9.53 Favored 'General case' 0 C--O 1.23 0.041 0 C-N-CA 124.933 1.293 . . . . 0.0 111.065 -177.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.439 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.466 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 59.08 36.41 24.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 94.3 mt -137.98 -166.79 2.03 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.543 1.137 . . . . 0.0 110.537 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.434 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 26.5 t-80 -147.97 -173.08 4.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.311 0.645 . . . . 0.0 109.361 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.434 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 11.9 tp -137.94 -2.5 1.89 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.7 tp -146.79 -6.21 0.52 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.43 -0.794 . . . . 0.0 112.304 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.64 6.18 3.46 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.971 0.508 . . . . 0.0 111.714 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -152.51 8.52 0.45 Allowed 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.885 0.374 . . . . 0.0 111.116 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -156.58 163.97 38.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -146.37 165.19 30.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.09 0.556 . . . . 0.0 110.762 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -149.19 6.58 0.68 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.979 0.419 . . . . 0.0 111.149 -178.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -146.31 11.75 1.18 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.251 0.62 . . . . 0.0 110.757 -177.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 74.4 t60 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 117.291 -1.338 . . . . 0.0 110.025 -177.932 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.08 -3.62 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.487 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 98.935 -3.765 . 0.73 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.487 " H5'" HO2' ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 99.21 -3.49 . 0.787 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.507 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.349 -3.351 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.507 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 O4'-C1'-N19 112.139 3.939 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.562 0 C4'-C3'-C2' 98.867 -3.833 . 0.764 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 C4'-C3'-C2' 99.188 -3.512 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C4'-C3'-C2' 100.013 -2.687 . 0.712 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.803 0 C4'-C3'-C2' 99.046 -3.654 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.461 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.182 0 C4'-C3'-C2' 99.172 -3.528 . 0.652 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.617 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.826 0 C4'-C3'-C2' 98.737 -3.963 . 0.813 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.617 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.676 -3.024 . 0.71 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.1 0 C4'-C3'-C2' 99.545 -3.155 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.612 -3.088 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.553 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 P--O5' 1.62 2.694 0 C4'-C3'-C2' 98.724 -3.976 . 0.761 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.553 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.492 -3.208 . 0.617 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.711 3.511 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 C4'-C3'-C2' 99.625 -3.075 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.677 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.274 -3.426 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.677 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 99.406 -3.294 . 0.652 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.441 " H5'" HO2' ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.89 0 C4'-C3'-C2' 100.045 -2.655 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.578 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 99.487 -3.213 . 0.907 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.578 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.468 1 O4'-C1'-N19 113.098 4.898 . 0.726 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.478 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 O4'-C1'-N19 111.277 3.077 . 0.763 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.478 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.834 0 C4'-C3'-C2' 98.816 -3.884 . 0.85 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.405 " H5'" HO2' ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.87 1 C4'-C3'-C2' 98.669 -4.031 . 0.802 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.503 -3.197 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.199 -3.501 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.566 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.437 0 C4'-C3'-C2' 100.06 -2.64 . 0.82 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.566 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 C4'-C3'-C2' 99.854 -2.846 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.442 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 99.45 -3.25 . 0.78 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C4'-C3'-C2' 100.005 -2.695 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.124 0 N19-C1'-C2' 108.76 -2.9 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C5'-C4'-C3' 109.357 -4.096 . 0.241 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.453 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.545 2.73 0 C4'-C3'-O3' 120.434 3.782 OUTLIER-EPSILON 0.088 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.565 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.824 2 P-O3'-C3' 125.998 5.248 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.563 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.914 1 C4'-C3'-C2' 98.105 -4.595 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.694 HO2' " H5'" ' B' ' 275' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.404 -4.057 1 N19-C1'-C2' 120.874 4.671 . 0.297 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.694 " H5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 P-O3'-C3' 123.061 2.801 . 0.424 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.461 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C4'-C3'-C2' 98.967 -3.733 . 0.846 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.562 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.565 1 C4'-C3'-C2' 98.675 -4.025 . 0.608 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.491 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.083 2.883 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 C4'-C3'-C2' 98.572 -4.128 . 0.821 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.403 HO2' " H5'" ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C4'-C3'-C2' 98.873 -3.827 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.423 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C4'-C3'-C2' 99.287 -3.413 . 0.911 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.423 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C4'-C3'-C2' 99.304 -3.396 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C4'-C3'-C2' 99.906 -2.794 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 100.029 -2.671 . 0.928 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 C4'-C3'-C2' 99.93 -2.77 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.512 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.261 2 O4'-C1'-N19 113.233 5.033 . 0.578 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.709 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 111.489 3.289 . 0.464 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.709 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.438 -2.708 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.589 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.202 -3.498 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.487 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.116 -3.584 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.596 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C4'-C3'-C2' 99.816 -2.884 . 0.535 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.656 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 O4'-C1'-N19 111.578 3.378 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.656 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 C4'-C3'-C2' 99.625 -3.075 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 1 C4'-C3'-C2' 98.643 -4.057 . 0.747 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.464 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.158 -3.542 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.464 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 C4'-C3'-C2' 99.152 -3.548 . 0.794 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.623 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 98.839 -3.861 . 0.623 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.623 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.165 -3.535 . 0.533 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.478 " H5'" HO2' ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.93 0 C5'-C4'-C3' 111.191 -2.873 . 0.826 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 O4'-C1'-N19 111.069 2.869 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.543 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.185 -3.515 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.543 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C4'-C3'-C2' 98.787 -3.913 . 0.737 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.466 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.49 1 C4'-C3'-C2' 98.636 -4.064 . 0.76 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.419 HO2' " H5'" ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.144 3.944 . 0.804 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.419 " H5'" HO2' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.457 -3.243 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.494 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.35 1 C4'-C3'-C2' 98.18 -4.52 . 0.774 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.494 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.759 3.559 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 CA--C 1.531 0.345 0 N-CA-C 113.028 0.357 . . . . 0.0 113.028 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.79 -173.26 44.68 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 -178.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.28 -6.97 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 124.195 3.263 . . . . 0.0 111.789 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m 44.75 33.05 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 125.191 1.396 . . . . 0.0 112.647 178.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -50.28 145.61 9.88 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 123.231 0.612 . . . . 0.0 111.968 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -79.53 -13.35 13.46 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.092 2.528 . . . . 0.0 112.329 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.412 HD21 ' CE1' ' A' ' 22' ' ' TYR . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.412 ' CE1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.537 ' C ' HG22 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.471 ' CB ' HG21 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.537 HG22 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.455 HG12 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.479 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CZ ' HG12 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -147.15 64.53 8.94 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.26 -8.32 23.2 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.648 2.898 . . . . 0.0 112.098 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -159.22 171.71 19.37 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.714 0.806 . . . . 0.0 109.13 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.73 156.2 20.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 117.86 0.3 . . . . 0.0 110.378 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.5 m -147.19 172.49 13.73 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.918 0.389 . . . . 0.0 110.32 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -156.29 168.98 25.63 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.462 0.705 . . . . 0.0 109.343 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.63 166.1 34.42 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.629 0.252 . . . . 0.0 110.97 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.7 t-80 -146.66 11.3 1.1 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.437 0.695 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.38 19.2 9.74 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.896 1.278 . . . . 0.0 109.062 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.26 -175.34 3.96 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.826 0.851 . . . . 0.0 110.095 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -140.58 173.27 11.66 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.126 0.571 . . . . 0.0 111.516 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.09 17.41 0.46 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -64.45 -11.13 30.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.662 0.731 . . . . 0.0 112.122 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 95.1 m -58.19 149.24 24.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.1 tp -148.76 165.78 30.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.423 0.689 . . . . 0.0 109.572 -179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.9 m -142.27 173.49 11.48 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.45 0.7 . . . . 0.0 111.035 -177.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.419 HG13 ' H ' ' A' ' 90' ' ' THR . 16.1 t -61.43 166.8 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.036 0.934 . . . . 0.0 110.438 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -124.84 18.14 8.61 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.505 0.722 . . . . 0.0 111.842 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.419 ' H ' HG13 ' A' ' 88' ' ' VAL . 63.3 p -142.83 165.93 26.04 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -155.6 173.44 16.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.254 -0.279 . . . . 0.0 111.122 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -150.74 167.82 26.24 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.267 1.027 . . . . 0.0 108.843 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.8 t -62.76 161.52 12.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.999 0.428 . . . . 0.0 110.718 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.5 m -149.04 165.76 30.71 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.393 0.677 . . . . 0.0 109.979 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.66 173.86 16.33 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.175 0.59 . . . . 0.0 110.416 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.69 169.44 21.6 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 122.949 0.499 . . . . 0.0 110.358 178.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.88 164.83 37.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 110.238 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -157.82 170.25 22.77 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.005 0.922 . . . . 0.0 108.946 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -60.32 147.62 81.46 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 122.838 0.455 . . . . 0.0 110.32 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -72.5 169.25 22.23 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.492 2.795 . . . . 0.0 111.393 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -148.66 3.32 0.64 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.286 0.634 . . . . 0.0 110.038 178.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 40.1 p -71.47 177.45 3.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.334 0.654 . . . . 0.0 110.562 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 22.8 tp -142.49 18.03 2.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.294 0.638 . . . . 0.0 110.096 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -139.4 17.01 2.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.806 0.442 . . . . 0.0 111.308 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -77.39 12.39 1.57 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.275 0.63 . . . . 0.0 110.808 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.71 -173.99 24.19 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -136.65 3.12 2.73 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 117.246 0.523 . . . . 0.0 112.177 -174.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 47.27 -159.58 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.365 1.066 . . . . 0.0 113.082 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.7 p -62.75 159.42 44.48 Favored Pre-proline 0 C--O 1.235 0.299 0 C-N-CA 124.056 0.943 . . . . 0.0 111.736 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.13 -179.44 3.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.952 3.101 . . . . 0.0 111.152 177.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -136.39 12.15 3.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.114 0.566 . . . . 0.0 111.721 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -143.31 12.13 1.75 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 123.525 0.73 . . . . 0.0 111.682 -178.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.4 m -144.33 7.64 1.35 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.25 0.62 . . . . 0.0 111.981 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.31 160.42 58.53 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.535 0.734 . . . . 0.0 110.717 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -50.34 -43.73 42.49 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 124.477 3.451 . . . . 0.0 115.634 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -74.27 -169.12 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.9 2.4 . . . . 0.0 111.286 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -133.4 145.88 50.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.286 0.565 . . . . 0.0 111.094 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -150.31 172.76 14.87 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.685 1.194 . . . . 0.0 109.719 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.5 p -153.16 154.92 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.289 0.636 . . . . 0.0 109.703 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.03 -15.77 0.11 Allowed Glycine 0 CA--C 1.528 0.879 0 CA-C-O 119.891 -0.394 . . . . 0.0 112.691 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.8 m -71.09 -1.64 12.96 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 117.529 0.664 . . . . 0.0 111.986 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -150.74 173.89 13.66 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.269 0.628 . . . . 0.0 110.361 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.6 21.66 0.16 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.37 172.27 3.33 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.361 0.664 . . . . 0.0 112.579 -178.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -152.92 177.57 10.62 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.477 0.711 . . . . 0.0 109.695 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 22.7 t -149.15 176.02 10.86 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -150.39 169.51 21.25 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.433 0.693 . . . . 0.0 110.133 -176.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 77.8 p -154.27 -179.77 8.24 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.711 0.405 . . . . 0.0 111.112 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 78.6 p -151.13 171.27 17.63 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.833 0.853 . . . . 0.0 109.786 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.2 m -73.59 -7.85 53.59 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.45 178.56 40.23 Favored Glycine 0 CA--C 1.527 0.824 0 O-C-N 122.16 -0.337 . . . . 0.0 112.533 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -151.12 163.37 38.96 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.572 0.749 . . . . 0.0 109.423 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 m 37.76 41.55 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.4 1.08 . . . . 0.0 112.718 -176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.7 m -128.97 19.37 6.01 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.108 0.563 . . . . 0.0 110.976 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.7 mt 54.09 28.19 8.56 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.896 0.878 . . . . 0.0 113.055 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 22.3 t -141.34 -3.98 1.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.318 -0.239 . . . . 0.0 111.543 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.69 169.89 14.81 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.1 p -160.53 160.2 25.84 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.158 178.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.18 162.31 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 124.069 3.179 . . . . 0.0 112.736 174.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 23.8 t -141.87 125.08 9.63 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.58 0.352 . . . . 0.0 110.313 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.76 -179.82 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 124.35 3.367 . . . . 0.0 113.418 173.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 54.44 18.25 1.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.547 1.139 . . . . 0.0 113.834 176.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 86.1 p -146.43 1.06 0.81 Allowed 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 118.057 0.389 . . . . 0.0 111.677 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 95.6 mt -142.87 3.13 1.4 Allowed 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.353 1.061 . . . . 0.0 110.18 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 15.1 t -159.64 175.46 13.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.857 0.863 . . . . 0.0 110.451 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -142.37 151.86 59.11 Favored Pre-proline 0 N--CA 1.456 -0.174 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.72 168.56 24.18 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 122.88 2.387 . . . . 0.0 111.961 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.53 169.81 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 124.986 3.79 . . . . 0.0 113.355 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -53.9 148.1 21.81 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.167 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.51 -1.05 11.08 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 124.031 3.154 . . . . 0.0 113.507 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 44.6 mm -61.89 133.63 93.88 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -177.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.17 170.88 18.77 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.896 3.064 . . . . 0.0 111.109 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -49.49 159.34 1.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.062 3.175 . . . . 0.0 112.728 175.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.52 152.87 11.52 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.761 2.974 . . . . 0.0 113.41 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.45 158.81 32.68 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.725 0.81 . . . . 0.0 109.051 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -48.08 115.56 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.843 3.029 . . . . 0.0 112.707 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -80.03 166.59 20.81 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 124.539 3.492 . . . . 0.0 111.049 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.57 166.55 29.06 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.331 2.688 . . . . 0.0 110.241 173.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.9 t -150.59 1.68 0.45 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 169.93 -6.89 0.04 OUTLIER Glycine 0 C--N 1.344 1.021 0 CA-C-N 118.266 0.484 . . . . 0.0 112.803 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -143.9 172.44 12.86 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.92 0.888 . . . . 0.0 109.115 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 50.8 p30 -144.22 155.72 57.98 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 122.854 0.462 . . . . 0.0 110.249 -178.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.77 -19.8 23.49 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.05 2.5 . . . . 0.0 111.454 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.25 166.44 24.52 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 89.4 p -163.86 156.14 17.36 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 123.577 0.751 . . . . 0.0 109.809 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 158.79 -163.63 33.24 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-O 121.335 0.408 . . . . 0.0 112.329 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -128.49 6.31 5.72 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.141 0.576 . . . . 0.0 111.402 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.9 m 102.86 -21.27 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 128.023 2.529 . . . . 0.0 111.885 173.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -111.12 4.83 19.66 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.95 0.795 . . . . 0.0 111.691 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.94 18.0 0.98 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 177.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -61.43 153.37 27.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.26 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.71 34.66 22.12 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.42 -155.74 0.62 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.623 1.169 . . . . 0.0 109.068 -176.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -138.39 -55.34 0.63 Allowed 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 121.339 -0.851 . . . . 0.0 110.606 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 5.7 tp -168.4 23.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.402 0.681 . . . . 0.0 110.224 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 6.0 mp 56.0 16.0 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.36 1.064 . . . . 0.0 111.742 -178.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 2.2 9.71 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.898 -0.501 . . . . 0.0 111.941 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -148.37 178.8 8.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.293 0.637 . . . . 0.0 110.332 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -140.65 31.69 1.85 Allowed 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 122.655 0.382 . . . . 0.0 110.982 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 64.3 m80 55.54 17.92 2.49 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.831 0.852 . . . . 0.0 112.206 -176.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -64.05 174.39 1.55 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.962 0.905 . . . . 0.0 111.008 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -151.59 165.82 33.11 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.554 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.8 t60 . . . . . 0 C--O 1.252 1.227 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.62 -177.845 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . 0.503 HO2' " H5'" ' B' ' 238' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.173 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.503 " H5'" HO2' ' B' ' 237' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 O4'-C1'-N19 111.963 3.763 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.506 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.007 1 O4'-C1'-N19 112.225 4.025 . 0.765 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.506 " H5'" HO2' ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C4'-C3'-C2' 99.121 -3.579 . 0.752 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.489 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.854 1 O4'-C1'-N19 112.525 4.325 . 0.642 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C5'-C4'-O4' 113.251 2.894 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.839 -3.861 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.607 -3.093 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.833 -2.867 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.163 2.963 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.308 0 C4'-C3'-C2' 99.111 -3.589 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.092 -3.608 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.418 -3.282 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.505 -3.195 . 0.754 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.637 -4.063 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.408 HO2' " H5'" ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.142 -3.558 . 0.657 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.408 " H5'" HO2' ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.266 -3.434 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.015 0 C4'-C3'-C2' 98.965 -3.735 . 0.715 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 O4'-C1'-N19 111.134 2.934 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.436 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 C4'-C3'-C2' 99.143 -3.557 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.455 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.144 0 C4'-C3'-C2' 99.862 -2.838 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.538 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.809 -3.891 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.538 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 O4'-C1'-N19 112.157 3.957 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.531 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C5'-C4'-C3' 110.549 -3.3 . 0.815 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.531 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.808 3.608 . 0.852 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.544 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 98.724 -3.976 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.544 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.284 1 C4'-C3'-C2' 98.584 -4.116 . 0.647 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.502 -3.198 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.482 -3.218 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.561 3.361 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.58 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.117 -3.583 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.58 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 99.294 -3.406 . 0.742 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 98.991 -3.709 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 N19-C1'-C2' 108.367 -3.146 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.409 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.546 2.735 1 C4'-C3'-O3' 121.228 4.088 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.517 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.699 2 P-O3'-C3' 125.568 4.89 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.625 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.241 1 C4'-C3'-C2' 98.601 -4.099 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.625 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.895 2 N19-C1'-C2' 123.308 6.192 . 0.297 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.486 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.032 2.832 . 0.372 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.486 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.815 -3.885 . 0.882 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.479 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.415 -3.146 0 C4'-C3'-C2' 99.111 -3.589 . 0.713 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.479 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-O4' 112.718 2.513 . 0.889 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.468 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.242 -3.458 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.468 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.24 -3.46 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.034 -3.666 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.082 0 C4'-C3'-C2' 98.839 -3.861 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.427 -3.273 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.831 1 C4'-C3'-C2' 98.432 -4.268 . 0.861 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-C3' 111.442 -2.705 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.191 1 O4'-C1'-N19 113.072 4.872 . 0.537 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.463 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.618 2.49 0 C5'-C4'-O4' 113.183 2.845 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.502 HO2' " H5'" ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 C4'-C3'-C2' 100.073 -2.627 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.502 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 O4'-C1'-N19 111.611 3.411 . 0.881 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 112.087 3.887 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 O4'-C1'-N19 111.166 2.966 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.682 0 C4'-C3'-C2' 99.981 -2.719 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 C4'-C3'-C2' 99.793 -2.907 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 O4'-C1'-N19 111.902 3.702 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 O4'-C1'-N19 110.915 2.715 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.573 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.943 -3.757 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.587 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 99.251 -3.449 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.587 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.824 3.624 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.486 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 O4'-C1'-N19 111.097 2.897 . 0.849 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.499 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C4'-C3'-C2' 100.04 -2.66 . 0.64 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.552 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.274 -3.426 . 0.626 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.552 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 98.89 -3.81 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.517 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.676 1 C4'-C3'-C2' 97.836 -4.864 . 0.813 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.517 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 O4'-C1'-N19 112.177 3.977 . 0.81 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.783 0 C4'-C3'-C2' 99.114 -3.586 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.448 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.342 1 C4'-C3'-C2' 97.5 -5.2 . 0.708 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.448 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 O4'-C1'-N19 111.618 3.418 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.473 0.273 0 N-CA-C 112.148 0.018 . . . . 0.0 112.148 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.438 ' C ' ' H ' ' A' ' 4' ' ' VAL . . . 171.05 -169.77 42.73 Favored Glycine 0 C--N 1.34 0.8 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -178.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.84 1.74 0.06 OUTLIER 'Trans proline' 0 CA--C 1.53 0.311 1 C-N-CA 125.885 4.39 . . . . 0.0 114.849 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.438 ' H ' ' C ' ' A' ' 2' ' ' GLY . 29.0 t -121.43 -5.75 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 118.469 0.577 . . . . 0.0 110.147 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.7 tp -153.21 54.2 1.14 Allowed Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.347 0.659 . . . . 0.0 109.619 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.09 -14.77 18.73 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.28 2.653 . . . . 0.0 111.509 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.502 HD23 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.502 ' H ' HD23 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.446 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.469 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.469 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.446 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.561 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.612 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.674 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -152.26 53.76 1.14 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.674 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 73.0 Cg_endo -68.45 -10.25 28.43 Favored 'Trans proline' 0 N--CA 1.452 -0.946 1 C-N-CA 125.544 4.163 . . . . 0.0 114.356 -175.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -160.74 -34.26 0.05 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 77' ' ' GLU . . . -160.38 175.11 13.18 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.523 -0.736 . . . . 0.0 111.669 -175.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.441 ' C ' ' H ' ' A' ' 78' ' ' ALA . 33.7 m -70.77 21.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.449 1.5 . . . . 0.0 112.737 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.418 ' H ' ' C ' ' A' ' 75' ' ' ALA . 45.2 mt-10 -71.56 18.54 0.07 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.974 0.909 . . . . 0.0 112.153 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.441 ' H ' ' C ' ' A' ' 76' ' ' SER . . . -138.59 175.44 9.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.94 0.896 . . . . 0.0 109.929 179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -146.47 166.96 24.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.728 0.411 . . . . 0.0 111.13 -175.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.86 171.41 17.8 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.999 0.52 . . . . 0.0 111.639 -178.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.28 -175.84 5.33 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.683 0.393 . . . . 0.0 110.399 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -145.39 172.5 13.1 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.363 0.665 . . . . 0.0 110.254 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -178.46 39.37 0.08 OUTLIER Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp180 -128.69 178.2 6.51 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.566 0.746 . . . . 0.0 110.823 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 72.9 p -72.68 26.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.86 1.264 . . . . 0.0 113.069 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 mp 55.66 29.22 13.28 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.232 0.613 . . . . 0.0 110.556 -174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.4 t -144.32 175.39 10.13 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.228 0.611 . . . . 0.0 110.253 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.1 8.42 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.78 0.832 . . . . 0.0 111.099 -175.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -143.7 169.24 18.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.431 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 48.7 p -142.81 175.0 10.16 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 125.159 1.384 . . . . 0.0 109.795 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -154.3 170.48 21.18 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.808 0.443 . . . . 0.0 110.164 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -151.54 176.97 10.8 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.809 0.444 . . . . 0.0 110.488 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.4 t -150.36 169.64 20.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.475 0.31 . . . . 0.0 110.591 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.3 p -153.96 178.26 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.14 0.576 . . . . 0.0 110.701 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.09 24.63 1.3 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.765 0.826 . . . . 0.0 110.496 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -144.68 178.41 8.0 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.136 0.574 . . . . 0.0 110.402 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -142.73 17.75 1.99 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.176 0.59 . . . . 0.0 110.992 -177.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -148.81 160.72 42.95 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 122.714 0.405 . . . . 0.0 109.924 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -87.87 155.7 52.78 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 122.833 0.453 . . . . 0.0 111.681 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -74.77 177.94 7.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.225 3.283 . . . . 0.0 111.553 175.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -147.97 171.08 16.36 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.928 0.491 . . . . 0.0 109.991 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -149.57 179.05 8.29 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 120.896 0.379 . . . . 0.0 110.917 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.1 tp -147.64 160.26 42.86 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -149.46 174.12 12.83 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.918 0.487 . . . . 0.0 110.742 -176.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -62.1 163.4 8.08 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.046 0.538 . . . . 0.0 111.608 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -174.72 179.65 45.89 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -146.34 171.75 14.53 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.945 0.498 . . . . 0.0 110.467 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -141.66 -177.15 5.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.6 0.76 . . . . 0.0 109.578 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 41.3 m -138.6 136.71 19.1 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.58 171.65 14.95 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.703 2.935 . . . . 0.0 111.531 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -153.5 174.82 13.91 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.408 0.683 . . . . 0.0 109.345 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.72 13.7 1.92 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.4 m -144.13 165.32 28.15 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.007 0.523 . . . . 0.0 110.407 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -159.51 161.63 26.79 Favored Pre-proline 0 N--CA 1.454 -0.252 0 C-N-CA 123.287 0.635 . . . . 0.0 110.094 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.66 166.05 3.05 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.467 2.778 . . . . 0.0 112.157 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.85 -32.57 30.19 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.636 2.89 . . . . 0.0 112.436 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -164.07 -44.37 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.658 0.783 . . . . 0.0 109.778 173.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -166.16 -20.76 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.733 0.813 . . . . 0.0 110.304 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.9 m -144.39 173.27 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 124.417 1.087 . . . . 0.0 109.861 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.32 6.96 0.03 OUTLIER Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.505 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 17.8 t -155.5 176.5 12.51 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.071 0.935 . . . . 0.0 110.4 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -149.45 9.06 0.72 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.29 0.636 . . . . 0.0 111.559 -178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.7 174.32 46.79 Favored Glycine 0 CA--C 1.531 1.092 0 O-C-N 121.958 -0.464 . . . . 0.0 112.621 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -72.64 -0.05 11.94 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -151.3 156.35 40.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.6 m -151.47 175.12 12.6 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.776 0.831 . . . . 0.0 109.639 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -150.98 169.55 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.759 0.423 . . . . 0.0 110.254 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 84.4 p -149.56 4.96 0.6 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.8 p -155.09 171.26 20.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.131 0.572 . . . . 0.0 110.266 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.8 t -69.37 161.5 29.25 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.805 0.442 . . . . 0.0 111.185 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.59 -6.45 0.08 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.75 -0.472 . . . . 0.0 111.962 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.04 169.31 21.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.755 0.822 . . . . 0.0 108.821 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.403 ' C ' ' H ' ' A' ' 135' ' ' LEU . 5.2 t 59.59 4.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.693 1.197 . . . . 0.0 112.018 -176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -69.77 8.8 0.61 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.351 1.06 . . . . 0.0 112.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 133' ' ' VAL . 19.1 tp -138.24 10.39 2.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.897 0.879 . . . . 0.0 110.438 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.7 m -138.32 12.74 2.8 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.068 0.947 . . . . 0.0 111.26 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -143.0 8.94 1.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.069 0.548 . . . . 0.0 110.794 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 45.8 m -61.81 160.32 28.95 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.277 0.631 . . . . 0.0 111.834 -178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.07 158.64 1.27 Allowed 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.459 3.44 . . . . 0.0 114.7 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.414 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 48.1 t -55.45 -39.28 76.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 140' ' ' VAL . 72.0 Cg_exo -53.25 0.35 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 124.157 3.238 . . . . 0.0 115.481 172.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -128.13 -3.45 5.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.078 0.853 . . . . 0.0 111.777 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 50.7 m -77.0 7.64 4.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.839 0.456 . . . . 0.0 112.097 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -140.67 9.35 2.2 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 122.876 0.47 . . . . 0.0 112.188 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.7 t -147.93 -4.35 0.49 Allowed 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.047 -0.408 . . . . 0.0 111.312 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.465 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 57.1 tp60 -150.99 42.53 0.24 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.068 0.547 . . . . 0.0 110.835 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 98.4 Cg_endo -71.85 169.67 20.66 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.908 2.405 . . . . 0.0 111.17 -178.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.68 166.39 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 124.53 3.487 . . . . 0.0 113.418 174.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.91 154.05 69.85 Favored Pre-proline 0 N--CA 1.455 -0.213 0 C-N-CA 122.613 0.365 . . . . 0.0 110.69 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.86 176.37 9.96 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.849 3.033 . . . . 0.0 111.02 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 37.3 mm -137.79 137.74 22.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.96 159.64 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.655 2.903 . . . . 0.0 112.747 176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.64 163.35 39.28 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.203 2.602 . . . . 0.0 110.852 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.83 166.21 30.21 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.424 2.749 . . . . 0.0 111.713 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -155.65 155.48 29.64 Favored Pre-proline 0 CA--C 1.532 0.25 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.75 147.3 39.61 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.796 2.331 . . . . 0.0 110.686 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.9 167.4 23.76 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.654 2.902 . . . . 0.0 110.839 176.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.02 161.52 6.43 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.355 2.703 . . . . 0.0 112.379 173.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 92.0 p -149.79 8.13 0.66 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 122.704 0.402 . . . . 0.0 111.976 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -178.12 17.37 0.03 OUTLIER Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.664 -0.52 . . . . 0.0 111.899 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -146.01 17.91 1.41 Allowed 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 117.708 0.754 . . . . 0.0 111.143 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -57.66 147.76 59.92 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 122.792 0.437 . . . . 0.0 111.014 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.15 -14.57 25.87 Favored 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 124.536 3.49 . . . . 0.0 111.287 -177.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . 0.443 ' C ' HD23 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.443 HD23 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.94 174.26 10.67 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.8 t -153.08 143.47 22.53 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.275 0.63 . . . . 0.0 109.739 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.32 -170.78 17.24 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -131.79 -59.04 0.96 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 117.23 0.515 . . . . 0.0 110.507 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.1 p -172.36 -35.16 0.01 OUTLIER 'General case' 0 C--O 1.23 0.071 0 C-N-CA 122.789 0.436 . . . . 0.0 110.563 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -67.65 -19.42 65.2 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.343 175.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.53 147.8 17.53 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.708 -1.589 . . . . 0.0 106.708 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -160.52 156.71 26.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 117.699 0.227 . . . . 0.0 111.006 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.42 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.47 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.47 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 56.06 36.86 28.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 81.8 mt -136.62 -165.73 1.78 Allowed 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.344 1.058 . . . . 0.0 110.401 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.646 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 36.8 t-80 -144.95 -168.78 3.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.427 0.691 . . . . 0.0 109.255 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.646 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.0 tp -123.43 17.65 9.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.743 0.417 . . . . 0.0 111.188 -176.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.497 ' C ' ' H ' ' A' ' 231' ' ' HIS . 64.9 mt 51.73 29.59 5.93 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.868 1.267 . . . . 0.0 113.943 176.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.51 9.32 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.558 0.743 . . . . 0.0 111.985 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . 0.497 ' H ' ' C ' ' A' ' 229' ' ' LEU . 11.7 p80 -137.26 7.23 2.86 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.376 1.07 . . . . 0.0 111.097 -178.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -142.97 1.35 1.27 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.179 0.592 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -151.21 154.75 37.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -157.88 -174.77 5.01 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -142.01 13.74 2.06 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.021 0.529 . . . . 0.0 112.354 -177.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.697 -179.902 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.282 -3.418 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.157 -3.543 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 98.829 -3.871 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.253 0 C4'-C3'-C2' 99.527 -3.173 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.453 HO2' " H5'" ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.742 1 O4'-C1'-N19 112.428 4.228 . 0.653 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.466 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 98.95 -3.75 . 0.748 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.466 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C4'-C3'-C2' 98.897 -3.803 . 0.577 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 99.335 -3.365 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.33 0 C4'-C3'-C2' 99.577 -3.123 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.41 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.9 -2.8 . 0.315 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.41 " H5'" HO2' ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 O4'-C1'-N19 111.569 3.369 . 0.873 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.401 HO2' " H5'" ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.715 -2.985 . 0.714 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.401 " H5'" HO2' ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 C4'-C3'-C2' 99.382 -3.318 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.728 -2.972 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 99.384 -3.316 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.492 HO2' " H5'" ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.32 -3.38 . 0.706 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.492 " H5'" HO2' ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C4'-C3'-C2' 99.532 -3.168 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.47 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 C4'-C3'-C2' 98.919 -3.781 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.592 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C4'-C3'-C2' 100.229 -2.471 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.592 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.454 -3.246 . 0.781 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.468 " H5'" HO2' ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.52 -3.18 . 0.826 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.456 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.369 0 C4'-C3'-C2' 99.911 -2.789 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.048 -3.652 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.69 -3.01 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 O4'-C1'-N19 111.033 2.833 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.451 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.272 -3.428 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.451 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.169 -3.531 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.499 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.245 -3.455 . 0.873 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.527 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.244 -3.456 . 0.734 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.527 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.285 3.085 . 0.59 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.569 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C5'-C4'-O4' 113.99 3.422 . 0.723 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.569 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.744 1 C4'-C3'-C2' 98.321 -4.379 . 0.79 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.472 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.694 1 C4'-C3'-C2' 98.636 -4.064 . 0.676 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . 0.423 " H1'" ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.39 0 N19-C1'-C2' 108.306 -3.184 . 0.718 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.269 1 C4'-C3'-O3' 121.357 4.137 . 0.346 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.413 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.259 1 P-O3'-C3' 125.818 5.098 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.439 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.627 3.407 1 C4'-C3'-C2' 97.902 -4.798 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.439 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.541 -3.159 . 0.66 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.503 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C4'-C3'-C2' 99.028 -3.672 . 0.646 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.503 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.44 1 C4'-C3'-C2' 98.439 -4.261 . 0.746 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.612 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.416 -3.091 0 O4'-C1'-N19 111.759 3.559 . 0.575 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.86 0 C4'-C3'-C2' 99.404 -3.296 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.889 1 C4'-C3'-C2' 98.497 -4.203 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.327 -3.373 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.808 -3.892 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.122 0 C4'-C3'-C2' 98.831 -3.869 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.407 HO2' " H5'" ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.984 0 C4'-C3'-C2' 100.005 -2.695 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.407 " H5'" HO2' ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 O4'-C1'-N19 111.669 3.469 . 0.901 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 110.335 2.135 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 O4'-C1'-N19 113.049 4.849 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.623 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.984 0 C4'-C3'-C2' 99.495 -3.205 . 0.571 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.623 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 100.341 -2.359 . 0.825 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.451 HO2' " H5'" ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C4'-C3'-C2' 99.35 -3.35 . 0.841 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.451 " H5'" HO2' ' B' ' 289' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 O4'-C1'-N19 111.481 3.281 . 0.825 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 2.297 0 O4'-C1'-N19 111.434 3.234 . 0.543 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.419 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.443 0 O4'-C1'-N19 110.712 2.512 . 0.6 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.596 HO2' " H5'" ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 O4'-C1'-N19 111.601 3.401 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.596 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.519 -4.181 . 0.681 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.452 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.198 -3.502 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.452 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.13 0 C4'-C3'-C2' 99.628 -3.072 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.416 0 C4'-C3'-C2' 98.933 -3.767 . 0.661 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C4'-C3'-C2' 99.371 -3.329 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.46 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C4'-C3'-C2' 99.813 -2.887 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.501 HO2' " H5'" ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 100.254 -2.446 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.587 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.91 0 O4'-C1'-N19 111.48 3.28 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.587 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 O4'-C1'-N19 111.626 3.426 . 0.716 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.499 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 98.443 -4.257 . 0.808 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.499 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 O4'-C1'-N19 112.084 3.884 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C4'-C3'-C2' 99.478 -3.222 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.476 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.62 2.739 1 C4'-C3'-C2' 97.573 -5.127 . 0.747 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.476 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 112.157 3.957 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo . . . . . 0 C--O 1.23 0.098 0 CA-C-O 120.632 0.18 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.83 54.69 0.21 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.159 -0.8 . . . . 0.0 111.888 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.41 172.48 14.1 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 124.141 3.227 . . . . 0.0 110.936 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -144.07 174.34 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.254 1.022 . . . . 0.0 109.929 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.9 tt -144.89 62.93 9.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 122.84 0.456 . . . . 0.0 109.909 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.17 -28.08 32.18 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.68 2.92 . . . . 0.0 114.17 -175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.439 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' CD1' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.508 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.508 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.448 ' CB ' HG21 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.409 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.419 HG22 " H1'" ' B' ' 287' ' ' ' U' . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.415 HD12 ' HG ' ' A' ' 26' ' ' SER . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.409 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.448 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.44 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -143.9 64.55 13.1 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.37 4.03 4.23 Favored 'Trans proline' 0 N--CA 1.453 -0.896 1 C-N-CA 125.478 4.118 . . . . 0.0 112.931 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -145.95 167.92 22.13 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.229 0.612 . . . . 0.0 109.498 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.62 11.66 1.12 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.687 0.395 . . . . 0.0 111.877 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 48.8 m -61.26 167.08 3.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 117.999 0.363 . . . . 0.0 110.839 178.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.46 156.42 16.18 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 122.064 -0.398 . . . . 0.0 111.693 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.56 176.02 12.54 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.656 0.382 . . . . 0.0 110.745 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -148.34 7.44 0.78 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.56 0.744 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.45 169.49 10.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.442 0.697 . . . . 0.0 110.584 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.0 176.65 10.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.433 0.693 . . . . 0.0 109.767 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.0 mtm -144.79 172.23 13.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.376 0.67 . . . . 0.0 110.216 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.46 11.35 0.31 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -155.33 161.26 41.11 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -178.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.5 t -149.18 174.15 12.67 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.799 0.44 . . . . 0.0 110.455 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.0 tp -145.89 16.54 1.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.848 0.859 . . . . 0.0 109.354 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -142.22 162.35 35.69 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.472 0.709 . . . . 0.0 110.753 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -71.15 150.66 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 122.74 0.416 . . . . 0.0 111.279 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -146.19 9.94 1.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.671 0.788 . . . . 0.0 111.594 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.9 p -144.96 -175.44 4.69 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.562 1.145 . . . . 0.0 109.286 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -146.11 172.67 13.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.483 0.659 . . . . 0.0 111.364 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -144.29 8.75 1.4 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.272 0.629 . . . . 0.0 111.242 -178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.3 m -59.48 158.62 9.39 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.973 0.909 . . . . 0.0 110.481 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 81.1 p -149.21 171.2 16.85 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.929 0.491 . . . . 0.0 109.822 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -62.04 161.06 11.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.141 0.496 . . . . 0.0 111.652 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -153.99 169.04 24.45 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.63 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -156.07 165.17 37.21 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.667 0.387 . . . . 0.0 110.521 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -77.66 174.51 10.86 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.7 0.286 . . . . 0.0 110.784 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -142.84 154.75 62.71 Favored Pre-proline 0 C--O 1.233 0.236 0 C-N-CA 123.499 0.72 . . . . 0.0 110.063 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.9 164.28 36.18 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.474 2.783 . . . . 0.0 111.675 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -150.27 7.94 0.61 Allowed 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.227 0.611 . . . . 0.0 111.437 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 42.3 p -143.32 174.37 10.79 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.052 0.941 . . . . 0.0 110.24 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.545 HD11 ' H ' ' A' ' 104' ' ' PHE . 0.1 OUTLIER -148.45 158.48 44.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.321 0.648 . . . . 0.0 109.585 179.385 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.545 ' H ' HD11 ' A' ' 103' ' ' LEU . 72.6 m-85 -70.9 -177.44 1.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.873 0.869 . . . . 0.0 110.42 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -138.23 170.38 16.14 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.529 0.732 . . . . 0.0 110.221 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.42 27.58 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -144.2 179.72 7.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.769 0.828 . . . . 0.0 109.941 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -143.22 169.05 18.35 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.393 0.616 . . . . 0.0 111.54 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.3 p -66.32 154.38 90.6 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.698 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.66 6.29 2.88 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.433 3.422 . . . . 0.0 111.908 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -148.06 178.22 8.72 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.671 0.388 . . . . 0.0 110.244 -178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -146.97 154.95 41.86 Favored 'General case' 0 CA--C 1.526 0.055 0 C-N-CA 123.473 0.709 . . . . 0.0 109.214 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.4 p -148.97 12.27 0.85 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -177.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.429 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 8.1 tp10 -140.04 47.02 1.1 Allowed Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 122.283 0.233 . . . . 0.0 111.444 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 88.2 Cg_endo -71.77 168.65 23.2 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.149 1.9 . . . . 0.0 110.454 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.73 160.66 1.67 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 124.409 3.406 . . . . 0.0 112.842 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -154.15 174.4 14.79 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.716 0.406 . . . . 0.0 110.077 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -139.29 175.36 9.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 122.828 0.451 . . . . 0.0 111.127 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.8 m -136.14 19.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 123.652 0.781 . . . . 0.0 111.693 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.44 -178.56 31.61 Favored Glycine 0 C--N 1.337 0.586 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 97.6 p -146.96 -175.28 4.75 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.687 0.795 . . . . 0.0 109.907 -178.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -138.83 1.71 2.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.69 171.85 37.86 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -151.23 3.99 0.45 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.73 0.412 . . . . 0.0 110.945 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -144.72 6.63 1.23 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.286 0.634 . . . . 0.0 110.877 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.1 p -155.26 165.89 35.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.281 0.632 . . . . 0.0 109.964 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -154.92 172.86 17.36 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.978 0.418 . . . . 0.0 111.076 -178.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 70.6 p -157.23 174.12 15.93 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.09 0.956 . . . . 0.0 110.116 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.3 m -63.18 162.62 11.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.733 0.413 . . . . 0.0 110.301 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.3 p -154.47 172.53 17.63 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.096 0.558 . . . . 0.0 110.964 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.73 10.52 0.02 OUTLIER Glycine 0 CA--C 1.531 1.054 0 CA-C-O 119.546 -0.585 . . . . 0.0 112.423 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -147.42 6.97 0.86 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.893 0.846 . . . . 0.0 111.403 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.407 HG21 ' H ' ' A' ' 135' ' ' LEU . 9.9 p -151.1 163.74 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 C-N-CA 123.107 0.563 . . . . 0.0 110.102 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -145.89 25.98 1.26 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.807 0.443 . . . . 0.0 111.218 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.407 ' H ' HG21 ' A' ' 133' ' ' VAL . 4.0 pp -59.72 -9.97 3.27 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.204 0.602 . . . . 0.0 112.488 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.6 m -74.45 13.3 0.62 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.807 0.843 . . . . 0.0 111.828 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.67 26.33 2.81 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.502 1.121 . . . . 0.0 110.253 -176.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 53.0 m -133.22 49.2 4.07 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.809 0.844 . . . . 0.0 111.203 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -70.62 174.34 10.4 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.737 2.958 . . . . 0.0 111.042 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 44.6 t -141.24 142.99 28.94 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.84 156.69 1.23 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 124.679 3.586 . . . . 0.0 113.559 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.85 1.21 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.913 0.485 . . . . 0.0 111.37 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.9 m -134.58 13.78 3.74 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 112.122 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -73.57 -15.53 61.28 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.247 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p 44.45 22.67 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.938 1.695 . . . . 0.0 114.594 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -154.31 141.9 13.8 Favored Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 121.532 -0.73 . . . . 0.0 109.444 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.1 163.23 2.31 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.542 2.828 . . . . 0.0 111.978 174.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.44 166.58 27.96 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.794 2.996 . . . . 0.0 110.285 176.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.05 155.88 85.87 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 122.397 -0.189 . . . . 0.0 110.699 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.82 164.32 2.45 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.5 3.466 . . . . 0.0 112.489 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 15.2 tt -152.82 140.31 13.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -54.73 164.99 2.78 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.812 3.008 . . . . 0.0 112.025 174.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -52.22 160.24 3.51 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.651 2.901 . . . . 0.0 111.964 175.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -71.76 1.83 5.33 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.825 3.017 . . . . 0.0 112.335 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -134.41 157.48 77.33 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 124.096 0.958 . . . . 0.0 109.642 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.48 141.28 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.855 3.037 . . . . 0.0 113.061 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.26 159.9 7.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 124.283 3.322 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -74.6 -11.63 22.3 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.026 3.151 . . . . 0.0 111.996 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.0 t -158.96 167.86 28.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.914 0.885 . . . . 0.0 109.629 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.73 -174.83 47.32 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 120.916 0.176 . . . . 0.0 112.675 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -149.8 174.75 12.29 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.802 1.641 . . . . 0.0 108.358 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -138.19 138.84 23.86 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -176.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -83.16 -5.9 11.17 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.377 3.385 . . . . 0.0 111.612 176.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.83 168.52 14.33 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 33.8 t -154.55 162.3 41.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.157 0.583 . . . . 0.0 110.344 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 93.24 173.49 40.4 Favored Glycine 0 C--N 1.338 0.655 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.44 167.99 18.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.194 0.521 . . . . 0.0 109.762 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.3 m -66.7 -0.3 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -174.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -123.05 8.26 9.25 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.958 0.344 . . . . 0.0 110.988 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.05 22.53 1.22 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -61.52 158.98 13.8 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.766 1.226 . . . . 0.0 112.558 -171.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.415 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.482 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 52.79 30.62 9.26 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 93.0 mt -140.11 93.1 2.6 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.631 1.172 . . . . 0.0 109.607 -176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.66 140.1 42.5 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.521 0.513 . . . . 0.0 109.994 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 42.0 tp -63.69 145.37 55.86 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.49 0.316 . . . . 0.0 111.031 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -155.84 168.3 27.65 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.935 0.494 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -150.5 2.17 0.46 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.445 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -64.48 -6.57 7.63 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -63.05 -3.91 1.98 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.076 0.551 . . . . 0.0 112.401 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -142.02 22.68 2.08 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 121.094 0.473 . . . . 0.0 110.649 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -134.31 25.6 3.82 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.478 0.711 . . . . 0.0 110.832 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -129.95 8.44 5.23 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.963 0.505 . . . . 0.0 111.028 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.1 t60 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.371 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.229 -3.471 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.982 3.782 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.434 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C4'-C3'-C2' 99.338 -3.362 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.537 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.235 0 C4'-C3'-C2' 99.021 -3.679 . 0.796 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.537 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.808 1 O4'-C1'-N19 112.361 4.161 . 0.655 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.491 " H5'" HO2' ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 98.9 -3.8 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.011 0 C4'-C3'-C2' 98.946 -3.754 . 0.668 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 0 C4'-C3'-C2' 99.603 -3.097 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 100.687 -2.013 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.456 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C4'-C3'-C2' 99.661 -3.039 . 0.493 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.54 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.484 0 O4'-C1'-N19 112.113 3.913 . 0.708 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.54 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.733 0 C4'-C3'-C2' 99.697 -3.003 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.407 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C4'-C3'-C2' 99.216 -3.484 . 0.841 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.491 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 C4'-C3'-C2' 99.979 -2.721 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.491 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.18 -3.52 . 0.755 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.453 HO2' " H5'" ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.58 1 C4'-C3'-C2' 98.385 -4.315 . 0.63 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.464 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.363 -3.337 . 0.687 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.506 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.55 -3.15 . 0.772 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.506 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.231 -3.469 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.507 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C5'-C4'-O4' 113.702 3.216 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.544 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 99.075 -3.625 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.608 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 98.939 -3.761 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.608 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.402 -2.355 1 O4'-C1'-N19 112.844 4.644 . 0.82 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.575 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.303 0 C4'-C3'-C2' 99.186 -3.514 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.575 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.424 3.224 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.537 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.704 0 C4'-C3'-C2' 98.972 -3.728 . 0.829 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.537 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.196 -3.504 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.486 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C4'-C3'-C2' 99.37 -3.33 . 0.88 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.517 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 C4'-C3'-C2' 99.061 -3.639 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.517 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.84 1 O4'-C1'-N19 112.216 4.016 . 0.591 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.66 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C4'-C3'-C2' 98.943 -3.757 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.66 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.081 0 C4'-C3'-C2' 98.736 -3.964 . 0.763 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.481 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C4'-C3'-C2' 99.144 -3.556 . 0.734 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 0 O4'-C1'-N19 111.037 2.837 . 0.669 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.462 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.176 1 C5'-C4'-C3' 109.335 -4.11 . 0.058 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.462 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.087 3 C3'-C2'-C1' 105.909 4.899 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.488 HO2' " H5'" ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.355 1 C4'-C3'-C2' 98.347 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.488 " H5'" HO2' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.786 3.586 . 0.632 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.497 HO2' " H5'" ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 99.595 -3.105 . 0.63 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.497 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.213 -4.487 . 0.733 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.409 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 O4'-C1'-N19 112.139 3.939 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.409 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C5'-C4'-O4' 113.137 2.812 . 0.914 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.024 1 C4'-C3'-C2' 98.681 -4.019 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.822 -2.878 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.426 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.139 -3.561 . 0.922 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.426 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.412 -3.426 0 C4'-C3'-C2' 98.96 -3.74 . 0.823 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.881 -2.819 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.855 1 C4'-C3'-C2' 98.412 -4.288 . 0.898 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C5'-C4'-C3' 111.384 -2.744 . 0.875 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.519 1 O4'-C1'-N19 113.465 5.265 . 0.506 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.618 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.739 3.539 . 0.495 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.618 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.097 2.897 . 0.666 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.443 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 C4'-C3'-C2' 99.38 -3.32 . 0.852 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 O4'-C1'-N19 111.358 3.158 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 O4'-C1'-N19 111.777 3.577 . 0.558 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.05 0 C4'-C3'-C2' 99.066 -3.634 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.571 HO2' " H5'" ' B' ' 294' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.627 -3.073 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.571 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.415 -3.179 0 O4'-C1'-N19 111.652 3.452 . 0.696 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.435 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.661 -3.039 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.579 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.154 0 C4'-C3'-C2' 99.133 -3.567 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.599 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.47 -4.23 . 0.637 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.599 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 111.288 3.088 . 0.562 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.501 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 O4'-C1'-N19 111.224 3.024 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.501 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 100.005 -2.695 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.415 " H5'" HO2' ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.689 1 C4'-C3'-C2' 98.614 -4.086 . 0.651 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.406 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 98.917 -3.783 . 0.652 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.468 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.829 -3.871 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.468 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.971 3.771 . 0.807 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.538 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.229 0 C4'-C3'-C2' 99.543 -3.157 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.538 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.564 1 C4'-C3'-C2' 97.41 -5.29 . 0.792 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.48 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 O4'-C1'-N19 111.504 3.304 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.484 0.148 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.01 -174.43 47.07 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.24 176.33 8.03 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.918 3.079 . . . . 0.0 110.707 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.63 1.58 0.87 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 123.017 0.527 . . . . 0.0 110.84 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.29 50.84 0.99 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.116 0.566 . . . . 0.0 112.185 176.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -66.24 -20.42 55.83 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.177 1.918 . . . . 0.0 110.412 -176.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.517 ' C ' ' H ' ' A' ' 19' ' ' GLY . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.517 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.542 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.542 ' H ' HD21 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.464 ' CB ' HG23 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.494 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.494 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.428 HG13 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.418 ' CZ ' ' CB ' ' A' ' 68' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.442 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.6 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -145.03 56.54 3.74 Favored Pre-proline 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.6 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -75.85 -9.55 19.61 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 124.466 3.444 . . . . 0.0 111.865 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.0 p30 -147.67 5.49 0.79 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.69 34.66 1.84 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.924 0.89 . . . . 0.0 112.815 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.2 t -139.48 -179.7 6.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.301 0.64 . . . . 0.0 111.08 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -134.04 14.22 3.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.209 0.604 . . . . 0.0 110.772 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.98 5.54 1.55 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -141.05 174.93 10.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.832 0.853 . . . . 0.0 109.696 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -146.6 -178.31 6.1 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.98 0.512 . . . . 0.0 111.804 -176.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -144.03 -171.68 3.61 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 109.838 -177.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -132.94 176.74 8.22 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.526 0.33 . . . . 0.0 110.969 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.86 -171.73 37.87 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -146.67 169.86 18.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.3 p -136.57 -175.18 3.93 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.681 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.85 -0.93 1.19 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.632 0.773 . . . . 0.0 112.262 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 94.9 p -65.65 -9.32 26.33 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.928 0.786 . . . . 0.0 111.979 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 97.3 t -141.28 130.48 24.44 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.052 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -163.82 -175.13 3.94 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.923 0.489 . . . . 0.0 111.6 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.3 p -134.98 -178.86 5.28 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.796 1.238 . . . . 0.0 108.246 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -147.65 145.45 28.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.682 0.753 . . . . 0.0 112.137 -176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -159.95 149.31 17.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.087 1.355 . . . . 0.0 108.579 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.0 p -151.27 -178.55 6.71 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.884 0.473 . . . . 0.0 111.606 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 48.0 m -139.69 167.1 22.87 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.822 1.249 . . . . 0.0 109.016 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -147.49 8.44 0.9 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 172.32 15.13 Favored 'General case' 0 C--N 1.342 0.245 0 O-C-N 121.667 -0.646 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.17 5.77 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.644 0.778 . . . . 0.0 110.637 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -146.81 166.87 25.37 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.063 0.945 . . . . 0.0 109.466 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -153.48 144.27 15.96 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -51.74 168.7 0.3 Allowed 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 124.076 3.184 . . . . 0.0 113.764 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -147.44 164.94 31.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.768 0.427 . . . . 0.0 110.525 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -149.19 -171.54 3.91 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.844 0.858 . . . . 0.0 110.193 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.404 ' H ' HD23 ' A' ' 103' ' ' LEU . 2.0 pt? -138.59 178.09 7.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.035 0.934 . . . . 0.0 110.488 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -141.18 27.16 1.96 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.645 0.378 . . . . 0.0 110.827 -173.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -138.35 10.2 2.74 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.015 0.526 . . . . 0.0 111.547 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 172.56 178.55 42.76 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -152.31 -11.98 0.18 Allowed 'General case' 0 CA--C 1.528 0.097 0 O-C-N 122.562 -0.375 . . . . 0.0 110.805 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -160.63 163.31 32.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.327 1.051 . . . . 0.0 109.398 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.514 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 76.0 p -144.32 26.98 0.06 OUTLIER Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 109' ' ' THR . 98.5 Cg_endo -73.26 -5.36 17.02 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.861 1.707 . . . . 0.0 112.293 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -151.74 15.98 0.67 Allowed 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.094 0.558 . . . . 0.0 110.689 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -141.69 162.5 35.32 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.057 0.543 . . . . 0.0 110.593 -175.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.0 m -147.04 -0.65 0.69 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.199 0.6 . . . . 0.0 111.84 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.99 155.3 47.43 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.424 0.689 . . . . 0.0 109.446 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.41 166.39 29.56 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.792 2.994 . . . . 0.0 111.485 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.69 174.85 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 124.985 3.79 . . . . 0.0 113.293 174.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -144.9 166.58 24.86 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.296 0.638 . . . . 0.0 110.619 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -148.9 171.57 16.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.522 0.729 . . . . 0.0 110.548 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.4 p -154.1 158.17 3.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 C-N-CA 123.19 0.596 . . . . 0.0 109.46 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -176.28 -178.41 46.04 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 112.226 -0.35 . . . . 0.0 112.226 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 41.7 m -68.99 4.9 1.31 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.832 0.853 . . . . 0.0 112.009 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -148.15 166.75 26.92 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.88 -0.512 . . . . 0.0 109.908 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.75 -176.39 40.68 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.524 -0.631 . . . . 0.0 111.524 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -149.62 11.97 0.78 Allowed 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -149.82 165.18 33.29 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.819 0.447 . . . . 0.0 109.911 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.6 p -149.77 174.55 12.49 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.73 0.412 . . . . 0.0 111.038 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.97 161.22 21.87 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.004 0.922 . . . . 0.0 110.673 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.3 p -154.33 171.06 19.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.773 0.429 . . . . 0.0 110.345 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 86.4 p -151.86 172.88 15.5 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 122.166 -0.334 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.5 m 52.85 18.58 1.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.43 1.092 . . . . 0.0 113.188 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.78 178.15 44.44 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -148.93 -13.67 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.903 0.352 . . . . 0.0 111.141 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -148.5 173.66 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.705 0.802 . . . . 0.0 110.002 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.0 p -151.02 164.35 36.63 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.27 0.628 . . . . 0.0 109.669 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.0 mp 49.44 20.99 0.52 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.328 1.051 . . . . 0.0 111.497 -177.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.8 p -65.07 168.94 5.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 112.303 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.51 174.67 13.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.933 0.893 . . . . 0.0 109.584 179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 27.0 p -58.1 155.3 25.73 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.047 0.539 . . . . 0.0 110.322 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -73.93 -0.1 9.03 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.783 2.989 . . . . 0.0 112.519 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.64 153.86 58.8 Favored Pre-proline 0 C--N 1.341 0.227 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.32 175.41 9.38 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 123.375 2.717 . . . . 0.0 111.212 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.67 174.06 12.56 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 79.1 p -151.62 19.96 0.72 Allowed 'General case' 0 C--O 1.233 0.195 0 C-N-CA 122.99 0.516 . . . . 0.0 111.727 -176.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 24.3 tp -136.93 -8.55 1.82 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.197 0.453 . . . . 0.0 112.061 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.3 p -145.33 -12.76 0.53 Allowed 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.489 -0.757 . . . . 0.0 111.602 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -161.59 157.48 21.26 Favored Pre-proline 0 CA--C 1.531 0.217 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.469 ' C ' ' H ' ' A' ' 149' ' ' LEU . 71.9 Cg_endo -71.91 171.1 17.28 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 122.972 2.448 . . . . 0.0 110.756 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.54 6.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 124.903 3.736 . . . . 0.0 114.647 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.469 ' H ' ' C ' ' A' ' 147' ' ' PRO . 85.3 mt -133.69 160.9 66.78 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.353 0.661 . . . . 0.0 110.395 -175.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.18 168.86 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.333 3.355 . . . . 0.0 114.531 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.4 pt -145.03 159.44 49.76 Favored Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 124.407 1.083 . . . . 0.0 108.721 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.44 160.04 51.32 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 122.719 2.279 . . . . 0.0 111.112 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.63 160.55 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.544 3.496 . . . . 0.0 113.65 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -7.29 1.05 Allowed 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 124.39 3.394 . . . . 0.0 114.639 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -142.92 71.18 19.02 Favored Pre-proline 0 C--O 1.233 0.209 0 C-N-CA 123.865 0.866 . . . . 0.0 110.282 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -50.35 152.25 8.7 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.841 3.027 . . . . 0.0 113.586 -178.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -52.26 158.09 5.77 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.538 2.825 . . . . 0.0 112.581 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.62 174.56 12.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 124.583 3.522 . . . . 0.0 110.695 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 24.8 t -151.7 172.14 16.58 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.924 0.49 . . . . 0.0 110.637 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 178.12 28.06 0.04 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -176.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -136.53 -159.17 0.93 Allowed 'General case' 0 C--O 1.231 0.117 0 C-N-CA 124.772 1.229 . . . . 0.0 108.903 -175.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -129.96 70.21 82.01 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 121.791 0.805 . . . . 0.0 111.344 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo -83.65 -9.31 10.09 Favored 'Trans proline' 0 N--CA 1.444 -1.427 1 C-N-CA 125.479 4.119 . . . . 0.0 110.597 -176.484 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.464 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.53 166.8 22.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 82.0 p -160.89 166.83 27.8 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.092 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.82 173.09 24.57 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 176.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -75.6 171.39 14.39 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.98 0.512 . . . . 0.0 110.304 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 39.6 m -66.26 -3.66 6.26 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 36.6 p-80 -129.28 11.31 5.89 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.55 0.34 . . . . 0.0 110.929 -177.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.14 19.13 1.24 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -59.23 156.51 12.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.585 1.154 . . . . 0.0 111.789 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.422 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 56.64 35.28 25.88 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.9 mt -138.12 -168.92 2.46 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.347 1.059 . . . . 0.0 109.409 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.516 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 17.0 t-80 -143.14 -169.2 2.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 122.065 -0.397 . . . . 0.0 110.569 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.516 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.3 tp -132.27 10.88 4.53 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.208 0.603 . . . . 0.0 112.429 -175.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.2 mt -132.28 29.0 4.35 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.623 0.769 . . . . 0.0 109.674 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -134.91 23.64 3.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.853 0.861 . . . . 0.0 110.066 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -134.46 13.31 3.8 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.546 0.738 . . . . 0.0 110.618 -176.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . 0.44 ' C ' ' H ' ' A' ' 234' ' ' HIS . 45.2 p-80 -67.84 3.26 1.55 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.527 1.131 . . . . 0.0 112.793 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -67.4 18.98 0.03 OUTLIER 'General case' 0 C--N 1.342 0.248 0 C-N-CA 124.51 1.124 . . . . 0.0 113.148 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . 0.44 ' H ' ' C ' ' A' ' 232' ' ' HIS . 82.0 t60 -131.49 3.46 4.23 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.122 0.419 . . . . 0.0 111.669 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -147.24 10.92 1.01 Allowed 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.763 -0.586 . . . . 0.0 110.979 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.606 179.294 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 C5'-C4'-O4' 114.198 3.57 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.151 0 C4'-C3'-C2' 99.047 -3.653 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 O4'-C1'-N19 111.605 3.405 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.153 -3.547 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.031 1 O4'-C1'-N19 112.892 4.692 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C4'-C3'-C2' 99.24 -3.46 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.411 HO2' " H5'" ' B' ' 244' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.882 0 C4'-C3'-C2' 99.263 -3.437 . 0.675 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . 0.411 " H5'" HO2' ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.512 -3.188 . 0.711 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.597 -3.103 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.215 0 C4'-C3'-C2' 99.369 -3.331 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.467 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 98.775 -3.925 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.531 HO2' " H5'" ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 O4'-C1'-N19 111.945 3.745 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.531 " H5'" HO2' ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.702 0 C4'-C3'-C2' 99.501 -3.199 . 0.818 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.446 " H5'" HO2' ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.824 0 C4'-C3'-C2' 99.551 -3.149 . 0.729 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.504 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.016 0 C4'-C3'-C2' 99.302 -3.398 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.504 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 98.969 -3.731 . 0.629 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.423 -3.277 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C4'-C3'-C2' 99.622 -3.078 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 C4'-C3'-C2' 99.142 -3.558 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.515 HO2' " H5'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 C4'-C3'-C2' 99.594 -3.106 . 0.75 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.515 " H5'" HO2' ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.187 0 C4'-C3'-C2' 99.703 -2.997 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.532 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C4'-C3'-C2' 99.121 -3.579 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.532 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 C4'-C3'-C2' 98.864 -3.836 . 0.776 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.574 HO2' " H5'" ' B' ' 261' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C5'-C4'-C3' 110.323 -3.452 . 0.796 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.574 " H5'" HO2' ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.102 2.902 . 0.879 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.034 -3.666 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.53 0 C4'-C3'-C2' 98.718 -3.982 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.983 0 C4'-C3'-C2' 99.121 -3.579 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.18 -3.52 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.45 HO2' " H5'" ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 O4'-C1'-N19 111.163 2.963 . 0.779 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.579 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.748 -2.952 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.579 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.01 0 C4'-C3'-C2' 98.79 -3.91 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.465 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.106 -3.594 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.433 0 N19-C1'-C2' 110.18 -2.012 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.523 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.183 1 C5'-C4'-C3' 107.895 -5.07 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.523 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.413 -3.374 2 C5'-C4'-C3' 108.572 -4.619 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.656 0 C4'-C3'-C2' 100.27 -2.43 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.415 HO2' " H5'" ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C4'-C3'-C2' 99.942 -2.758 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.415 " H5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.756 0 C4'-C3'-C2' 99.078 -3.622 . 0.697 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 1 C4'-C3'-C2' 98.536 -4.164 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 N19-C1'-C2' 108.374 -3.141 . 0.734 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.425 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C4'-C3'-C2' 99.488 -3.212 . 0.89 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.425 HO2' " H5'" ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 98.744 -3.956 . 0.782 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.425 " H5'" HO2' ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.225 -3.475 . 0.742 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.444 HO2' " H5'" ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.677 0 C4'-C3'-C2' 98.856 -3.844 . 0.895 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.444 " H5'" HO2' ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.719 1 C4'-C3'-C2' 98.496 -4.204 . 0.808 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.479 -3.221 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.466 -3.234 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.7 0 C4'-C3'-C2' 99.755 -2.945 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.13 2 O4'-C1'-N19 113.177 4.977 . 0.802 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.609 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.819 -2.881 . 0.488 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.609 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C5'-C4'-C3' 110.987 -3.008 . 0.726 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.497 0 C4'-C3'-C2' 99.377 -3.323 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.407 -2.066 0 O4'-C1'-N19 111.98 3.78 . 0.898 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.657 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.46 0 O4'-C1'-N19 111.802 3.602 . 0.511 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.657 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C4'-C3'-C2' 99.328 -3.372 . 0.658 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.626 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C4'-C3'-C2' 99.452 -3.248 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.034 0 C4'-C3'-C2' 99.316 -3.384 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 112.018 3.818 . 0.844 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.578 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C4'-C3'-C2' 99.219 -3.481 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.578 " H5'" HO2' ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 98.919 -3.781 . 0.622 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.543 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 C4'-C3'-C2' 99.605 -3.095 . 0.558 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.453 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 99.721 -2.979 . 0.87 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.453 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.482 -3.218 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.243 -3.457 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.437 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C4'-C3'-C2' 99.058 -3.642 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.437 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.883 1 C4'-C3'-C2' 98.285 -4.415 . 0.791 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.406 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.781 1 O4'-C1'-N19 112.397 4.197 . 0.822 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.454 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.517 -3.183 . 0.806 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.454 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.058 1 C4'-C3'-C2' 97.644 -5.056 . 0.697 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.448 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.044 1 O4'-C1'-N19 112.325 4.125 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo . . . . . 0 N--CA 1.472 0.259 0 N-CA-C 113.01 0.35 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.01 -64.85 0.08 OUTLIER Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.85 177.56 7.5 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.715 2.943 . . . . 0.0 110.209 175.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -130.82 16.33 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 123.666 0.786 . . . . 0.0 111.022 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.3 tp 44.73 56.78 14.47 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 124.058 0.943 . . . . 0.0 111.921 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.63 -11.15 24.09 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.6 2.2 . . . . 0.0 111.706 -177.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' CG ' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.432 ' CD1' ' CG ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.457 ' CB ' HG21 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.48 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.48 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.457 HG21 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -148.98 59.33 4.04 Favored Pre-proline 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -79.95 -13.89 12.63 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 124.834 3.69 . . . . 0.0 111.673 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 52.04 10.87 0.13 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.952 1.701 . . . . 0.0 113.684 -175.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.98 11.77 0.3 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.568 0.347 . . . . 0.0 111.894 -178.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.3 t -151.09 178.91 8.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 122.066 -0.396 . . . . 0.0 110.15 -175.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -142.3 21.38 2.06 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.983 1.313 . . . . 0.0 110.316 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.17 6.26 1.01 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -62.02 167.15 4.06 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.428 0.632 . . . . 0.0 111.806 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.481 ' C ' ' H ' ' A' ' 82' ' ' MET . 2.4 pt? -149.85 15.51 0.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.69 0.796 . . . . 0.0 112.14 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.45 19.49 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.409 1.084 . . . . 0.0 112.708 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' MET . . . . . 0.481 ' H ' ' C ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -138.78 15.22 2.7 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.284 1.434 . . . . 0.0 110.812 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -157.3 -169.75 21.44 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.7 mtp-105 -63.03 169.68 3.22 Favored 'General case' 0 C--N 1.339 0.114 0 CA-C-O 121.218 0.532 . . . . 0.0 111.156 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -137.73 -174.31 3.74 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 109.503 -177.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.21 152.93 45.01 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.1 p -156.9 178.64 10.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.67 0.788 . . . . 0.0 110.131 179.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -68.58 172.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.672 0.789 . . . . 0.0 111.77 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -142.96 22.45 1.92 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.052 0.541 . . . . 0.0 110.934 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -140.96 9.54 2.14 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 122.792 0.437 . . . . 0.0 111.568 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.49 -18.26 63.68 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.877 -0.514 . . . . 0.0 111.633 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -67.45 157.97 32.92 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.634 0.374 . . . . 0.0 111.11 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -157.16 170.14 23.19 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.744 0.418 . . . . 0.0 110.415 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.5 p -69.08 172.44 6.76 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.879 0.872 . . . . 0.0 112.163 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -143.41 19.1 1.88 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.419 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -143.97 157.72 44.16 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.338 0.655 . . . . 0.0 109.568 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.38 167.95 25.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.55 0.34 . . . . 0.0 110.488 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -152.62 20.72 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.415 0.686 . . . . 0.0 110.147 -178.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -56.77 153.31 22.74 Favored Pre-proline 0 CA--C 1.535 0.393 0 O-C-N 121.893 -0.505 . . . . 0.0 111.038 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.4 158.14 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 124.023 3.149 . . . . 0.0 113.7 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -147.51 11.27 0.99 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.948 0.899 . . . . 0.0 109.746 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.0 t -151.13 174.86 12.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.991 0.916 . . . . 0.0 109.268 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 54.6 tp -149.95 156.55 41.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -151.88 162.2 41.43 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.159 0.584 . . . . 0.0 109.74 177.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -89.8 -10.41 45.57 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 73.48 -173.6 49.05 Favored Glycine 0 CA--C 1.531 1.08 0 O-C-N 121.84 -0.538 . . . . 0.0 111.95 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -157.82 169.55 24.36 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.886 0.874 . . . . 0.0 109.828 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -152.49 -22.51 0.17 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.463 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 67.2 p -144.4 37.15 0.22 Allowed Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 109' ' ' THR . 93.2 Cg_endo -71.1 146.97 53.3 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.665 2.243 . . . . 0.0 110.729 -176.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -165.1 -37.42 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.03 0.532 . . . . 0.0 111.093 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -148.65 169.94 19.26 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.887 0.875 . . . . 0.0 108.647 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.6 m -146.01 9.52 1.13 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.561 0.344 . . . . 0.0 111.095 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -155.62 136.73 9.2 Favored Pre-proline 0 CA--C 1.533 0.295 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' A' ' 117' ' ' PHE . 68.9 Cg_endo -70.77 144.18 47.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.213 1.942 . . . . 0.0 111.967 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.47 13.72 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.7 1 C-N-CA 125.357 4.038 . . . . 0.0 115.301 174.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.415 ' H ' ' C ' ' A' ' 115' ' ' PRO . 69.5 t80 -135.58 166.41 23.28 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.321 -0.862 . . . . 0.0 111.499 -174.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.24 169.68 5.42 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.826 0.85 . . . . 0.0 112.416 -177.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -140.71 -16.18 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.625 0.77 . . . . 0.0 110.348 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 160.77 -0.18 0.07 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.29 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 98.2 p -152.64 -171.08 3.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 117.705 0.752 . . . . 0.0 110.498 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -129.86 26.11 5.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.622 0.769 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.443 ' C ' ' H ' ' A' ' 125' ' ' ASP . . . -137.85 26.75 2.85 Favored Glycine 0 C--N 1.34 0.753 0 C-N-CA 124.56 1.076 . . . . 0.0 110.692 179.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.25 16.71 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.684 1.593 . . . . 0.0 111.893 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 123' ' ' GLY . 25.7 t0 -138.84 164.64 29.12 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.488 0.715 . . . . 0.0 109.976 -177.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.9 p -146.73 -177.84 5.86 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 122.511 0.324 . . . . 0.0 111.362 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -55.37 156.25 4.55 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.704 0.801 . . . . 0.0 112.251 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 79.4 p -156.83 174.57 15.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.79 0.836 . . . . 0.0 110.048 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -152.27 172.54 16.27 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 177.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.2 m -141.7 17.54 2.17 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.753 0.821 . . . . 0.0 111.626 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.19 174.9 34.74 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -64.16 -6.14 6.09 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.338 0.655 . . . . 0.0 112.081 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 p -64.05 -6.22 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 123.67 0.788 . . . . 0.0 111.612 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.2 m -142.73 13.72 1.92 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.556 0.616 . . . . 0.0 112.242 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.6 mp -134.54 164.53 27.28 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.038 -0.414 . . . . 0.0 110.612 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.9 m -72.06 0.74 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 112.46 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 52.08 23.18 2.14 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.24 1.016 . . . . 0.0 112.633 -178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t -56.78 142.64 71.75 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.435 0.694 . . . . 0.0 111.243 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.33 -5.9 18.03 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.977 3.118 . . . . 0.0 112.271 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.3 136.84 88.68 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -68.77 170.03 16.27 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.402 2.734 . . . . 0.0 111.862 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -143.75 17.27 1.81 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.499 -178.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 33.8 t -150.82 153.69 35.87 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.846 0.458 . . . . 0.0 110.667 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 tp -159.34 157.63 30.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.065 0.946 . . . . 0.0 108.747 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.2 p -142.48 131.35 22.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -152.99 156.13 32.53 Favored Pre-proline 0 CA--C 1.529 0.141 0 C-N-CA 124.66 1.184 . . . . 0.0 109.168 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.97 165.98 30.58 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.657 2.238 . . . . 0.0 110.11 175.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.39 157.49 4.7 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.365 2.71 . . . . 0.0 112.642 175.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.92 50.86 4.65 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 123.508 0.723 . . . . 0.0 110.936 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -68.51 172.04 12.04 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.272 2.648 . . . . 0.0 111.111 -178.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.87 165.4 31.21 Favored Pre-proline 0 C--O 1.233 0.229 0 C-N-CA 123.621 0.768 . . . . 0.0 109.429 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.92 160.34 1.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.466 2.778 . . . . 0.0 113.7 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 158.02 5.39 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.965 3.11 . . . . 0.0 113.747 -177.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.0 171.54 0.11 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 124.89 3.726 . . . . 0.0 113.381 174.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -48.01 134.89 11.61 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.318 0.647 . . . . 0.0 110.378 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.88 168.79 23.5 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.983 3.122 . . . . 0.0 112.184 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -51.83 157.76 5.34 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.982 3.121 . . . . 0.0 112.713 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.66 39.49 0.64 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.604 3.536 . . . . 0.0 110.927 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.0 m -123.11 23.41 9.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.58 0.752 . . . . 0.0 111.134 -173.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -145.58 164.73 28.06 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.55 163.24 24.0 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.141 0.577 . . . . 0.0 111.519 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -67.9 135.12 92.01 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.454 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.56 -13.31 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.976 2.451 . . . . 0.0 111.542 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' MET . . . . . 0.436 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG11 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -122.14 159.0 28.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.7 m -149.21 160.93 42.95 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.916 0.886 . . . . 0.0 109.713 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 116.32 176.9 18.13 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -79.59 -77.65 0.18 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 18.1 t -165.8 -31.19 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.348 0.659 . . . . 0.0 109.989 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -84.9 2.42 42.77 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.8 22.0 1.0 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.775 0.322 . . . . 0.0 110.267 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.8 tptt -58.13 161.77 3.92 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.706 0.803 . . . . 0.0 110.884 -175.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.483 HG11 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 56.76 33.09 22.4 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -138.14 -161.56 1.19 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.923 1.289 . . . . 0.0 110.143 -174.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . 0.683 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 13.2 t-80 -144.93 -164.57 1.96 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.367 0.667 . . . . 0.0 109.679 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . 0.683 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 24.2 tp -127.96 33.8 4.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.4 tp -136.08 164.73 27.35 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -147.33 -171.39 3.78 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.927 0.491 . . . . 0.0 110.566 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -140.11 172.43 12.77 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.446 0.698 . . . . 0.0 110.63 -175.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -120.79 -2.67 9.79 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 122.587 0.355 . . . . 0.0 110.873 -177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 54.54 12.26 0.52 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.079 1.352 . . . . 0.0 114.127 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -155.9 -0.57 0.14 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.703 0.401 . . . . 0.0 111.54 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -156.77 172.88 17.83 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 121.606 -0.684 . . . . 0.0 109.589 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 116.617 -1.658 . . . . 0.0 110.276 -178.761 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C5'-C4'-O4' 113.929 3.378 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.038 0 O4'-C1'-N19 111.537 3.337 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.445 3.245 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.652 -3.048 . 0.709 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 O4'-C1'-N19 111.637 3.437 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.436 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.325 0 C4'-C3'-C2' 98.795 -3.905 . 0.787 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.436 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.249 0 C4'-C3'-C2' 99.241 -3.459 . 0.613 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.141 -3.559 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . 0.453 HO2' " H5'" ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 100.016 -2.684 . 0.769 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.496 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.033 -3.667 . 0.612 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.496 " H5'" HO2' ' B' ' 246' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 C4'-C3'-C2' 98.877 -3.823 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.476 0 C4'-C3'-C2' 99.361 -3.339 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.418 -3.282 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.531 HO2' " H5'" ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 C4'-C3'-C2' 98.856 -3.844 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.531 " H5'" HO2' ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 C4'-C3'-C2' 98.972 -3.728 . 0.779 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 98.94 -3.76 . 0.684 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.54 HO2' " H5'" ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C4'-C3'-C2' 99.14 -3.56 . 0.84 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.54 " H5'" HO2' ' B' ' 253' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 98.95 -3.75 . 0.736 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.641 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.416 -3.092 0 C4'-C3'-C2' 99.591 -3.109 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.641 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.565 -3.135 . 0.699 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.444 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.333 0 C4'-C3'-C2' 99.379 -3.321 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.551 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 C4'-C3'-C2' 99.187 -3.513 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.551 " H5'" HO2' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.108 1 O4'-C1'-N19 113.086 4.886 . 0.68 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.791 -2.909 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.499 -3.201 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.083 0 C4'-C3'-C2' 98.859 -3.841 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.654 0 C4'-C3'-C2' 99.118 -3.582 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.438 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 110.774 2.574 . 0.907 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.535 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.288 -3.412 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.535 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 111.629 3.429 . 0.587 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.434 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 C4'-C3'-C2' 99.813 -2.887 . 0.69 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.532 HO2' " H5'" ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.482 1 C4'-C3'-C2' 98.617 -4.083 . 0.757 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.532 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C4'-C3'-C2' 99.459 -3.241 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . 0.452 " H1'" ' N6 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C5'-C4'-C3' 112.006 -2.33 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.506 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.094 1 C5'-C4'-C3' 109.343 -4.105 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.506 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.41 -3.558 2 C3'-C2'-C1' 105.668 4.631 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.53 0 C5'-C4'-C3' 112.545 -1.97 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.452 ' N6 ' " H1'" ' B' ' 270' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.414 -3.227 0 C4'-C3'-C2' 99.863 -2.837 . 0.841 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 C4'-C3'-C2' 98.973 -3.727 . 0.667 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.663 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.275 -3.425 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.663 " H5'" HO2' ' B' ' 276' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.412 -3.417 0 O4'-C1'-N19 111.951 3.751 . 0.722 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.457 HO2' " H5'" ' B' ' 279' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 C4'-C3'-C2' 99.858 -2.842 . 0.914 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . 0.457 " H5'" HO2' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.965 -3.735 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 98.863 -3.837 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.934 -3.766 . 0.871 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.114 0 C4'-C3'-C2' 99.594 -3.106 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.253 -3.447 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.454 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 C4'-C3'-C2' 99.636 -3.064 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.454 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C5'-C4'-C3' 111.297 -2.802 . 0.896 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 1 O4'-C1'-N19 112.503 4.303 . 0.529 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 O4'-C1'-N19 112.011 3.811 . 0.507 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 100.263 -2.437 . 0.831 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.479 HO2' " H5'" ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 111.542 3.342 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.633 HO2' " H5'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 C4'-C3'-C2' 98.825 -3.875 . 0.882 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.712 HO2' " H5'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 O4'-C1'-N19 111.911 3.711 . 0.421 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.712 " H5'" HO2' ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.476 1 C4'-C3'-C2' 98.644 -4.056 . 0.732 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.556 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.168 0 C4'-C3'-C2' 99.951 -2.749 . 0.562 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.516 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.449 0 C4'-C3'-C2' 99.415 -3.285 . 0.67 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.446 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 110.916 2.716 . 0.87 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.446 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.635 3.435 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.555 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 P--O5' 1.615 2.164 0 C4'-C3'-C2' 99.053 -3.647 . 0.662 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.555 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.534 -3.166 . 0.595 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.547 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C5'-C4'-C3' 111.568 -2.621 . 0.825 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.547 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C4'-C3'-C2' 99.13 -3.57 . 0.75 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.748 -3.952 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.438 HO2' " H5'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 98.848 -3.852 . 0.649 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.438 " H5'" HO2' ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.292 0 C4'-C3'-C2' 99.075 -3.625 . 0.782 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 1 O4'-C1'-N19 112.266 4.066 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . 0.499 HO2' " H5'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.022 -3.678 . 0.84 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.499 " H5'" HO2' ' B' ' 305' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 C4'-C3'-C2' 97.329 -5.371 . 0.685 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.478 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.708 1 O4'-C1'-N19 112.445 4.245 . 0.765 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.52 -0.221 0 CA-C-O 120.961 0.317 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.81 178.52 48.51 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.45 123.75 10.85 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.573 3.516 . . . . 0.0 111.868 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.4 p -154.28 11.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.033 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -140.23 156.35 70.0 Favored Pre-proline 0 C--O 1.23 0.059 0 C-N-CA 124.026 0.93 . . . . 0.0 110.068 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.02 -39.7 7.55 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.558 2.172 . . . . 0.0 108.986 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.582 HD21 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.582 ' H ' HD21 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.439 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.411 HG22 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -146.02 64.25 9.85 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.5 4.98 2.17 Favored 'Trans proline' 0 CA--C 1.536 0.607 1 C-N-CA 125.364 4.043 . . . . 0.0 112.531 -177.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -144.36 -176.58 5.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.233 0.613 . . . . 0.0 110.385 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -142.76 174.81 10.32 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.184 0.594 . . . . 0.0 110.033 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.3 p -149.79 12.56 0.79 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.434 0.294 . . . . 0.0 111.629 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -147.86 162.34 39.47 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 178.01 10.05 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.059 0.944 . . . . 0.0 109.91 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -146.75 175.08 10.89 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.201 0.6 . . . . 0.0 110.148 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.2 mt -140.3 13.78 2.39 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.703 0.801 . . . . 0.0 110.24 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.87 159.41 44.4 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.567 0.347 . . . . 0.0 110.925 -178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 24.3 ptp -160.73 -178.09 6.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 122.986 0.514 . . . . 0.0 110.387 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -170.54 171.64 43.76 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 ttm180 -156.9 164.7 37.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.202 0.601 . . . . 0.0 110.317 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.3 m -71.43 -5.26 31.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.693 0.797 . . . . 0.0 111.932 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 89.2 mt 49.41 32.48 4.66 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.549 0.74 . . . . 0.0 112.399 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.0 t -130.69 14.65 5.39 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.512 0.725 . . . . 0.0 109.402 178.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 8.3 p -147.65 27.85 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.962 1.305 . . . . 0.0 108.919 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -131.9 8.55 4.47 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.412 -176.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.2 m 48.97 26.56 1.38 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.774 1.23 . . . . 0.0 112.919 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -65.59 -16.78 64.04 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.886 -0.509 . . . . 0.0 110.461 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -158.71 178.26 10.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.251 1.02 . . . . 0.0 108.811 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 81.8 p -139.21 178.45 7.17 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 122.62 0.368 . . . . 0.0 110.918 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.8 p -139.47 13.24 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.274 0.63 . . . . 0.0 111.431 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 55.41 -175.62 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.624 1.17 . . . . 0.0 113.26 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -152.31 152.02 31.6 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.606 0.762 . . . . 0.0 109.396 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.15 7.5 0.39 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 122.555 0.342 . . . . 0.0 111.18 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -149.6 173.55 13.52 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -143.9 155.01 59.34 Favored Pre-proline 0 N--CA 1.454 -0.226 0 C-N-CA 123.255 0.622 . . . . 0.0 109.976 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.05 8.65 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 124.254 3.303 . . . . 0.0 112.784 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -148.94 159.61 44.04 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.236 0.615 . . . . 0.0 110.342 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 77.4 p -143.17 -2.68 0.99 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.704 0.802 . . . . 0.0 112.11 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.09 161.01 25.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.195 0.452 . . . . 0.0 110.076 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.53 -179.47 7.81 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.743 0.417 . . . . 0.0 110.692 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -144.82 -178.32 5.96 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.429 0.691 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.38 -158.87 9.25 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -128.46 7.92 5.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.643 0.377 . . . . 0.0 111.734 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 49.97 -163.11 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.846 1.258 . . . . 0.0 113.592 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 5.2 t -43.42 138.01 2.87 Favored Pre-proline 0 C--N 1.34 0.189 0 C-N-CA 125.699 1.6 . . . . 0.0 112.387 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -79.01 2.4 8.32 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.98 3.12 . . . . 0.0 111.964 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.8 t0 54.86 28.35 10.3 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.17 0.588 . . . . 0.0 111.957 -177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -142.58 159.31 42.47 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.822 1.249 . . . . 0.0 108.828 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.9 p -150.44 163.66 37.83 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -163.03 154.57 14.96 Favored Pre-proline 0 N--CA 1.456 -0.15 0 C-N-CA 124.26 1.024 . . . . 0.0 109.17 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -70.23 156.65 61.64 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.64 2.227 . . . . 0.0 110.219 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.82 175.09 11.75 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 123.735 2.957 . . . . 0.0 111.09 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -143.16 15.17 1.87 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.001 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -146.63 169.21 19.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.345 0.658 . . . . 0.0 109.448 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 57.7 t -141.47 151.05 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 122.787 0.435 . . . . 0.0 109.833 -177.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -179.96 -173.22 44.76 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.0 t -152.59 168.04 26.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.119 0.459 . . . . 0.0 110.738 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -144.24 9.01 1.42 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.041 0.536 . . . . 0.0 111.094 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.42 -173.24 41.0 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 -177.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -143.31 2.76 1.3 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -67.16 0.24 2.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.752 0.821 . . . . 0.0 111.476 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.4 m -136.3 14.75 3.24 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.354 0.662 . . . . 0.0 111.252 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -142.36 -1.9 1.15 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.848 0.459 . . . . 0.0 111.563 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 60.9 m -145.1 5.69 1.12 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.506 0.722 . . . . 0.0 110.697 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.0 m -148.48 177.87 9.09 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.903 0.881 . . . . 0.0 110.635 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.8 p -148.43 168.46 22.61 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.894 0.878 . . . . 0.0 110.56 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 173.14 -161.69 32.8 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -141.71 158.07 44.27 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 135' ' ' LEU . 5.3 p -149.09 6.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.445 0.698 . . . . 0.0 110.061 -176.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.3 t -66.44 8.28 0.25 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.772 0.829 . . . . 0.0 112.705 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.414 ' H ' ' C ' ' A' ' 133' ' ' VAL . 96.1 mt -135.12 11.12 3.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.164 0.586 . . . . 0.0 111.042 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 63.8 p -147.57 5.85 0.82 Allowed 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.62 -0.08 0.85 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.644 0.656 . . . . 0.0 112.469 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.9 p -158.83 160.79 29.1 Favored Pre-proline 0 C--O 1.234 0.249 0 O-C-N 122.06 -0.4 . . . . 0.0 110.729 179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.23 163.43 4.64 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.63 2.886 . . . . 0.0 112.157 173.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 26.7 m -59.99 152.78 58.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.673 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -77.22 0.34 9.84 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.827 3.018 . . . . 0.0 111.604 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.98 163.29 17.51 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 121.434 0.635 . . . . 0.0 111.628 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 66.7 p -84.49 178.73 7.61 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.26 0.624 . . . . 0.0 110.743 178.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 45.62 40.39 5.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.39 1.076 . . . . 0.0 111.832 178.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 6.2 t -121.2 4.5 10.33 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.597 0.359 . . . . 0.0 111.887 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 36.26 66.73 1.8 Allowed Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 125.626 1.57 . . . . 0.0 112.496 177.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.15 165.79 31.28 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.611 2.874 . . . . 0.0 110.814 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -50.96 155.58 5.77 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.118 3.212 . . . . 0.0 112.794 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -152.78 153.53 30.23 Favored Pre-proline 0 CA--C 1.531 0.212 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.13 9.62 2.02 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.292 3.328 . . . . 0.0 113.764 -171.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.3 tt -56.78 138.23 77.97 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 118.401 0.546 . . . . 0.0 109.628 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -51.28 133.98 43.44 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.858 2.372 . . . . 0.0 111.438 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.68 166.65 25.22 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.93 3.087 . . . . 0.0 110.552 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.02 173.14 14.11 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.994 2.463 . . . . 0.0 109.836 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -153.04 143.65 15.7 Favored Pre-proline 0 C--O 1.233 0.224 0 O-C-N 121.634 -0.666 . . . . 0.0 110.404 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -52.55 166.85 0.68 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.474 3.449 . . . . 0.0 112.684 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.07 155.61 5.98 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.71 2.94 . . . . 0.0 111.969 177.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.37 15.05 0.68 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.877 3.718 . . . . 0.0 111.685 -177.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 30.6 m -63.53 -5.69 4.16 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -176.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 90.54 11.65 62.05 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 118.574 0.625 . . . . 0.0 112.17 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -146.93 -175.6 4.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 117.439 0.62 . . . . 0.0 111.393 -178.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -128.05 159.81 64.85 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -177.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.69 -13.81 32.64 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.755 2.303 . . . . 0.0 110.767 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.42 ' CG ' HG12 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.39 159.72 40.92 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.4 p -165.1 165.29 20.02 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.158 0.583 . . . . 0.0 109.9 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 123.39 175.75 14.59 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 177.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.37 159.63 34.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 49.4 m -61.99 -6.72 3.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -127.04 12.93 7.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.365 0.266 . . . . 0.0 110.68 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.72 15.59 1.1 Allowed 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 63.6 tttt -61.29 158.74 13.64 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.386 1.074 . . . . 0.0 112.285 -176.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.42 HG12 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 32.92 22.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.7 mt -132.09 -172.64 2.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.729 0.811 . . . . 0.0 110.573 -175.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -145.77 18.44 1.46 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.954 0.501 . . . . 0.0 111.549 -177.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 15.0 tp 50.14 31.7 5.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.596 1.158 . . . . 0.0 111.9 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 70.7 mt 61.51 8.1 2.09 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.897 1.679 . . . . 0.0 113.497 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.89 155.34 36.7 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.344 -0.847 . . . . 0.0 110.365 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -158.73 170.04 23.04 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.066 -0.396 . . . . 0.0 110.531 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -91.22 0.97 57.43 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.989 0.516 . . . . 0.0 111.501 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . 0.431 ' CG ' ' H ' ' A' ' 234' ' ' HIS . 11.3 t-80 -143.56 176.32 9.29 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.564 0.746 . . . . 0.0 109.17 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . 0.431 ' H ' ' CG ' ' A' ' 233' ' ' HIS . 55.4 t60 -151.1 161.96 41.75 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.618 0.247 . . . . 0.0 111.484 -174.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.36 160.08 42.95 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.102 0.961 . . . . 0.0 109.437 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.861 179.105 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.118 -3.582 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.204 -3.496 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C4'-C3'-C2' 99.595 -3.105 . 0.847 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.595 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.215 -3.485 . 0.804 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.595 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.865 3.665 . 0.599 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.539 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.765 -3.935 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.539 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.905 -3.795 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.376 -3.324 . 0.713 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 C4'-C3'-C2' 99.702 -2.998 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.364 0 O4'-C1'-N19 111.548 3.348 . 0.524 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 O4'-C1'-N19 111.756 3.556 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 O4'-C1'-N19 111.349 3.149 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . 0.431 HO2' " H5'" ' B' ' 250' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.894 0 C4'-C3'-C2' 99.872 -2.828 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . 0.431 " H5'" HO2' ' B' ' 249' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.524 -3.176 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.478 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.416 -3.284 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.478 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.088 -3.612 . 0.631 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.411 " H5'" HO2' ' B' ' 252' ' ' ' G' . . . . . . . . 0 P--O5' 1.617 2.396 0 C4'-C3'-C2' 98.973 -3.727 . 0.708 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.6 -3.1 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.59 HO2' " H5'" ' B' ' 256' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.429 0 O4'-C1'-N19 111.031 2.831 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . 0.59 " H5'" HO2' ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.253 -3.447 . 0.626 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.609 HO2' " H5'" ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.936 0 C4'-C3'-C2' 99.409 -3.291 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.618 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 C4'-C3'-C2' 98.385 -4.315 . 0.724 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.618 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 99.083 -3.617 . 0.755 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.42 0 C4'-C3'-C2' 99.939 -2.761 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.563 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C4'-C3'-C2' 99.647 -3.053 . 0.861 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.563 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.112 -3.588 . 0.72 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . 0.473 HO2' " H5'" ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C4'-C3'-C2' 98.805 -3.895 . 0.878 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.473 " H5'" HO2' ' B' ' 264' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C4'-C3'-C2' 99.937 -2.763 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.475 HO2' " H5'" ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.646 -3.054 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.475 " H5'" HO2' ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.805 0 C4'-C3'-C2' 99.663 -3.037 . 0.667 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.557 -3.143 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.831 -2.869 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 0 N19-C1'-C2' 108.7 -2.938 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.456 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.542 2.455 1 C4'-C3'-O3' 121.345 4.133 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.456 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.921 3 P-O3'-C3' 125.399 4.749 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.583 0 C4'-C3'-C2' 99.894 -2.806 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C4'-C3'-C2' 99.694 -3.006 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 C4'-C3'-C2' 98.93 -3.77 . 0.581 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.518 HO2' " H5'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.392 1 C4'-C3'-C2' 98.545 -4.155 . 0.684 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.522 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 100.023 -2.677 . 0.55 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.522 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 99.7 -3.0 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.663 1 C4'-C3'-C2' 98.383 -4.317 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 98.978 -3.722 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.578 1 C4'-C3'-C2' 98.556 -4.144 . 0.906 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.41 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.01 -3.69 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.41 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.344 0 C4'-C3'-C2' 99.393 -3.307 . 0.861 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.44 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C4'-C3'-C2' 99.214 -3.486 . 0.825 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.44 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.014 0 C4'-C3'-C2' 100.095 -2.605 . 0.872 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.545 1 O4'-C1'-N19 113.075 4.875 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.662 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.539 -3.161 . 0.542 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.662 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.285 0 C4'-C3'-C2' 99.9 -2.8 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.569 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.102 0 O4'-C1'-N19 111.392 3.192 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . 0.633 HO2' " H5'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.149 -3.551 . 0.864 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . 0.633 " H5'" HO2' ' B' ' 290' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.761 -2.939 . 0.496 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.611 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.275 -3.425 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.611 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.519 -3.181 . 0.692 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.599 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.766 1 O4'-C1'-N19 112.227 4.027 . 0.727 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.421 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.495 3.295 . 0.833 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.421 " H5'" HO2' ' B' ' 295' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.264 0 C4'-C3'-C2' 99.443 -3.257 . 0.731 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C4'-C3'-C2' 99.136 -3.564 . 0.662 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 0 O4'-C1'-N19 112.007 3.807 . 0.584 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.512 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 C4'-C3'-C2' 99.473 -3.227 . 0.86 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.512 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C4'-C3'-C2' 99.356 -3.344 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.598 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 C4'-C3'-C2' 98.815 -3.885 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.598 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.899 0 C4'-C3'-C2' 99.255 -3.445 . 0.668 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.459 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.112 -3.588 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.459 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.877 0 C4'-C3'-C2' 98.782 -3.918 . 0.832 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.977 -2.723 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.466 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.459 1 C4'-C3'-C2' 97.849 -4.851 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.466 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.989 0 O4'-C1'-N19 111.75 3.55 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.983 0.34 . . . . 0.0 112.983 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.4 177.54 48.3 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 178.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -50.89 156.98 4.14 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 124.928 3.752 . . . . 0.0 114.083 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.8 p -154.0 136.35 6.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp 41.73 54.86 8.69 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.467 0.707 . . . . 0.0 111.718 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.8 -16.99 37.65 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.646 2.897 . . . . 0.0 111.821 -173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.4 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.405 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.54 HD21 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.54 ' H ' HD21 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.457 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 27' ' ' GLN . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.546 HG13 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.478 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.413 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.413 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.725 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 10.5 m-85 -144.21 54.54 2.85 Favored Pre-proline 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.725 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 72.0 Cg_endo -68.73 -5.4 15.33 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 124.87 3.714 . . . . 0.0 112.884 -178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -149.4 17.96 0.93 Allowed 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.79 -0.569 . . . . 0.0 110.895 -177.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.78 172.2 15.02 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.915 -0.49 . . . . 0.0 110.876 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 88.9 p -155.94 6.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.16 -2.61 19.32 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.8 -0.563 . . . . 0.0 111.777 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.9 174.92 13.01 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.62 0.768 . . . . 0.0 109.672 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -157.1 177.06 11.92 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.899 0.48 . . . . 0.0 111.642 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.8 tp -152.43 166.14 32.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.892 1.277 . . . . 0.0 107.878 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.07 157.64 44.34 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.314 0.578 . . . . 0.0 110.735 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 84.2 mtp -146.52 24.6 1.24 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.063 0.945 . . . . 0.0 110.229 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.23 174.55 23.76 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 111.339 -0.704 . . . . 0.0 111.339 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -154.4 -175.9 5.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.113 0.565 . . . . 0.0 111.226 -175.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.0 m -53.79 155.51 3.24 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 124.573 1.149 . . . . 0.0 110.913 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 97.0 mt -134.11 178.52 6.9 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.869 0.868 . . . . 0.0 110.174 -177.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.7 t -149.92 -170.72 3.72 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.456 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -57.38 168.41 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.239 0.616 . . . . 0.0 111.781 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -145.41 174.49 11.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.435 0.694 . . . . 0.0 109.614 -175.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.1 t -145.16 166.64 24.83 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 123.034 0.534 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -153.17 -175.67 5.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.532 0.733 . . . . 0.0 109.392 -175.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -134.26 169.41 17.24 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.16 0.505 . . . . 0.0 110.848 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 t -149.79 -176.0 5.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.756 0.822 . . . . 0.0 109.035 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.0 m -140.44 177.55 7.93 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.376 0.608 . . . . 0.0 111.823 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.79 179.15 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.502 0.721 . . . . 0.0 110.046 -177.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.58 165.63 26.74 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.2 0.6 . . . . 0.0 111.141 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.22 169.82 11.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.956 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -153.94 165.11 37.13 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.407 0.683 . . . . 0.0 109.776 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -145.61 154.62 52.55 Favored Pre-proline 0 N--CA 1.456 -0.148 0 C-N-CA 122.905 0.482 . . . . 0.0 109.903 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.51 171.86 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.919 3.08 . . . . 0.0 111.256 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -151.59 163.8 38.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.725 0.81 . . . . 0.0 109.775 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.6 p -146.47 171.72 14.62 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.375 0.67 . . . . 0.0 110.198 -177.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.7 mt -141.56 168.31 20.08 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.118 0.967 . . . . 0.0 109.614 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -146.48 176.36 9.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 122.561 0.344 . . . . 0.0 110.329 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -62.91 169.1 3.46 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.244 0.618 . . . . 0.0 112.0 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.51 -176.53 38.88 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.77 149.28 40.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 111.267 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -157.27 168.06 28.51 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.423 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 10.2 t -149.46 144.41 17.85 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.56 173.99 12.39 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 C-N-CA 123.639 2.893 . . . . 0.0 110.764 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -151.43 168.87 23.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.927 0.491 . . . . 0.0 110.196 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -144.78 174.48 10.95 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.535 0.734 . . . . 0.0 110.042 -177.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.2 m -144.0 159.05 43.26 Favored 'General case' 0 C--N 1.337 0.065 0 C-N-CA 122.907 0.483 . . . . 0.0 110.806 -178.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -73.32 155.88 89.49 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.03 165.45 32.34 Favored 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 123.416 2.744 . . . . 0.0 110.163 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -70.74 174.12 10.83 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.922 3.081 . . . . 0.0 111.405 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.29 170.44 15.98 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.585 0.754 . . . . 0.0 110.05 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -143.29 -176.46 4.94 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.488 0.715 . . . . 0.0 111.216 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.76 12.61 2.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 122.742 0.417 . . . . 0.0 110.628 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.95 170.42 34.82 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 51.0 m -148.38 13.06 0.95 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.777 0.431 . . . . 0.0 111.513 -175.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -146.78 163.52 35.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.127 0.489 . . . . 0.0 110.575 -176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 179.29 28.22 0.05 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -144.3 45.33 1.42 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.225 0.61 . . . . 0.0 110.288 -175.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -133.9 32.14 3.54 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.157 0.583 . . . . 0.0 110.753 -176.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.3 p -137.95 168.67 19.23 Favored 'General case' 0 N--CA 1.461 0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.967 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -82.07 8.28 11.17 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.901 0.48 . . . . 0.0 111.997 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 42.0 m 54.97 31.19 15.48 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.989 0.915 . . . . 0.0 112.133 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.7 m -135.43 11.04 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.227 0.611 . . . . 0.0 111.195 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 37.4 m -69.57 -2.7 12.19 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.329 0.252 . . . . 0.0 111.673 178.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -174.07 171.02 44.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -155.02 13.43 0.39 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 121.059 0.457 . . . . 0.0 111.117 -179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.86 28.23 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.172 0.511 . . . . 0.0 110.585 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.2 t -133.77 13.73 4.02 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.072 0.549 . . . . 0.0 110.955 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -133.69 5.88 3.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.155 0.582 . . . . 0.0 110.669 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.6 p -151.92 14.29 0.63 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -144.95 12.44 1.42 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.492 0.717 . . . . 0.0 111.918 -174.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 65.4 m -144.76 156.79 55.8 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 122.326 0.251 . . . . 0.0 110.56 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -74.06 -173.88 1.57 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 124.104 3.203 . . . . 0.0 111.029 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.9 m -136.49 154.89 77.16 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.58 170.36 17.75 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.71 2.94 . . . . 0.0 111.656 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.32 178.18 9.79 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.46 0.704 . . . . 0.0 110.329 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 82.4 p -142.8 7.5 1.66 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.487 0.315 . . . . 0.0 111.716 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.71 177.79 10.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.676 0.39 . . . . 0.0 110.865 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.8 t -153.89 166.44 32.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.925 0.49 . . . . 0.0 110.319 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -63.07 123.07 78.87 Favored Pre-proline 0 CA--C 1.531 0.237 0 C-N-CA 122.807 0.443 . . . . 0.0 110.296 -179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.36 161.93 25.44 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 123.268 2.645 . . . . 0.0 110.069 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -61.31 147.11 96.42 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.302 2.668 . . . . 0.0 111.704 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.57 ' H ' ' CD ' ' A' ' 150' ' ' PRO . 3.6 mm? -131.28 -9.01 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 117.524 -1.227 . . . . 0.0 113.888 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.57 ' CD ' ' H ' ' A' ' 149' ' ' LEU . 50.6 Cg_endo -79.91 2.52 8.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 CA-C-N 122.369 1.882 . . . . 0.0 112.708 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 38.9 pt -57.9 149.1 56.28 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-O 121.072 0.463 . . . . 0.0 111.871 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -76.69 166.34 27.3 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.316 3.344 . . . . 0.0 110.239 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.37 168.17 21.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.533 2.822 . . . . 0.0 109.578 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.05 -14.02 26.26 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.951 3.101 . . . . 0.0 114.123 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -146.38 67.09 11.55 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.087 0.555 . . . . 0.0 111.127 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.92 152.14 21.79 Favored 'Trans proline' 0 N--CA 1.447 -1.226 0 C-N-CA 123.352 2.701 . . . . 0.0 110.727 -174.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.93 164.52 27.41 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 124.043 3.162 . . . . 0.0 109.108 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -70.2 161.61 45.35 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.672 2.248 . . . . 0.0 109.974 175.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.2 t -157.92 -22.93 0.08 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 151.38 -170.42 30.98 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -140.89 158.58 43.74 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -64.57 112.42 7.8 Favored Pre-proline 0 C--O 1.227 -0.083 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.9 -10.69 9.24 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 123.371 2.714 . . . . 0.0 111.851 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.3 164.58 28.91 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.6 p -160.62 158.61 29.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.493 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 121.54 173.04 14.46 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -83.08 166.76 18.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 50.2 m -65.4 4.92 0.46 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -132.87 12.56 4.35 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.359 0.264 . . . . 0.0 110.903 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -156.04 13.77 0.32 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 110.09 -178.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -63.41 162.39 12.56 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.476 0.71 . . . . 0.0 112.556 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' VAL . . . . . 0.491 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.442 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.442 HE21 HG22 ' A' ' 223' ' ' VAL . 3.4 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.442 HG22 HE21 ' A' ' 199' ' ' GLN . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 56.46 34.64 24.62 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.9 mt -139.28 -162.44 1.33 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.628 1.171 . . . . 0.0 109.729 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -146.64 156.62 43.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.03 139.75 58.8 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 111.032 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.0 168.41 11.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.213 0.605 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -144.69 12.9 1.5 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.83 0.852 . . . . 0.0 111.346 178.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 59.7 m80 -72.68 2.94 5.62 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.334 0.654 . . . . 0.0 112.542 -179.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 232' ' ' HIS . . . . . 0.631 ' CG ' ' H ' ' A' ' 233' ' ' HIS . 14.6 t60 -152.66 -170.07 3.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 120.902 0.382 . . . . 0.0 110.323 -176.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 233' ' ' HIS . . . . . 0.631 ' H ' ' CG ' ' A' ' 232' ' ' HIS . 21.9 t60 -132.27 173.78 10.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.854 0.862 . . . . 0.0 110.511 -178.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 234' ' ' HIS . . . . . 0.43 ' H ' ' CG ' ' A' ' 233' ' ' HIS . 7.6 p80 -146.93 -168.51 3.06 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.002 0.521 . . . . 0.0 111.808 -177.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -56.62 -18.45 12.06 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -170.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.361 -179.839 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.045 -3.655 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 238' ' ' ' G' . . . . . 0.476 HO2' " H5'" ' B' ' 239' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.798 3.598 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 239' ' ' ' C' . . . . . 0.55 HO2' " H5'" ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.27 -3.43 . 0.804 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 240' ' ' ' A' . . . . . 0.597 HO2' " H5'" ' B' ' 241' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.226 -3.474 . 0.813 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 241' ' ' ' U' . . . . . 0.597 " H5'" HO2' ' B' ' 240' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.721 3.521 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 242' ' ' ' U' . . . . . 0.583 HO2' " H5'" ' B' ' 243' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C4'-C3'-C2' 99.271 -3.429 . 0.818 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 243' ' ' ' A' . . . . . 0.583 " H5'" HO2' ' B' ' 242' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.54 1 C4'-C3'-C2' 98.555 -4.145 . 0.602 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.103 0 C4'-C3'-C2' 99.059 -3.641 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.188 -3.512 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 246' ' ' ' G' . . . . . 0.49 HO2' " H5'" ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.404 3.204 . 0.508 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 247' ' ' ' U' . . . . . 0.527 HO2' " H5'" ' B' ' 248' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 O4'-C1'-N19 111.884 3.684 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 248' ' ' ' G' . . . . . 0.527 " H5'" HO2' ' B' ' 247' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 C4'-C3'-C2' 98.823 -3.877 . 0.648 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C4'-C3'-C2' 99.332 -3.368 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 C4'-C3'-C2' 100.083 -2.617 . 0.86 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 251' ' ' ' U' . . . . . 0.552 HO2' " H5'" ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.919 -3.781 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 252' ' ' ' G' . . . . . 0.552 " H5'" HO2' ' B' ' 251' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.051 -3.649 . 0.696 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 253' ' ' ' G' . . . . . 0.459 " H5'" HO2' ' B' ' 252' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.346 -3.354 . 0.72 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 254' ' ' ' A' . . . . . 0.501 HO2' " H5'" ' B' ' 255' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C5'-C4'-O4' 113.067 2.762 . 0.718 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 255' ' ' ' A' . . . . . 0.501 " H5'" HO2' ' B' ' 254' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 C4'-C3'-C2' 99.492 -3.208 . 0.787 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C4'-C3'-C2' 99.389 -3.311 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 257' ' ' ' A' . . . . . 0.448 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C4'-C3'-C2' 99.223 -3.477 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 258' ' ' ' G' . . . . . 0.448 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.97 -3.73 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 259' ' ' ' U' . . . . . 0.648 HO2' " H5'" ' B' ' 260' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.315 1 C4'-C3'-C2' 98.572 -4.128 . 0.802 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 260' ' ' ' A' . . . . . 0.648 " H5'" HO2' ' B' ' 259' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.31 3.11 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 261' ' ' ' U' . . . . . 0.405 HO2' " H5'" ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.452 -3.248 . 0.891 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 262' ' ' ' A' . . . . . 0.576 HO2' " H5'" ' B' ' 263' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.324 0 C4'-C3'-C2' 99.587 -3.113 . 0.84 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 263' ' ' ' A' . . . . . 0.576 " H5'" HO2' ' B' ' 262' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.284 -3.416 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C4'-C3'-C2' 99.7 -3.0 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 265' ' ' ' A' . . . . . 0.531 HO2' " H5'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.078 0 C4'-C3'-C2' 99.514 -3.186 . 0.854 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 266' ' ' ' A' . . . . . 0.531 " H5'" HO2' ' B' ' 265' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.364 -3.336 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 267' ' ' ' U' . . . . . 0.537 HO2' " H5'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.633 -3.067 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 268' ' ' ' A' . . . . . 0.537 " H5'" HO2' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.366 -3.334 . 0.714 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 269' ' ' ' U' . . . . . 0.467 " H5'" HO2' ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 N19-C1'-C2' 108.318 -3.176 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C5'-C4'-C3' 111.893 -2.405 . 0.654 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 271' ' ' ' C' . . . . . 0.426 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.478 1 C5'-C4'-C3' 108.909 -4.394 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 272' ' ' ' U' . . . . . 0.434 H5'' ' C6 ' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.924 1 C5'-C4'-C3' 109.152 -4.232 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' B' B ' 273' ' ' ' A' . . . . . 0.62 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 274' ' ' ' A' . . . . . 0.725 HO2' " H5'" ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.494 2 N19-C1'-C2' 122.448 5.655 . 0.325 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 275' ' ' ' A' . . . . . 0.725 " H5'" HO2' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.149 0 O4'-C1'-N19 110.947 2.747 . 0.305 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 276' ' ' ' U' . . . . . 0.588 " H5'" HO2' ' B' ' 275' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C4'-C3'-C2' 98.789 -3.911 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 277' ' ' ' G' . . . . . 0.53 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.359 0 O4'-C1'-N19 111.426 3.226 . 0.587 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 278' ' ' ' U' . . . . . 0.53 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.871 -3.829 . 0.894 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C4'-C3'-C2' 98.603 -4.097 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 280' ' ' ' G' . . . . . 0.416 HO2' " H5'" ' B' ' 281' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.357 -3.343 . 0.801 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 281' ' ' ' U' . . . . . 0.416 " H5'" HO2' ' B' ' 280' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.11 0 C4'-C3'-C2' 99.163 -3.537 . 0.93 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 282' ' ' ' U' . . . . . 0.5 HO2' " H5'" ' B' ' 283' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 99.189 -3.511 . 0.862 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 283' ' ' ' A' . . . . . 0.5 " H5'" HO2' ' B' ' 282' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C4'-C3'-C2' 99.359 -3.341 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 284' ' ' ' U' . . . . . 0.445 HO2' " H5'" ' B' ' 285' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.293 -3.407 . 0.893 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 285' ' ' ' A' . . . . . 0.445 " H5'" HO2' ' B' ' 284' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.889 0 C4'-C3'-C2' 100.354 -2.346 . 0.887 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 286' ' ' ' G' . . . . . 0.459 HO2' " H5'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.143 0 O4'-C1'-N19 112.148 3.948 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 287' ' ' ' U' . . . . . 0.579 HO2' " H5'" ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.144 -3.556 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 288' ' ' ' A' . . . . . 0.579 " H5'" HO2' ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.55 0 C4'-C3'-C2' 99.955 -2.745 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 289' ' ' ' U' . . . . . 0.507 " H5'" HO2' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.904 0 C5'-C4'-C3' 110.932 -3.045 . 0.867 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 O4'-C1'-N19 112.042 3.842 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 O4'-C1'-N19 111.656 3.456 . 0.539 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 292' ' ' ' C' . . . . . 0.614 HO2' " H5'" ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.122 0 C4'-C3'-C2' 99.349 -3.351 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 293' ' ' ' A' . . . . . 0.614 " H5'" HO2' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.377 0 O4'-C1'-N19 111.838 3.638 . 0.625 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 294' ' ' ' C' . . . . . 0.545 " H5'" HO2' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.534 0 C4'-C3'-C2' 98.83 -3.87 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 295' ' ' ' C' . . . . . 0.493 HO2' " H5'" ' B' ' 296' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.085 0 O4'-C1'-N19 111.656 3.456 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 296' ' ' ' U' . . . . . 0.584 HO2' " H5'" ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.181 -3.519 . 0.752 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 297' ' ' ' A' . . . . . 0.589 HO2' " H5'" ' B' ' 298' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C4'-C3'-C2' 99.699 -3.001 . 0.589 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 298' ' ' ' C' . . . . . 0.589 " H5'" HO2' ' B' ' 297' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 98.863 -3.837 . 0.684 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 299' ' ' ' C' . . . . . 0.556 HO2' " H5'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.043 2.843 . 0.794 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 300' ' ' ' C' . . . . . 0.556 " H5'" HO2' ' B' ' 299' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.52 -3.18 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 301' ' ' ' U' . . . . . 0.574 HO2' " H5'" ' B' ' 302' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C4'-C3'-C2' 99.057 -3.643 . 0.648 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 302' ' ' ' G' . . . . . 0.574 " H5'" HO2' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 C4'-C3'-C2' 98.48 -4.22 . 0.634 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 303' ' ' ' A' . . . . . 0.464 HO2' " H5'" ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C4'-C3'-C2' 98.611 -4.089 . 0.677 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 304' ' ' ' U' . . . . . 0.464 " H5'" HO2' ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 112.024 3.824 . 0.792 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 O4'-C1'-N19 111.076 2.876 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 306' ' ' ' C' . . . . . 0.458 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.354 1 C4'-C3'-C2' 98.112 -4.588 . 0.776 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 307' ' ' ' C' . . . . . 0.458 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 O4'-C1'-N19 111.854 3.654 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo . . . . . 0 N--CA 1.453 -0.9 0 CA-C-O 120.094 -0.044 . . . . 0.0 112.019 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.599 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.69 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.69 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.587 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.558 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.587 ' HG2' HD23 ' A' ' 24' ' ' LEU . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.475 HG11 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' O ' HG22 ' A' ' 53' ' ' THR . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 52' ' ' PRO 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.475 ' CE2' HG11 ' A' ' 42' ' ' VAL . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 119.853 -0.145 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.423 ' H ' HG13 ' A' ' 166' ' ' ILE . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.456 HD22 HD21 ' A' ' 174' ' ' LEU . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' LEU . . . . . 0.456 HD21 HD22 ' A' ' 167' ' ' LEU . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 175' ' ' LYS . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.491 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.796 0.331 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.491 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 119.858 -0.143 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.64 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.547 ' CB ' HG22 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.547 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.601 ' HG2' HD23 ' A' ' 24' ' ' LEU . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.643 HG11 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.488 ' HB2' HD21 ' A' ' 35' ' ' LEU . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.643 ' CE2' HG11 ' A' ' 42' ' ' VAL . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.411 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 91.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 N-CA-C 110.678 -0.547 . . . . 0.0 110.678 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.411 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' PHE . . . . . 0.523 ' CE1' ' HE2' ' A' ' 208' ' ' LYS . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.483 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.411 HG21 ' HB1' ' A' ' 219' ' ' ALA . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.523 ' HE2' ' CE1' ' A' ' 178' ' ' PHE . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.411 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.438 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.2 m120 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.462 -0.348 0 N-CA-C 114.225 0.817 . . . . 0.0 114.225 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.432 HD13 HD13 ' A' ' 66' ' ' LEU . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.572 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.681 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CD1' HD21 ' A' ' 20' ' ' LEU . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.608 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.608 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.587 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.424 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.5 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.587 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.408 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 20' ' ' LEU . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.431 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.431 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 16' ' ' ILE . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.572 ' CD2' ' HE2' ' A' ' 17' ' ' LYS . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.7 Cg_endo . . . . . 0 N--CA 1.449 -1.122 0 CA-C-O 119.994 -0.086 . . . . 0.0 111.935 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.421 HG13 ' HE3' ' A' ' 212' ' ' LYS . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.483 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 212' ' ' LYS . . . . . 0.421 ' HE3' HG13 ' A' ' 164' ' ' VAL . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.3 m120 . . . . . 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo . . . . . 0 N--CA 1.46 -0.479 0 N-CA-C 114.899 1.076 . . . . 0.0 114.899 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.686 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.621 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.621 ' H ' HD22 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.551 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.3 p80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.551 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.613 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.481 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.622 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 39' ' ' SER . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.622 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.455 -0.789 0 N-CA-C 111.89 -0.081 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' LEU . . . . . 0.418 ' C ' ' HD3' ' A' ' 175' ' ' LYS . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 174' ' ' LEU . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 . . . . . 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt . . . . . 0 CA--C 1.526 0.033 0 CA-C-O 120.677 0.275 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo . . . . . 0 CA--C 1.537 0.645 0 CA-C-O 121.078 0.366 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 11' ' ' MET . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 16' ' ' ILE . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.542 HD13 HD13 ' A' ' 66' ' ' LEU . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.483 ' HG3' HD12 ' A' ' 20' ' ' LEU . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.687 ' N ' HD22 ' A' ' 20' ' ' LEU . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.65 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.577 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.577 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.65 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.556 ' CG2' HD23 ' A' ' 20' ' ' LEU . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' A' ' 20' ' ' LEU . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.417 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' HG22 ' A' ' 53' ' ' THR . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' O ' ' A' ' 52' ' ' PRO 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.449 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.549 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.549 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 16' ' ' ILE . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 CA-C-O 120.61 0.171 . . . . 0.0 111.77 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.481 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 167' ' ' LEU . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.492 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.492 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.479 HD22 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.62 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 115.376 1.26 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.486 HD13 HD13 ' A' ' 66' ' ' LEU . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.589 ' N ' HD22 ' A' ' 20' ' ' LEU . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.556 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' H ' HD22 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.561 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.561 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.556 ' HG2' HD23 ' A' ' 24' ' ' LEU . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.565 HG23 HD23 ' A' ' 20' ' ' LEU . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.462 ' HB2' HD21 ' A' ' 35' ' ' LEU . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.486 HD13 HD13 ' A' ' 16' ' ' ILE . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo . . . . . 0 N--CA 1.449 -1.13 0 N-CA-C 110.483 -0.622 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.429 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.498 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 111.487 0.18 . . . . 0.0 111.487 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.498 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.436 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.429 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 113.756 0.637 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.525 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.665 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.52 ' CD1' HD21 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.578 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' VAL . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.5 p80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.578 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 24' ' ' LEU . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.537 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.442 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.525 ' CD2' ' HE2' ' A' ' 17' ' ' LYS . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.464 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo . . . . . 0 N--CA 1.454 -0.814 0 N-CA-C 109.831 -0.873 . . . . 0.0 109.831 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.485 ' CG ' HG13 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.291 0.091 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.485 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 113.956 0.714 . . . . 0.0 113.956 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HB2' ' A' ' 66' ' ' LEU . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.619 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.619 ' N ' HD22 ' A' ' 20' ' ' LEU . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.606 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.614 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 31' ' ' VAL . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.614 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.448 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.409 HG21 ' CE2' ' A' ' 69' ' ' PHE . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 39' ' ' SER . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.446 ' O ' HG22 ' A' ' 53' ' ' THR . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 52' ' ' PRO 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.407 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CD2' ' HE3' ' A' ' 64' ' ' LYS . 5.9 t60 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.412 ' HE3' ' CD2' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HB2' HD11 ' A' ' 16' ' ' ILE . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.454 ' HA ' HD12 ' A' ' 166' ' ' ILE . 89.4 Cg_endo . . . . . 0 N--CA 1.443 -1.451 0 CA-C-O 119.194 -0.419 . . . . 0.0 111.81 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' A' ' 163' ' ' PRO . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG13 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.384 0.135 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.2 m120 . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.452 0.52 . . . . 0.0 113.452 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 66' ' ' LEU . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.682 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.672 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.603 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.542 ' CB ' HG22 ' A' ' 37' ' ' VAL . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' HD2' HD21 ' A' ' 24' ' ' LEU . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.672 ' HG2' HD23 ' A' ' 24' ' ' LEU . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.518 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.602 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.456 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 16' ' ' ILE . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CE2' HG11 ' A' ' 42' ' ' VAL . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.421 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 81.0 Cg_endo . . . . . 0 N--CA 1.453 -0.862 0 N-CA-C 110.806 -0.498 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? . . . . . 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.406 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.434 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 113.145 0.402 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.462 HD13 HD13 ' A' ' 66' ' ' LEU . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HD2' ' CD1' ' A' ' 20' ' ' LEU . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.683 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.526 ' H ' HD22 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.554 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.554 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.683 ' HG2' HD23 ' A' ' 24' ' ' LEU . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.519 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 16' ' ' ILE . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 47' ' ' PHE . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.497 ' CE2' HG11 ' A' ' 42' ' ' VAL . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 . . . . . 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.429 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 88.8 Cg_endo . . . . . 0 N--CA 1.457 -0.666 0 N-CA-C 110.455 -0.633 . . . . 0.0 110.455 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.429 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.407 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.448 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.858 0.361 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.448 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.463 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.46 -0.492 0 CA-C-O 119.813 -0.161 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 20' ' ' LEU . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.689 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.689 ' N ' HD22 ' A' ' 20' ' ' LEU . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.632 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.565 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.565 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.632 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.501 ' CG2' HD23 ' A' ' 20' ' ' LEU . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 20' ' ' LEU . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.479 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.48 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.419 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 111.913 -0.072 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.507 ' CG ' HG13 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 205' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 210' ' ' LEU . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 210' ' ' LEU . . . . . 0.438 HD12 ' HA3' ' A' ' 205' ' ' GLY . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.3 m120 . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 114.338 0.861 . . . . 0.0 114.338 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 16' ' ' ILE . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 HD13 ' A' ' 66' ' ' LEU . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.677 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.677 ' N ' HD22 ' A' ' 20' ' ' LEU . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.537 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.537 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.64 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.415 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.64 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.468 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.467 HG23 HD23 ' A' ' 20' ' ' LEU . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.434 ' HB2' HD11 ' A' ' 35' ' ' LEU . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.424 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 16' ' ' ILE . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 66' ' ' LEU . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.466 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 72.8 Cg_endo . . . . . 0 N--CA 1.454 -0.81 0 N-CA-C 111.061 -0.4 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.466 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.816 0.341 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.453 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.0 m120 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo . . . . . 0 N--CA 1.451 -0.987 0 N-CA-C 112.329 0.088 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CD1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.546 HD13 ' HG2' ' A' ' 38' ' ' MET . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.56 ' C ' HG23 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.512 ' CB ' HG22 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.56 HG23 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.546 ' HG2' HD13 ' A' ' 24' ' ' LEU . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.508 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.425 ' HB3' HG12 ' A' ' 37' ' ' VAL . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.419 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 N-CA-C 111.454 -0.248 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.449 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 121.262 0.554 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 205' ' ' GLY . . . . . 0.406 ' CA ' HD12 ' A' ' 210' ' ' LEU . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 210' ' ' LEU . . . . . 0.406 HD12 ' CA ' ' A' ' 205' ' ' GLY . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.449 ' CD2' HD13 ' A' ' 170' ' ' LEU . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 111.509 -0.227 . . . . 0.0 111.509 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.672 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.728 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.599 ' H ' HD22 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 31' ' ' VAL . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.404 ' HD2' HD21 ' A' ' 24' ' ' LEU . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.728 ' HG2' HD23 ' A' ' 24' ' ' LEU . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.6 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.3 t60 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.6 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 166' ' ' ILE . 73.9 Cg_endo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.287 -0.313 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 163' ' ' PRO . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.415 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CD1' HG13 ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' PHE . . . . . 0.58 ' C ' HD22 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.58 HD22 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.313 0.101 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.413 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo . . . . . 0 N--CA 1.459 -0.516 0 N-CA-C 114.17 0.796 . . . . 0.0 114.17 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.493 HD12 HD11 ' A' ' 16' ' ' ILE . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 13' ' ' LEU . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.456 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.621 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.646 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.535 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.535 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.646 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.558 HG23 HD23 ' A' ' 20' ' ' LEU . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 55' ' ' LYS . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 53' ' ' THR . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.414 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 61.7 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.414 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.482 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.482 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.431 HG13 HG21 ' A' ' 223' ' ' VAL . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.428 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.431 HG21 HG13 ' A' ' 196' ' ' VAL . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.1 m120 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.5 ' O ' HD22 ' A' ' 10' ' ' LEU . 56.0 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' MET . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 6' ' ' PRO . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 16' ' ' ILE . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.502 HD11 ' HD2' ' A' ' 17' ' ' LYS . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 12' ' ' GLN . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HD2' HD11 ' A' ' 13' ' ' LEU . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.705 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.617 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.617 ' H ' HD22 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.597 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.523 HG23 HD23 ' A' ' 20' ' ' LEU . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.449 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' HD21 ' A' ' 35' ' ' LEU . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.425 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.464 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.449 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.452 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo . . . . . 0 N--CA 1.444 -1.427 0 N-CA-C 110.597 -0.578 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.452 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.47 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 121.217 0.532 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.47 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.4 m120 . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 111.706 -0.152 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.694 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.609 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.574 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.574 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.609 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG23 HD23 ' A' ' 20' ' ' LEU . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 163' ' ' PRO . . . . . 0.407 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 56.3 Cg_endo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.542 -0.215 . . . . 0.0 111.542 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.488 ' OE1' ' HE2' ' A' ' 188' ' ' LYS . 11.0 pt-20 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 188' ' ' LYS . . . . . 0.488 ' HE2' ' OE1' ' A' ' 181' ' ' GLU . 31.8 tptt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.278 0.085 . . . . 0.0 110.884 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 201' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 219' ' ' ALA . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 205' ' ' GLY . . . . . 0.418 ' HA3' ' HB2' ' A' ' 210' ' ' LEU . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 210' ' ' LEU . . . . . 0.418 ' HB2' ' HA3' ' A' ' 205' ' ' GLY . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.407 ' HA ' ' CE2' ' A' ' 201' ' ' PHE . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 108.986 -1.198 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HD2' HD12 ' A' ' 20' ' ' LEU . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.6 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.586 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.586 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.628 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.473 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.628 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG2' HD23 ' A' ' 24' ' ' LEU . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.447 ' CG2' HD23 ' A' ' 20' ' ' LEU . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.433 HG21 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.433 ' CE2' HG21 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.767 -0.513 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.424 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.411 ' HB2' ' HE2' ' A' ' 188' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 188' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 181' ' ' GLU . 63.6 tttt . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 193' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 167' ' ' LEU . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.504 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.7 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.7 ' N ' HD22 ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.573 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.573 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.601 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.457 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.601 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.494 ' HG2' HD23 ' A' ' 24' ' ' LEU . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.523 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.559 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 53' ' ' THR . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 52' ' ' PRO 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.559 ' CE2' HG11 ' A' ' 42' ' ' VAL . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo . . . . . 0 N--CA 1.447 -1.245 0 N-CA-C 111.851 -0.096 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 176' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.413 0.625 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 194' ' ' VAL . . . . . 0.514 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 198' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.4 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.6 m120 . . . . . 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo . . . . . 0 CA--C 1.528 0.224 0 N-CA-C 112.778 0.261 . . . . 0.0 112.778 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.76 178.08 48.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.42 -179.0 4.03 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.467 3.445 . . . . 0.0 110.829 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.9 m -139.97 173.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 C-N-CA 124.092 0.957 . . . . 0.0 109.327 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 5' ' ' LEU . 2.0 pt? -146.93 151.79 42.54 Favored Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 122.974 0.51 . . . . 0.0 110.382 -176.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -76.98 -10.71 18.08 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.452 3.435 . . . . 0.0 112.019 -178.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.599 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.69 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.69 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.587 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.558 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.587 ' HG2' HD23 ' A' ' 24' ' ' LEU . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.475 HG11 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' O ' HG22 ' A' ' 53' ' ' THR . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 52' ' ' PRO 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.601 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.659 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -145.92 59.1 5.31 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.659 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 98.3 Cg_endo -70.85 -9.13 25.12 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.621 3.547 . . . . 0.0 110.774 176.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -160.27 164.47 32.63 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.051 1.74 . . . . 0.0 107.269 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.64 155.81 35.36 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 118.188 0.449 . . . . 0.0 111.712 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.6 p -158.13 3.73 0.11 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.716 0.807 . . . . 0.0 111.126 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -154.88 157.16 37.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.849 0.459 . . . . 0.0 110.053 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.13 165.62 35.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.456 0.703 . . . . 0.0 109.857 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -157.03 -173.6 4.53 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.99 0.516 . . . . 0.0 111.649 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -142.06 16.21 2.09 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.419 0.688 . . . . 0.0 110.12 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.15 15.15 0.6 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.015 0.926 . . . . 0.0 112.699 -178.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.4 ptm -141.56 171.59 13.85 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.509 0.671 . . . . 0.0 110.839 -177.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.35 -168.31 35.0 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -144.04 163.81 32.44 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 t -146.42 -170.06 3.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.342 0.657 . . . . 0.0 109.685 -176.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.605 ' H ' HD13 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -131.98 174.49 10.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.508 0.723 . . . . 0.0 111.506 -177.614 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -149.72 176.4 10.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.051 0.453 . . . . 0.0 111.169 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.402 ' C ' ' H ' ' A' ' 90' ' ' THR . 8.8 p -145.77 0.22 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.751 0.82 . . . . 0.0 110.145 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.68 22.33 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.915 0.886 . . . . 0.0 112.239 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.402 ' H ' ' C ' ' A' ' 88' ' ' VAL . 60.2 p -131.11 9.16 4.81 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 123.313 0.645 . . . . 0.0 110.806 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.6 -2.44 6.73 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.101 0.56 . . . . 0.0 111.659 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -148.28 170.63 17.5 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.36 0.664 . . . . 0.0 109.731 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -150.19 173.34 14.04 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.818 0.447 . . . . 0.0 110.254 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.3 m -139.84 17.38 2.49 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.697 -176.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -146.19 163.74 34.45 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 122.763 0.425 . . . . 0.0 109.977 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -157.38 179.12 9.56 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.075 0.95 . . . . 0.0 110.763 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.09 18.77 1.76 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.71 0.404 . . . . 0.0 111.272 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.15 170.75 18.19 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.007 0.523 . . . . 0.0 109.835 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -145.05 155.95 55.0 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.79 0.836 . . . . 0.0 110.592 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.87 169.96 19.06 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.241 3.294 . . . . 0.0 111.166 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -153.48 11.23 0.44 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.261 0.625 . . . . 0.0 112.359 -177.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.6 p -62.06 161.11 11.35 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -64.98 165.42 10.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.777 0.431 . . . . 0.0 112.073 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -148.83 2.35 0.6 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.774 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -155.57 168.29 27.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.46 0.573 . . . . 0.0 110.102 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 178.36 162.48 28.15 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -150.85 175.39 12.06 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.054 0.427 . . . . 0.0 111.345 -173.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -148.28 141.27 24.85 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.828 0.851 . . . . 0.0 109.192 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.1 m -59.64 127.78 85.44 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.48 -7.64 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.345 2.696 . . . . 0.0 113.386 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -156.06 177.13 11.78 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.694 0.679 . . . . 0.0 110.515 -177.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.66 -17.82 17.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.479 1.112 . . . . 0.0 112.24 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.8 p -152.99 175.48 12.92 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.288 0.635 . . . . 0.0 110.06 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -58.14 145.14 74.57 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 122.177 -0.327 . . . . 0.0 110.542 178.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.66 166.2 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.995 3.13 . . . . 0.0 110.87 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.8 162.56 3.6 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.274 3.316 . . . . 0.0 112.855 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.51 16.42 2.01 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.844 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -138.88 16.41 2.67 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.906 0.482 . . . . 0.0 111.475 -176.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -144.08 177.01 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 C-N-CA 122.895 0.478 . . . . 0.0 110.065 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -158.25 26.85 0.43 Allowed Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.2 m -139.93 28.83 2.11 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.567 0.747 . . . . 0.0 110.514 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -129.95 13.2 5.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.921 0.488 . . . . 0.0 111.359 -175.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -178.96 178.21 48.72 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -154.48 12.06 0.4 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.015 0.526 . . . . 0.0 111.288 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -142.73 29.28 1.55 Allowed 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.05 0.54 . . . . 0.0 111.348 -174.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.3 m -135.34 15.11 3.47 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.969 -0.457 . . . . 0.0 111.847 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -147.28 20.69 1.21 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 123.425 0.69 . . . . 0.0 111.136 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.5 m -136.34 16.82 3.18 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.38 0.672 . . . . 0.0 111.278 -177.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 29.5 t -153.47 171.56 18.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.117 0.567 . . . . 0.0 110.435 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 79.7 p -149.09 5.08 0.64 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.967 0.507 . . . . 0.0 111.476 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.4 166.94 33.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -157.72 6.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.22 147.52 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 121.867 -0.521 . . . . 0.0 110.417 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.0 m -151.26 8.07 0.53 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.387 0.675 . . . . 0.0 111.528 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.6 mt -137.0 17.2 3.02 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.83 0.452 . . . . 0.0 111.432 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.0 t -147.88 172.31 14.36 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.87 0.468 . . . . 0.0 110.907 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.9 17.81 2.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.351 1.06 . . . . 0.0 110.208 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.516 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 50.6 m -68.26 -26.27 1.22 Allowed Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 117.25 -1.357 . . . . 0.0 114.48 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.516 ' CD ' ' N ' ' A' ' 138' ' ' SER . 91.2 Cg_exo -48.3 166.35 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.288 2.659 . . . . 0.0 115.116 175.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 25.5 m -137.53 52.89 5.79 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.568 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -68.05 -179.86 2.41 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.57 2.847 . . . . 0.0 110.847 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.6 -178.98 5.77 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.121 0.568 . . . . 0.0 110.46 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.7 t -140.3 13.1 2.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.667 0.387 . . . . 0.0 111.932 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 144' ' ' LEU . 3.0 mm? 50.96 26.91 2.91 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.495 1.118 . . . . 0.0 112.614 178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 24.4 m -134.26 -7.21 2.62 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.591 0.756 . . . . 0.0 110.017 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -157.33 144.94 13.84 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 125.053 1.341 . . . . 0.0 108.028 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.9 150.13 4.87 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.649 2.899 . . . . 0.0 111.922 176.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.87 0.47 8.79 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.287 3.325 . . . . 0.0 112.624 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.48 147.03 97.82 Favored Pre-proline 0 N--CA 1.451 -0.411 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -58.59 2.97 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.623 3.549 . . . . 0.0 114.464 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 6.6 tt -145.23 145.25 26.02 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 123.387 0.675 . . . . 0.0 110.041 -174.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -54.47 167.44 1.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.373 2.715 . . . . 0.0 111.496 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -67.54 160.84 46.13 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.1 1.866 . . . . 0.0 110.405 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.94 156.59 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.378 3.385 . . . . 0.0 113.735 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -145.66 153.0 50.33 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.298 1.039 . . . . 0.0 109.451 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.18 138.82 28.46 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 123.039 2.493 . . . . 0.0 110.475 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.18 165.78 25.42 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.39 2.727 . . . . 0.0 110.524 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.22 172.45 12.1 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.359 2.706 . . . . 0.0 110.559 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 78.8 p -143.8 10.99 1.6 Allowed 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 179.79 -28.77 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.35 174.85 10.33 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 123.496 0.718 . . . . 0.0 109.811 175.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -145.0 102.04 4.48 Favored Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -82.85 -11.5 10.13 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 124.665 3.577 . . . . 0.0 112.021 -170.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.423 ' H ' HG13 ' A' ' 166' ' ' ILE . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.456 HD22 HD21 ' A' ' 174' ' ' LEU . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' LEU . . . . . 0.456 HD21 HD22 ' A' ' 167' ' ' LEU . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 175' ' ' LYS . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.491 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -112.22 -175.18 2.62 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 31.2 m -140.25 23.81 2.34 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -174.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -164.63 177.89 40.04 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 118.967 0.803 . . . . 0.0 111.861 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -79.77 -62.67 1.62 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 117.881 0.84 . . . . 0.0 110.247 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.1 m -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.988 0.915 . . . . 0.0 110.447 178.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -131.27 165.18 23.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.928 0.491 . . . . 0.0 109.862 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . 44.61 26.21 0.17 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -175.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.92 154.66 29.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.042 0.537 . . . . 0.0 111.472 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.491 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.417 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 54.43 28.38 9.48 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 83.7 mt -131.85 -166.22 1.69 Allowed 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.212 1.005 . . . . 0.0 110.209 -174.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -140.34 -170.18 2.93 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.884 -0.51 . . . . 0.0 110.477 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 19.4 tp -144.1 -0.63 1.0 Allowed 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.985 -0.447 . . . . 0.0 111.884 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.57 25.14 3.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.936 0.334 . . . . 0.0 111.126 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.57 7.49 9.5 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.934 0.494 . . . . 0.0 111.587 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -155.51 163.28 40.21 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.752 0.821 . . . . 0.0 109.921 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -157.93 8.52 0.15 Allowed 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -145.23 20.0 1.57 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.239 0.472 . . . . 0.0 111.59 -176.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -57.98 -16.61 13.02 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.95 0.5 . . . . 0.0 112.178 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -156.61 160.07 39.07 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.365 1.066 . . . . 0.0 108.818 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 81.4 t60 . . . . . 0 C--O 1.253 1.266 0 CA-C-O 117.752 -1.118 . . . . 0.0 110.358 -178.993 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 98.863 -3.837 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 O4'-C1'-N19 111.925 3.725 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C4'-C3'-C2' 99.475 -3.225 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 1 C4'-C3'-C2' 98.636 -4.064 . 0.793 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 O4'-C1'-N19 112.006 3.806 . 0.682 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 C4'-C3'-C2' 99.168 -3.532 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.365 0 C4'-C3'-C2' 98.99 -3.71 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.3 0 C4'-C3'-C2' 99.325 -3.375 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.237 0 C4'-C3'-C2' 99.367 -3.333 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.374 3.174 . 0.678 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 99.467 -3.233 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.123 -3.577 . 0.709 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.722 -2.978 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C4'-C3'-C2' 99.906 -2.794 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.417 -3.283 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 O4'-C1'-N19 111.36 3.16 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C4'-C3'-C2' 99.152 -3.548 . 0.783 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.289 -3.411 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 1 C4'-C3'-C2' 98.67 -4.03 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.265 0 C4'-C3'-C2' 99.316 -3.384 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.514 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C4'-C3'-C2' 99.472 -3.228 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.514 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.046 0 C4'-C3'-C2' 99.19 -3.51 . 0.75 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.08 -3.62 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C4'-C3'-C2' 99.464 -3.236 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.176 0 O4'-C1'-N19 111.099 2.899 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.178 -3.522 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 99.53 -3.17 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.096 -3.604 . 0.879 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.937 0 C4'-C3'-C2' 99.234 -3.466 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 99.243 -3.457 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.281 0 C4'-C3'-C2' 99.573 -3.127 . 0.693 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.81 0 C4'-C3'-C2' 99.268 -3.432 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.21 -3.49 . 0.754 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C5'-C4'-C3' 111.987 -2.342 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.568 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.457 1 C5'-C4'-C3' 108.667 -4.555 OUTLIER-DELTA 0.014 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.568 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.629 3 P-O3'-C3' 124.996 4.413 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.455 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.258 1 C4'-C3'-C2' 97.696 -5.004 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.455 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.124 2.924 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.4 0 C4'-C3'-C2' 99.637 -3.063 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 1 C4'-C3'-C2' 98.48 -4.22 . 0.759 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.601 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 O4'-C1'-N19 112.224 4.024 . 0.59 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 99.058 -3.642 . 0.891 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 1 C4'-C3'-C2' 98.613 -4.087 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 99.3 -3.4 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.026 0 C4'-C3'-C2' 99.012 -3.688 . 0.91 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.744 -3.956 . 0.847 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 C4'-C3'-C2' 99.677 -3.023 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.473 0 C4'-C3'-C2' 99.02 -3.68 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C5'-C4'-C3' 111.807 -2.462 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.28 1 O4'-C1'-N19 112.702 4.502 . 0.82 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.474 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.674 0 O4'-C1'-N19 111.803 3.603 . 0.496 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.474 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 C4'-C3'-C2' 99.581 -3.119 . 0.731 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.667 0 O4'-C1'-N19 111.218 3.018 . 0.895 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C4'-C3'-C2' 99.289 -3.411 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.387 1 O4'-C1'-N19 112.27 4.07 . 0.414 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.417 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.388 3.188 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.414 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.446 -3.254 . 0.628 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 O4'-C1'-N19 111.618 3.418 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.252 0 O4'-C1'-N19 111.167 2.967 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.319 0 C4'-C3'-C2' 99.322 -3.378 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 C4'-C3'-C2' 98.733 -3.967 . 0.601 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.291 -3.409 . 0.63 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C4'-C3'-C2' 99.908 -2.792 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.626 0 O4'-C1'-N19 111.511 3.311 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.352 0 C4'-C3'-C2' 99.371 -3.329 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C4'-C3'-C2' 99.45 -3.25 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.243 1 C4'-C3'-C2' 98.467 -4.233 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.202 0 O4'-C1'-N19 112.163 3.963 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.182 0 C4'-C3'-C2' 99.633 -3.067 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.442 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.26 1 C4'-C3'-C2' 98.084 -4.616 . 0.729 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.442 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.947 0 O4'-C1'-N19 111.879 3.679 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo . . . . . 0 CA--C 1.529 0.242 0 N-CA-C 112.356 0.098 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.01 -176.92 47.72 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.05 0.93 0.09 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.525 1 C-N-CA 125.6 4.2 . . . . 0.0 114.834 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.83 -12.23 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 118.489 0.586 . . . . 0.0 111.089 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.9 tp -159.02 63.02 2.26 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 123.916 0.886 . . . . 0.0 109.156 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.87 -26.05 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.408 2.072 . . . . 0.0 112.242 -171.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.64 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.547 ' CB ' HG22 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.547 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.601 ' HG2' HD23 ' A' ' 24' ' ' LEU . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.643 HG11 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.488 ' HB2' HD21 ' A' ' 35' ' ' LEU . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.653 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.46 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 25.1 m-85 -149.98 46.84 0.43 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.653 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 97.6 Cg_endo -71.09 -20.37 28.77 Favored 'Trans proline' 0 N--CA 1.448 -1.147 0 C-N-CA 124.438 3.425 . . . . 0.0 112.093 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -163.75 -33.01 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 CA-C-N 117.811 0.278 . . . . 0.0 110.808 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.57 -172.38 4.12 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.202 0.601 . . . . 0.0 110.152 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.4 t -139.71 170.56 15.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.246 0.618 . . . . 0.0 109.576 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -143.68 20.79 1.83 Allowed 'General case' 0 C--N 1.339 0.127 0 C-N-CA 123.37 0.668 . . . . 0.0 111.3 -175.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.04 168.26 19.69 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-O 120.912 0.387 . . . . 0.0 111.655 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -147.22 172.61 13.57 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 123.839 0.856 . . . . 0.0 110.412 -176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 80' ' ' LEU . 7.7 mp -67.48 -11.58 58.25 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.522 0.329 . . . . 0.0 111.489 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -82.35 -7.4 59.63 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.08 -179.97 4.66 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.049 0.54 . . . . 0.0 111.301 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.17 -174.75 29.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -139.86 171.9 13.54 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.525 0.73 . . . . 0.0 110.262 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.8 t -149.21 18.76 0.96 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.767 0.427 . . . . 0.0 110.933 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 96.4 mt -134.6 169.27 17.56 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.446 0.699 . . . . 0.0 110.262 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.7 t -156.72 175.77 13.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.356 0.662 . . . . 0.0 110.618 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -143.85 7.17 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 C-N-CA 123.917 0.887 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -144.7 24.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.935 0.494 . . . . 0.0 111.867 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.2 p -134.94 25.22 3.62 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.196 0.998 . . . . 0.0 109.762 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.03 174.49 10.47 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.294 0.568 . . . . 0.0 110.516 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.16 174.17 14.57 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.529 0.681 . . . . 0.0 110.075 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.7 p -144.08 175.96 9.66 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.879 0.872 . . . . 0.0 110.016 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 83.2 p -152.34 169.62 22.09 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.627 0.771 . . . . 0.0 110.468 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -151.67 171.2 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.011 0.524 . . . . 0.0 110.622 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -142.71 11.2 1.84 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.389 0.675 . . . . 0.0 111.637 -177.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -75.21 6.53 4.25 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.559 0.344 . . . . 0.0 111.871 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -151.24 177.78 9.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.454 0.702 . . . . 0.0 109.841 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.459 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 62.8 t80 -144.55 146.93 34.26 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 99' ' ' PHE . 52.0 Cg_exo -56.03 6.81 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 125.415 4.077 . . . . 0.0 116.265 178.626 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -138.29 15.27 2.8 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.078 0.853 . . . . 0.0 110.377 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.6 p -134.21 4.72 3.48 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.858 0.463 . . . . 0.0 111.294 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.17 -14.13 62.81 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.899 0.48 . . . . 0.0 111.632 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -68.94 -179.22 1.41 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.301 0.572 . . . . 0.0 112.08 178.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.0 p-10 -139.49 11.16 2.52 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.136 0.575 . . . . 0.0 111.587 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.77 169.81 42.34 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -154.44 -8.55 0.14 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.58 178.35 10.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.726 0.41 . . . . 0.0 111.182 -178.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 28.8 p -142.76 159.2 57.83 Favored Pre-proline 0 C--O 1.232 0.173 0 C-N-CA 123.886 0.875 . . . . 0.0 108.858 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 158.46 56.9 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.367 2.711 . . . . 0.0 111.372 -178.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.38 172.27 6.22 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.396 0.679 . . . . 0.0 111.032 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -129.24 20.04 5.81 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.277 0.631 . . . . 0.0 111.225 -178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.0 t -142.21 12.08 1.97 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.542 0.737 . . . . 0.0 109.475 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.459 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 39.3 tt0 -65.56 -36.2 13.97 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 71.1 Cg_exo -48.91 149.17 8.19 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.984 2.456 . . . . 0.0 112.595 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.61 164.06 36.7 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.324 2.683 . . . . 0.0 110.838 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -153.52 166.86 31.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.154 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -69.23 167.9 15.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.848 0.459 . . . . 0.0 111.015 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.8 m -144.64 168.81 9.41 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 C-N-CA 123.954 0.901 . . . . 0.0 110.195 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.11 177.35 46.38 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 67.9 p -153.28 19.38 0.56 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.182 0.593 . . . . 0.0 111.242 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -140.37 11.16 2.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.771 0.429 . . . . 0.0 110.969 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.23 18.4 0.07 OUTLIER Glycine 0 CA--C 1.522 0.507 0 N-CA-C 112.236 -0.345 . . . . 0.0 112.236 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -137.91 6.65 2.67 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.668 0.734 . . . . 0.0 111.518 -174.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -151.19 -5.65 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.263 0.625 . . . . 0.0 112.041 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.5 p -159.27 161.17 35.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.708 0.403 . . . . 0.0 111.027 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.4 t80 44.11 27.11 0.18 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.69 1.196 . . . . 0.0 113.193 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 75.7 p -104.52 8.7 35.57 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.769 0.827 . . . . 0.0 111.372 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 43.6 m -144.72 17.46 1.64 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.245 0.618 . . . . 0.0 110.536 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.6 t -146.65 26.12 1.16 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.676 0.391 . . . . 0.0 111.261 -175.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -153.29 174.65 31.94 Favored Glycine 0 CA--C 1.527 0.785 0 O-C-N 122.092 -0.38 . . . . 0.0 112.157 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.46 -6.46 43.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.998 0.919 . . . . 0.0 112.327 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.83 -13.21 11.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 123.059 0.544 . . . . 0.0 112.429 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 50.9 m -70.42 -13.89 62.32 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.668 0.387 . . . . 0.0 111.609 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.4 pp 44.4 18.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.785 1.634 . . . . 0.0 114.519 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 96.4 p -140.02 5.86 2.15 Favored 'General case' 0 CA--C 1.528 0.097 0 O-C-N 121.949 -0.47 . . . . 0.0 111.984 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -149.66 167.24 26.97 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.7 m -146.75 156.98 48.12 Favored Pre-proline 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.41 173.04 11.24 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 123.311 2.674 . . . . 0.0 110.271 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 6.3 t 41.69 60.73 8.59 Favored Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 124.593 1.157 . . . . 0.0 111.993 -177.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -74.3 7.72 2.46 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.368 3.379 . . . . 0.0 111.66 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.42 14.75 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.504 1.122 . . . . 0.0 113.194 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 74.4 p -128.38 1.61 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.572 0.749 . . . . 0.0 111.053 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 144' ' ' LEU . 7.2 mp 50.56 28.93 3.71 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 124.829 1.252 . . . . 0.0 113.101 177.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.3 t -145.1 178.88 7.74 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 122.559 0.343 . . . . 0.0 111.246 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -147.41 157.77 44.71 Favored Pre-proline 0 C--O 1.234 0.239 0 C-N-CA 123.698 0.799 . . . . 0.0 110.357 -176.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.32 162.6 41.77 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.525 2.15 . . . . 0.0 110.574 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.61 166.63 28.83 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 123.37 2.714 . . . . 0.0 110.976 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -152.9 163.02 24.84 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 122.934 0.494 . . . . 0.0 109.96 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -54.17 163.5 3.31 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 123.856 3.038 . . . . 0.0 112.923 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 31.7 pt -61.42 156.58 51.31 Favored Pre-proline 0 CA--C 1.53 0.204 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.47 163.29 3.78 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.791 2.994 . . . . 0.0 112.377 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.24 162.6 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.287 3.325 . . . . 0.0 111.429 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.34 144.8 69.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.741 2.294 . . . . 0.0 110.466 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -69.0 153.28 96.28 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.738 -177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -72.91 161.52 43.44 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.67 2.913 . . . . 0.0 110.878 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.45 164.93 34.07 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.297 2.665 . . . . 0.0 111.233 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.61 176.88 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.619 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 15.9 t -148.95 176.16 10.66 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 123.081 0.552 . . . . 0.0 110.54 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -164.91 18.75 0.11 Allowed Glycine 0 CA--C 1.527 0.838 0 CA-C-O 119.299 -0.723 . . . . 0.0 112.035 -177.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -142.68 169.5 17.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.846 0.823 . . . . 0.0 109.826 -177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -149.83 162.57 27.79 Favored Pre-proline 0 C--O 1.237 0.408 0 C-N-CA 122.432 0.293 . . . . 0.0 110.578 -176.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.411 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 91.1 Cg_endo -76.88 -11.12 18.22 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.715 2.943 . . . . 0.0 110.678 174.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.411 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' PHE . . . . . 0.523 ' CE1' ' HE2' ' A' ' 208' ' ' LYS . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -127.28 166.37 17.91 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.8 m -152.82 31.55 0.5 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.28 168.97 25.99 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.277 -0.963 . . . . 0.0 114.17 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.86 157.67 34.71 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.723 0.809 . . . . 0.0 110.859 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 28.5 m -58.64 -9.66 1.83 Allowed 'General case' 0 C--N 1.339 0.118 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -172.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -113.18 2.42 15.61 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.891 0.768 . . . . 0.0 111.456 -176.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -150.56 19.83 0.82 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt -60.48 158.19 12.63 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.498 1.119 . . . . 0.0 112.704 -173.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.483 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.411 HG21 ' HB1' ' A' ' 219' ' ' ALA . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.523 ' HE2' ' CE1' ' A' ' 178' ' ' PHE . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.411 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.438 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.2 m120 59.9 33.74 21.58 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.0 mt -136.87 -166.66 1.94 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.473 1.109 . . . . 0.0 109.393 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.494 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 29.2 t-80 -150.47 -167.23 2.76 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.524 0.73 . . . . 0.0 109.078 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.494 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 8.6 tp -137.33 11.9 3.02 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.232 0.469 . . . . 0.0 111.466 -176.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 45.7 tp -59.95 154.96 17.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.935 -0.478 . . . . 0.0 110.47 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -146.35 18.28 1.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.79 0.436 . . . . 0.0 110.202 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 231' ' ' HIS . . . . . 0.415 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 68.2 m80 -138.56 174.53 10.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.858 0.463 . . . . 0.0 110.835 -177.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.0 3.07 2.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.266 0.626 . . . . 0.0 111.06 -178.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 41.31 40.47 1.22 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.76 1.224 . . . . 0.0 113.424 178.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.04 173.55 0.61 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.735 0.779 . . . . 0.0 112.063 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -141.15 7.69 2.02 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.533 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 116.952 -1.499 . . . . 0.0 109.927 -178.139 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C4'-C3'-C2' 98.718 -3.982 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.058 -3.642 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.243 -3.457 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.255 -3.445 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 1 O4'-C1'-N19 112.514 4.314 . 0.717 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.266 0 C4'-C3'-C2' 98.788 -3.912 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.043 0 O4'-C1'-N19 111.959 3.759 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.871 0 C4'-C3'-C2' 99.337 -3.363 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.988 -2.712 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 O4'-C1'-N19 111.778 3.578 . 0.552 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.913 -3.787 . 0.854 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C4'-C3'-C2' 98.906 -3.794 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.87 0 C4'-C3'-C2' 99.474 -3.226 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.974 0 C4'-C3'-C2' 99.674 -3.026 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 98.881 -3.819 . 0.766 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 98.716 -3.984 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.528 -3.172 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 O4'-C1'-N19 111.241 3.041 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.068 0 C4'-C3'-C2' 98.964 -3.736 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.05 -3.65 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.465 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.344 -3.356 . 0.823 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.465 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.395 -3.305 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.16 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.043 -3.657 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.05 0 O4'-C1'-N19 110.907 2.707 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.146 -3.554 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C4'-C3'-C2' 98.876 -3.824 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 98.787 -3.913 . 0.925 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.18 -3.52 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.948 0 O4'-C1'-N19 111.51 3.31 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 C4'-C3'-C2' 98.866 -3.834 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 1 C4'-C3'-C2' 98.283 -4.417 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.625 -3.075 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C5'-C4'-C3' 111.981 -2.346 . 0.703 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.519 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.621 2.833 1 C5'-C4'-C3' 108.67 -4.553 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.519 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.645 2 C5'-C4'-C3' 108.606 -4.596 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.405 -3.963 0 C4'-C3'-C2' 99.596 -3.104 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.278 0 O4'-C1'-N19 110.818 2.618 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.242 0 C4'-C3'-C2' 98.717 -3.983 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.263 1 C4'-C3'-C2' 98.568 -4.132 . 0.801 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.597 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 112.002 3.802 . 0.604 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 C4'-C3'-C2' 98.911 -3.789 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 1 C4'-C3'-C2' 98.686 -4.014 . 0.779 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 99.735 -2.965 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.053 -3.647 . 0.937 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 C4'-C3'-C2' 98.939 -3.761 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.437 -3.263 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.093 -3.607 . 0.883 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 100.136 -2.564 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.011 1 O4'-C1'-N19 113.185 4.985 . 0.564 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C5'-C4'-O4' 113.21 2.865 . 0.484 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 C4'-C3'-C2' 99.963 -2.737 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.053 0 C4'-C3'-C2' 99.634 -3.066 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 98.916 -3.784 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.806 3.606 . 0.507 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.14 2.94 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 C4'-C3'-C2' 99.611 -3.089 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 98.978 -3.722 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.638 3.438 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.119 0 C4'-C3'-C2' 99.009 -3.691 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.333 -3.367 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 C4'-C3'-C2' 99.291 -3.409 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.776 -2.924 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.423 -3.277 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 98.856 -3.844 . 0.661 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 O4'-C1'-N19 111.677 3.477 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . 0.409 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 C4'-C3'-C2' 98.611 -4.089 . 0.805 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . 0.409 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 1 O4'-C1'-N19 112.508 4.308 . 0.818 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C4'-C3'-C2' 98.844 -3.856 . 0.866 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.439 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.822 1 C4'-C3'-C2' 97.5 -5.2 . 0.784 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.439 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 O4'-C1'-N19 111.644 3.444 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo . . . . . 0 N--CA 1.482 0.838 0 N-CA-C 112.897 0.307 . . . . 0.0 112.897 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.8 -179.85 48.72 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.57 171.41 0.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.295 3.33 . . . . 0.0 113.06 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.0 m -136.24 167.82 23.65 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 C-N-CA 123.919 0.888 . . . . 0.0 109.224 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.7 tt 45.46 59.95 14.06 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 111.186 -174.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.27 -29.6 23.63 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.884 3.056 . . . . 0.0 114.225 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.432 HD13 HD13 ' A' ' 66' ' ' LEU . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.572 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.681 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CD1' HD21 ' A' ' 20' ' ' LEU . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.608 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.608 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.587 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.424 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.468 HG21 " H1'" ' B' ' 287' ' ' ' U' . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.5 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.587 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.408 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 20' ' ' LEU . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.431 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.431 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 16' ' ' ILE . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.664 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -148.43 55.23 2.04 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.664 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 85.6 Cg_endo -71.89 -23.41 22.2 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.881 3.054 . . . . 0.0 113.355 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -159.2 17.25 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.215 -0.303 . . . . 0.0 111.648 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.07 177.83 8.67 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.812 -0.555 . . . . 0.0 111.158 -175.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 71.2 p -153.66 19.55 0.53 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.832 0.853 . . . . 0.0 111.14 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -144.71 162.04 37.7 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -176.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.58 -174.12 4.52 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.267 0.627 . . . . 0.0 110.369 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -142.45 -178.04 5.56 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.283 0.633 . . . . 0.0 111.37 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.4 tp -140.31 145.4 37.17 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.685 0.794 . . . . 0.0 109.895 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -160.9 -172.04 3.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.331 0.652 . . . . 0.0 110.249 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -141.41 165.82 26.45 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.073 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 170.86 -171.49 43.84 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.4 ptt-85 -147.65 159.58 43.63 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 122.308 0.243 . . . . 0.0 110.749 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 87' ' ' SER . 10.7 t -158.0 177.6 11.15 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.085 0.554 . . . . 0.0 110.081 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.02 8.79 0.84 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 124.824 1.25 . . . . 0.0 112.93 -176.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 85' ' ' THR . 88.8 p -59.57 164.95 3.18 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.94 177.04 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.105 0 C-N-CA 124.268 1.027 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -145.92 175.05 10.73 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.043 0.537 . . . . 0.0 109.656 -177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -140.22 12.85 2.4 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -174.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.6 8.97 0.94 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.736 -0.602 . . . . 0.0 111.66 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -145.14 177.94 8.42 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.234 0.614 . . . . 0.0 109.971 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.8 t -144.47 177.33 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.022 0.529 . . . . 0.0 111.578 -175.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 50.0 m -144.53 -170.55 3.41 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.633 0.773 . . . . 0.0 110.019 -175.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -141.44 169.41 17.65 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.987 0.515 . . . . 0.0 109.953 -177.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -143.22 -176.81 5.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.289 0.636 . . . . 0.0 110.158 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.58 170.18 16.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.2 0.6 . . . . 0.0 109.668 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -154.35 173.46 16.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.972 0.509 . . . . 0.0 110.403 -177.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -142.66 154.31 62.73 Favored Pre-proline 0 C--O 1.233 0.187 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.98 170.37 16.99 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.02 2.48 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -144.58 13.95 1.56 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.314 0.646 . . . . 0.0 110.556 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.8 p -139.63 6.6 2.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.279 0.632 . . . . 0.0 110.803 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 20.6 tp -72.54 173.46 8.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.601 . . . . 0.0 110.456 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -128.49 16.99 6.48 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.935 0.894 . . . . 0.0 111.149 -178.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 67.0 t30 48.06 26.5 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.608 1.163 . . . . 0.0 113.142 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.8 174.89 47.38 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -145.66 8.26 1.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.245 0.618 . . . . 0.0 110.922 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.11 -4.16 1.53 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.895 0.878 . . . . 0.0 110.663 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.7 t -166.25 146.52 5.31 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.82 172.53 15.15 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.046 2.497 . . . . 0.0 109.907 173.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -150.73 -31.91 0.18 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -157.76 -4.43 0.09 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 t -157.45 166.12 33.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.863 0.363 . . . . 0.0 110.136 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -151.75 157.71 34.38 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.567 0.747 . . . . 0.0 109.111 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.9 154.78 72.01 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.938 2.425 . . . . 0.0 109.929 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.88 173.61 13.24 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.179 3.252 . . . . 0.0 111.749 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -147.08 -6.95 0.48 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.399 0.68 . . . . 0.0 111.088 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -155.84 147.62 23.1 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.2 p -160.56 164.69 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.171 0.189 . . . . 0.0 110.733 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -177.59 -26.48 0.04 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 9.3 t 57.15 171.69 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.014 1.325 . . . . 0.0 113.203 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 43.86 25.09 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 17.14 0.07 OUTLIER Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.581 -0.7 . . . . 0.0 112.218 -176.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.14 117.32 7.32 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -154.37 -6.43 0.15 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.706 0.402 . . . . 0.0 110.898 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 36.0 t -158.99 160.66 36.22 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.095 0.958 . . . . 0.0 109.353 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -159.73 173.2 16.39 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.783 0.325 . . . . 0.0 111.22 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 61.5 m -140.27 11.3 2.35 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.544 1.138 . . . . 0.0 110.566 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.6 p -155.34 170.01 22.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.065 0.946 . . . . 0.0 109.402 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.1 m -142.61 4.58 1.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.026 0.53 . . . . 0.0 112.12 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 163.67 -8.76 0.08 OUTLIER Glycine 0 CA--C 1.529 0.968 0 CA-C-N 118.303 0.501 . . . . 0.0 113.247 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -153.26 173.15 15.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.516 0.727 . . . . 0.0 110.883 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.66 158.09 12.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.069 0.547 . . . . 0.0 109.584 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 84.3 p -149.05 15.61 0.93 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.0 tp -148.74 157.31 43.35 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.395 0.678 . . . . 0.0 109.516 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.9 m -61.89 164.71 6.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.948 0.404 . . . . 0.0 111.553 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.69 4.15 1.0 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.743 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.4 p -156.46 158.5 31.47 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -72.44 165.15 33.52 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.433 2.755 . . . . 0.0 110.461 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.9 p -152.49 137.91 11.3 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.92 7.7 2.32 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.91 3.073 . . . . 0.0 112.877 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 50.31 25.07 1.7 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.065 0.946 . . . . 0.0 112.089 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.8 m 54.96 16.51 1.51 Allowed 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 124.757 1.223 . . . . 0.0 113.558 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.36 170.53 14.86 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.1 p -138.81 4.4 2.31 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 123.851 0.86 . . . . 0.0 110.614 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -67.5 157.35 86.13 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 123.44 0.696 . . . . 0.0 110.59 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.36 165.69 29.64 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.051 2.501 . . . . 0.0 110.276 175.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.49 164.41 35.71 Favored 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.716 2.944 . . . . 0.0 110.629 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.75 132.18 91.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.07 140.35 34.35 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 122.298 1.998 . . . . 0.0 110.526 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 9.3 tp -162.08 140.95 7.14 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.99 149.65 72.01 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.4 2.067 . . . . 0.0 109.981 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.99 148.79 28.73 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.612 2.875 . . . . 0.0 112.58 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -78.46 169.26 20.22 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.975 3.117 . . . . 0.0 109.918 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -149.24 152.32 35.73 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.24 163.85 36.87 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.486 2.791 . . . . 0.0 110.249 177.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.92 142.1 34.56 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.503 2.802 . . . . 0.0 111.884 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -78.73 1.1 9.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 124.267 3.311 . . . . 0.0 111.98 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.0 p -144.6 24.15 1.56 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.974 0.51 . . . . 0.0 110.375 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -138.33 -160.52 8.48 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 123.724 0.678 . . . . 0.0 111.836 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -135.74 178.87 6.71 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.709 0.404 . . . . 0.0 110.076 -176.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -52.99 146.11 20.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 123.029 0.532 . . . . 0.0 111.662 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.7 Cg_endo -70.51 -17.85 33.9 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 123.883 3.055 . . . . 0.0 111.935 -175.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.421 HG13 ' HE3' ' A' ' 212' ' ' LYS . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' MET . . . . . 0.436 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.61 170.7 12.93 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 46.5 m -153.38 161.72 42.03 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.102 0.961 . . . . 0.0 110.205 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.47 174.81 25.06 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 123.502 0.572 . . . . 0.0 111.813 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -78.17 -97.76 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.824 -0.221 . . . . 0.0 111.138 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 48.3 m -149.81 -1.4 0.43 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.219 0.608 . . . . 0.0 110.984 176.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -124.01 4.8 8.64 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.38 0.272 . . . . 0.0 110.845 -176.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 22.57 1.11 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt -58.57 154.78 13.52 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 124.175 0.99 . . . . 0.0 112.482 -172.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.483 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.445 ' HE3' ' P ' ' B' ' 292' ' ' ' C' . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' LYS . . . . . 0.421 ' HE3' HG13 ' A' ' 164' ' ' VAL . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.3 m120 59.45 34.64 22.69 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -137.31 -165.68 1.8 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.07 0.948 . . . . 0.0 110.254 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -147.47 -177.52 5.75 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 123.485 0.714 . . . . 0.0 109.468 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 9.6 tp -145.21 6.33 1.13 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 118.389 0.54 . . . . 0.0 112.099 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.8 mt -136.23 164.9 27.01 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.704 -0.622 . . . . 0.0 111.291 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -143.45 170.84 15.04 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.12 0.968 . . . . 0.0 110.115 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 65.7 t60 -157.77 171.94 19.39 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.866 0.866 . . . . 0.0 108.912 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -60.14 160.57 8.02 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.394 0.278 . . . . 0.0 110.582 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.13 -176.69 5.66 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.86 0.464 . . . . 0.0 110.112 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -146.35 -177.84 5.83 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.684 0.794 . . . . 0.0 110.523 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -144.76 168.83 19.27 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.821 0.448 . . . . 0.0 110.548 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 116.786 -1.578 . . . . 0.0 110.441 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.364 -3.336 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 O4'-C1'-N19 111.678 3.478 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 O4'-C1'-N19 111.75 3.55 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.035 0 C4'-C3'-C2' 99.567 -3.133 . 0.801 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 O4'-C1'-N19 112.541 4.341 . 0.675 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.242 1 C4'-C3'-C2' 98.635 -4.065 . 0.708 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 98.758 -3.942 . 0.632 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.969 0 C4'-C3'-C2' 99.556 -3.144 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.77 -2.93 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 98.947 -3.753 . 0.54 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 O4'-C1'-N19 110.997 2.797 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 C4'-C3'-C2' 98.855 -3.845 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 1 C4'-C3'-C2' 98.659 -4.041 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.173 0 C4'-C3'-C2' 99.634 -3.066 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.22 0 O4'-C1'-N19 111.11 2.91 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 C4'-C3'-C2' 99.457 -3.243 . 0.637 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.602 1 C4'-C3'-C2' 98.698 -4.002 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.674 1 C4'-C3'-C2' 98.671 -4.029 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 98.953 -3.747 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.253 -3.447 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.504 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.093 0 C4'-C3'-C2' 98.965 -3.735 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.504 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.089 0 C4'-C3'-C2' 99.376 -3.324 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 O4'-C1'-N19 111.664 3.464 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C5'-C4'-C3' 110.846 -3.102 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.764 -2.936 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.168 -3.532 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.212 1 C4'-C3'-C2' 98.64 -4.06 . 0.729 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.481 -3.219 . 0.907 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.073 0 C4'-C3'-C2' 100.116 -2.584 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.448 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 O4'-C1'-N19 111.758 3.558 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.448 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.88 -3.82 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.358 -3.342 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C3'-C2'-C1' 104.125 2.916 . 0.715 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.879 1 C5'-C4'-C3' 108.043 -4.972 . 0.166 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.515 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.257 1 C5'-C4'-C3' 108.654 -4.564 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.515 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.111 3 P-O3'-C3' 124.729 4.191 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.433 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.392 0 C4'-C3'-C2' 98.927 -3.773 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.433 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 O4'-C1'-N19 112.397 4.197 . 0.706 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.053 -3.647 . 0.58 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 98.911 -3.789 . 0.705 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.455 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C5'-C4'-O4' 113.093 2.781 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.455 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.949 0 C4'-C3'-C2' 99.496 -3.204 . 0.918 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.481 1 C4'-C3'-C2' 98.147 -4.553 . 0.897 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.329 -3.371 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C4'-C3'-C2' 99.106 -3.594 . 0.936 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 C4'-C3'-C2' 98.78 -3.92 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.964 0 C4'-C3'-C2' 99.794 -2.906 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.066 0 C4'-C3'-C2' 98.98 -3.72 . 0.903 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 100.316 -2.384 . 0.876 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.33 1 O4'-C1'-N19 112.813 4.613 . 0.851 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.468 " H1'" HG21 ' A' ' 31' ' ' VAL . . . . . . . . 0 P--O5' 1.617 2.424 0 C4'-C3'-C2' 99.283 -3.417 . 0.438 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.663 -3.037 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 98.921 -3.779 . 0.881 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C4'-C3'-C2' 99.383 -3.317 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.436 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 O4'-C1'-N19 111.519 3.319 . 0.595 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.445 ' P ' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.715 -2.985 . 0.68 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.441 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.387 3.187 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 O4'-C1'-N19 111.55 3.35 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.841 -2.859 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 O4'-C1'-N19 111.486 3.286 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 1 C4'-C3'-C2' 98.59 -4.11 . 0.659 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.988 0 C4'-C3'-C2' 99.68 -3.02 . 0.561 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.853 0 O4'-C1'-N19 111.332 3.132 . 0.862 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . 0.427 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 100.178 -2.522 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . 0.427 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.095 0 C4'-C3'-C2' 98.893 -3.807 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 112.055 3.855 . 0.717 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.46 1 C4'-C3'-C2' 98.195 -4.505 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.557 1 O4'-C1'-N19 112.473 4.273 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.129 0 C4'-C3'-C2' 99.385 -3.315 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.433 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 1 C4'-C3'-C2' 98.409 -4.291 . 0.764 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.433 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.135 1 O4'-C1'-N19 112.502 4.302 . 0.783 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 C--O 1.234 0.288 0 N-CA-C 112.742 0.247 . . . . 0.0 112.742 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.33 179.27 48.63 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.886 -0.886 . . . . 0.0 110.886 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.01 -26.2 18.07 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 123.856 3.037 . . . . 0.0 113.149 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.5 p -161.78 153.27 3.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 122.996 0.519 . . . . 0.0 110.133 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.77 158.27 26.9 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -53.35 -33.76 67.65 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.904 3.07 . . . . 0.0 114.899 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.686 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.621 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.621 ' H ' HD22 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.551 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.3 p80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.551 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.613 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.481 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.622 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 39' ' ' SER . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.599 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -146.94 53.51 1.69 Allowed Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.744 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 74.3 Cg_endo -69.36 -17.35 39.41 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.413 3.408 . . . . 0.0 112.608 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -159.33 -14.94 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 O-C-N 122.054 -0.404 . . . . 0.0 110.836 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.66 29.01 0.6 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.85 1.26 . . . . 0.0 113.071 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.6 m -143.52 21.53 1.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.781 0.433 . . . . 0.0 111.563 -175.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -134.38 14.3 3.8 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.02 0.528 . . . . 0.0 111.996 -175.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.47 161.18 43.14 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.826 0.85 . . . . 0.0 110.069 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 p80 -148.88 10.58 0.81 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.542 0.337 . . . . 0.0 111.745 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -149.61 165.64 31.69 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.48 0.312 . . . . 0.0 110.337 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.99 168.49 25.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.272 0.629 . . . . 0.0 110.029 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 ptm -67.73 170.05 8.55 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.162 -0.336 . . . . 0.0 110.786 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -173.69 31.08 0.1 OUTLIER Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.588 -0.339 . . . . 0.0 112.54 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -134.85 165.93 24.15 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 122.292 -0.534 . . . . 0.0 110.362 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.8 m -144.56 160.78 40.58 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 mp -62.36 159.71 14.77 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.181 0.592 . . . . 0.0 110.912 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -75.71 1.41 14.75 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.492 0.717 . . . . 0.0 112.291 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.2 m -142.93 174.89 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.398 0.679 . . . . 0.0 110.397 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -149.84 172.56 14.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.168 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 50.4 p -140.12 177.53 7.92 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.096 0.559 . . . . 0.0 110.376 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -146.6 176.13 10.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.01 0.524 . . . . 0.0 110.117 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -145.61 166.45 25.72 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.004 0.522 . . . . 0.0 110.979 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -153.42 -179.61 7.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.402 0.681 . . . . 0.0 109.558 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 93.2 p -146.57 169.36 19.13 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 123.736 0.814 . . . . 0.0 110.512 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.9 167.25 29.75 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 120.875 0.369 . . . . 0.0 110.715 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -146.69 176.25 10.0 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.14 161.48 41.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.856 0.462 . . . . 0.0 110.044 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -153.59 1.54 0.25 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 122.914 0.485 . . . . 0.0 111.774 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 77.8 t80 -150.73 144.27 17.13 Favored Pre-proline 0 N--CA 1.452 -0.356 0 O-C-N 122.085 -0.384 . . . . 0.0 110.033 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 99' ' ' PHE . 51.1 Cg_exo -55.53 167.54 1.98 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.533 2.822 . . . . 0.0 113.642 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.12 10.85 0.8 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.655 176.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 t -156.02 -175.52 5.47 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.074 0.95 . . . . 0.0 109.215 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.4 mt -135.98 -177.27 4.62 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.575 1.15 . . . . 0.0 109.924 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -135.83 171.2 14.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.395 0.678 . . . . 0.0 110.054 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -140.66 18.67 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.926 0.49 . . . . 0.0 112.007 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.13 174.6 42.38 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -147.28 -173.45 4.26 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.468 1.107 . . . . 0.0 109.713 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -131.66 7.28 4.44 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.829 0.452 . . . . 0.0 110.97 -177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.3 p -142.87 146.59 38.25 Favored Pre-proline 0 C--O 1.231 0.128 0 C-N-CA 123.656 0.782 . . . . 0.0 109.417 178.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.55 154.95 27.73 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.449 2.766 . . . . 0.0 111.591 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -160.43 114.97 2.2 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.896 0.878 . . . . 0.0 108.839 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm 45.86 39.1 5.03 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.621 0.768 . . . . 0.0 111.567 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -130.65 11.34 5.24 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.534 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 13.3 pt-20 -144.29 28.4 0.07 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 123.561 0.744 . . . . 0.0 112.834 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 74.3 Cg_endo -70.35 158.32 56.55 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.066 1.844 . . . . 0.0 111.238 -177.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -74.12 178.45 6.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.815 3.01 . . . . 0.0 111.574 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -136.85 14.39 3.11 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.971 0.908 . . . . 0.0 110.089 177.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -153.57 176.24 12.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.801 1.24 . . . . 0.0 108.691 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.9 t -50.97 137.19 9.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 123.328 0.651 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.41 -19.56 0.09 OUTLIER Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 99.6 p -68.2 163.27 23.11 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 117.889 0.845 . . . . 0.0 111.478 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -153.41 25.35 0.53 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.865 0.466 . . . . 0.0 110.673 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -122.87 20.88 7.6 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -140.28 18.74 2.41 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.601 0.361 . . . . 0.0 111.109 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -144.96 164.38 31.31 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.834 0.853 . . . . 0.0 109.514 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.8 m -154.09 160.92 42.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.557 0.743 . . . . 0.0 110.117 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -153.7 8.3 0.37 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.628 0.771 . . . . 0.0 111.457 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 87.9 p -151.28 8.56 0.54 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 95.4 p -155.62 169.9 23.24 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.054 0.454 . . . . 0.0 110.928 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 88.9 p -77.69 13.35 1.33 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.864 0.865 . . . . 0.0 112.993 179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -61.04 -14.55 39.42 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 123.476 0.56 . . . . 0.0 113.313 -178.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -154.35 162.47 41.15 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.697 0.799 . . . . 0.0 109.56 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.21 0.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 123.253 0.621 . . . . 0.0 110.898 -178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.6 t -76.3 -25.41 54.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.036 0.38 . . . . 0.0 110.715 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.56 HD13 ' H ' ' A' ' 136' ' ' SER . 0.1 OUTLIER -157.72 167.69 29.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.614 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.56 ' H ' HD13 ' A' ' 135' ' ' LEU . 23.3 t -158.87 163.85 36.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.885 0.474 . . . . 0.0 109.782 177.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.0 166.35 33.28 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.389 0.676 . . . . 0.0 110.598 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.1 m -150.96 151.81 30.46 Favored Pre-proline 0 C--N 1.339 0.143 0 C-N-CA 123.137 0.575 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.63 5.32 5.29 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.462 3.441 . . . . 0.0 111.048 173.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.4 m -140.46 166.28 24.32 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 124.799 1.239 . . . . 0.0 109.306 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -49.95 168.89 0.15 Allowed 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.908 3.072 . . . . 0.0 113.209 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 17.79 3.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.384 0.674 . . . . 0.0 110.958 -175.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 71.5 p -132.61 5.74 4.01 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.731 0.813 . . . . 0.0 110.878 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 40.2 tp -148.87 -4.31 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.343 1.057 . . . . 0.0 110.256 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' THR . . . . . 0.548 HG22 ' H ' ' A' ' 146' ' ' GLN . 12.2 m -148.35 175.54 11.02 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.653 1.181 . . . . 0.0 108.126 -176.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.548 ' H ' HG22 ' A' ' 145' ' ' THR . 22.4 pt20 -136.92 161.59 60.68 Favored Pre-proline 0 N--CA 1.456 -0.15 0 O-C-N 121.843 -0.536 . . . . 0.0 110.484 -178.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -49.06 153.88 3.79 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 124.014 3.142 . . . . 0.0 113.112 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -71.78 166.17 30.3 Favored 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 123.959 3.106 . . . . 0.0 109.893 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.436 ' N ' HD23 ' A' ' 149' ' ' LEU . 1.9 pt? -154.91 156.18 31.05 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 122.882 0.473 . . . . 0.0 110.03 -177.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.4 176.05 8.53 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.986 2.457 . . . . 0.0 110.708 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.06 144.32 23.36 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 123.121 0.569 . . . . 0.0 109.69 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.41 154.34 4.19 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.249 2.633 . . . . 0.0 113.3 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.03 167.63 25.51 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.985 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.31 177.49 5.91 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.687 2.925 . . . . 0.0 111.613 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' PHE . . . . . 0.751 ' H ' ' CD ' ' A' ' 156' ' ' PRO . 84.3 m-85 -139.01 -27.41 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -176.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' PRO . . . . . 0.751 ' CD ' ' H ' ' A' ' 155' ' ' PHE . 77.0 Cg_exo -51.86 153.96 10.75 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.411 2.074 . . . . 0.0 113.41 177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.23 169.5 21.38 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 124.158 3.239 . . . . 0.0 110.662 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -54.57 -16.05 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.639 2.893 . . . . 0.0 113.757 177.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 57.0 m 45.28 32.48 1.0 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 124.692 1.197 . . . . 0.0 111.928 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -179.03 -157.27 19.2 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -51.3 147.82 5.38 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.014 0.526 . . . . 0.0 110.417 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -83.39 147.75 53.86 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.531 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.25 -10.63 11.15 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.013 3.142 . . . . 0.0 111.89 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' MET . . . . . 0.441 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' LEU . . . . . 0.418 ' C ' ' HD3' ' A' ' 175' ' ' LYS . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 174' ' ' LEU . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -119.99 172.74 7.53 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 23.1 t -145.25 165.82 27.27 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 82.46 -174.4 53.27 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -174.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -131.14 -53.56 1.04 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 117.382 0.591 . . . . 0.0 111.702 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.1 p -167.24 -33.01 0.02 OUTLIER 'General case' 0 C--N 1.339 0.109 0 C-N-CA 122.787 0.435 . . . . 0.0 111.167 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -64.12 -23.32 67.28 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.157 0.503 . . . . 0.0 109.774 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.33 155.04 26.11 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.228 -1.768 . . . . 0.0 106.228 173.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -155.82 158.28 37.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.316 0.507 . . . . 0.0 111.122 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.9 m120 56.59 35.75 26.55 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.3 mt -137.11 -165.3 1.73 Allowed 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 124.147 0.979 . . . . 0.0 111.06 -176.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.565 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 11.1 t-80 -140.58 -169.15 2.72 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.747 0.819 . . . . 0.0 110.107 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.565 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.2 tp -127.97 170.57 12.71 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.054 0.541 . . . . 0.0 109.7 -176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 228' ' ' LEU . 88.0 mt -54.52 130.92 41.55 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.252 0.621 . . . . 0.0 110.907 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -154.92 13.08 0.39 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.384 0.674 . . . . 0.0 109.985 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -141.62 4.57 1.75 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 122.097 -0.377 . . . . 0.0 111.673 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -77.37 4.07 11.69 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.075 -0.39 . . . . 0.0 110.916 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -61.16 159.07 12.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.653 0.781 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 26.7 p80 -157.63 175.36 14.02 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.952 0.501 . . . . 0.0 110.204 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -151.64 162.78 40.41 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.143 0.577 . . . . 0.0 109.596 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.252 1.204 0 CA-C-O 117.674 -1.155 . . . . 0.0 110.731 179.616 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.334 -3.366 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 98.996 -3.704 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.349 -3.351 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.516 -3.184 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 O4'-C1'-N19 112.399 4.199 . 0.689 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.05 -3.65 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.019 -3.681 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.954 0 C4'-C3'-C2' 99.274 -3.426 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 N19-C1'-C2' 108.745 -2.909 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 99.803 -2.897 . 0.568 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 C4'-C3'-C2' 99.36 -3.34 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.098 0 C4'-C3'-C2' 99.11 -3.59 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.513 -3.187 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.788 0 C4'-C3'-C2' 99.58 -3.12 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 O4'-C1'-N19 111.858 3.658 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 C4'-C3'-C2' 99.194 -3.506 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 N19-C1'-C2' 108.926 -2.796 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 99.038 -3.662 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.306 -3.394 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C4'-C3'-C2' 98.797 -3.903 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.966 0 C4'-C3'-C2' 99.477 -3.223 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 99.507 -3.193 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.945 3.745 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.304 -3.396 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.193 0 C4'-C3'-C2' 99.332 -3.368 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.811 1 C4'-C3'-C2' 98.697 -4.003 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.778 -2.922 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.926 -3.774 . 0.902 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.105 -3.595 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 1 O4'-C1'-N19 112.457 4.257 . 0.545 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 2.074 0 C5'-C4'-O4' 113.604 3.146 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.534 -3.166 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 N19-C1'-C2' 109.374 -2.516 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C5'-C4'-C3' 109.979 -3.681 . 0.088 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.47 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.121 1 C4'-C3'-C2' 98.364 -4.336 . 0.404 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.47 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.08 1 C5'-C4'-C3' 108.43 -4.713 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 004 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.355 0 C4'-C3'-C2' 99.413 -3.287 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 111.655 3.455 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 98.703 -3.997 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 98.84 -3.86 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.599 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 112.046 3.846 . 0.54 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.843 0 O4'-C1'-N19 110.807 2.607 . 0.946 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.128 1 C4'-C3'-C2' 98.695 -4.005 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C4'-C3'-C2' 99.456 -3.244 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.844 0 C4'-C3'-C2' 99.013 -3.687 . 0.926 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C4'-C3'-C2' 99.288 -3.412 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.954 -2.746 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.007 0 C4'-C3'-C2' 99.301 -3.399 . 0.904 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C4'-C3'-C2' 100.249 -2.451 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.408 -3.71 1 O4'-C1'-N19 113.014 4.814 . 0.612 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C4'-C3'-C2' 99.196 -3.504 . 0.624 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C4'-C3'-C2' 99.613 -3.087 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.909 0 C4'-C3'-C2' 99.388 -3.312 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 98.867 -3.833 . 0.853 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.441 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C4'-C3'-C2' 99.101 -3.599 . 0.523 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C4'-C3'-C2' 99.854 -2.846 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.431 -3.269 . 0.609 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.228 0 O4'-C1'-N19 111.91 3.71 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 O4'-C1'-N19 112.108 3.908 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.621 2.788 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.05 -3.65 . 0.675 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 O4'-C1'-N19 112.223 4.023 . 0.644 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.958 -2.742 . 0.888 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 100.572 -2.128 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C4'-C3'-C2' 99.167 -3.533 . 0.614 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.229 -3.471 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.497 1 C4'-C3'-C2' 98.205 -4.495 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.11 2 O4'-C1'-N19 112.483 4.283 . 0.836 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.248 -3.452 . 0.831 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.419 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 C4'-C3'-C2' 97.84 -4.86 . 0.691 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.419 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 O4'-C1'-N19 112.167 3.967 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo . . . . . 0 N--CA 1.471 0.162 0 N-CA-C 112.533 0.166 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.89 176.09 47.89 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 120.174 -0.237 . . . . 0.0 112.541 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.8 171.4 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 1 C-N-CA 125.426 4.084 . . . . 0.0 113.853 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.47 177.68 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.602 0.761 . . . . 0.0 110.37 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 5' ' ' LEU . 1.2 pt? -139.18 78.66 27.98 Favored Pre-proline 0 N--CA 1.454 -0.243 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -51.46 -23.81 15.12 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 124.284 3.323 . . . . 0.0 111.705 175.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 11' ' ' MET . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 16' ' ' ILE . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.542 HD13 HD13 ' A' ' 66' ' ' LEU . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.483 ' HG3' HD12 ' A' ' 20' ' ' LEU . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.687 ' N ' HD22 ' A' ' 20' ' ' LEU . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.65 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.577 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.577 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.65 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.556 ' CG2' HD23 ' A' ' 20' ' ' LEU . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' A' ' 20' ' ' LEU . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.417 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' HG22 ' A' ' 53' ' ' THR . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' O ' ' A' ' 52' ' ' PRO 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.579 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.549 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.549 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 16' ' ' ILE . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -147.89 64.2 8.15 Favored Pre-proline 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -74.87 -5.07 16.34 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.128 3.219 . . . . 0.0 111.405 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -155.34 164.0 39.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.43 0.692 . . . . 0.0 109.506 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.91 16.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.511 0.324 . . . . 0.0 111.815 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -138.84 -3.45 1.63 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -153.78 2.95 0.27 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.272 0.487 . . . . 0.0 111.366 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.66 -11.43 60.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 121.894 -0.504 . . . . 0.0 111.568 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 47.49 25.23 0.59 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 124.887 1.275 . . . . 0.0 113.372 -176.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.1 mt -145.34 172.42 13.19 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.821 1.248 . . . . 0.0 109.814 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.48 23.25 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.339 0.656 . . . . 0.0 110.391 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.9 ptm -147.83 -179.86 7.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.451 0.701 . . . . 0.0 110.518 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -158.15 -174.21 27.56 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -74.61 19.84 0.13 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.605 1.162 . . . . 0.0 112.589 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.4 p -57.3 166.01 1.29 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.113 0.565 . . . . 0.0 111.853 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 pp -152.06 -174.1 4.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.521 0.729 . . . . 0.0 110.505 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.8 p -144.86 171.72 14.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.657 0.741 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.508 HG22 ' H ' ' A' ' 90' ' ' THR . 10.8 p -153.18 168.07 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.471 0.709 . . . . 0.0 109.295 -177.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -144.88 15.29 1.55 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.75 0.42 . . . . 0.0 111.266 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.508 ' H ' HG22 ' A' ' 88' ' ' VAL . 70.2 p -78.14 21.32 0.34 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.205 1.002 . . . . 0.0 112.817 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -139.88 159.76 41.45 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.706 0.402 . . . . 0.0 110.553 -176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -152.25 170.53 19.8 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -154.74 171.18 19.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.0 m -145.24 174.74 10.82 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.314 0.578 . . . . 0.0 111.363 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -150.11 167.94 25.37 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -56.86 144.65 32.48 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.33 0.652 . . . . 0.0 111.358 -177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.62 15.37 0.77 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.933 0.493 . . . . 0.0 111.88 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.4 t70 62.63 2.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.527 1.531 . . . . 0.0 113.032 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 34.9 t80 31.02 64.11 1.0 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.539 1.536 . . . . 0.0 113.084 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -71.67 1.24 5.9 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 124.096 3.197 . . . . 0.0 112.42 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.7 -1.25 3.57 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 122.093 -0.379 . . . . 0.0 111.389 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -146.68 175.73 10.39 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.873 0.869 . . . . 0.0 110.016 177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -134.86 -1.25 2.73 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.603 0.361 . . . . 0.0 111.952 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 41.5 t80 49.16 23.36 0.76 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.43 1.092 . . . . 0.0 113.359 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -148.4 13.81 0.97 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.565 0.346 . . . . 0.0 111.024 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.86 172.47 43.77 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -156.75 -172.02 3.89 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.269 0.628 . . . . 0.0 109.766 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.84 -9.8 10.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.242 1.017 . . . . 0.0 112.021 178.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -59.83 156.12 37.32 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.07 0.548 . . . . 0.0 111.223 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -73.91 177.36 8.24 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.497 2.798 . . . . 0.0 111.619 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -147.61 170.1 18.22 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.337 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -141.7 162.5 35.32 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-O 121.435 0.636 . . . . 0.0 111.645 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -154.73 -1.63 0.17 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.841 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.474 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.0 mp0 -68.57 -41.8 24.12 Favored Pre-proline 0 N--CA 1.448 -0.527 0 C-N-CA 124.219 1.007 . . . . 0.0 112.754 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 114' ' ' GLU . 94.2 Cg_endo -76.72 162.23 32.89 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.263 1.975 . . . . 0.0 111.109 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.12 174.17 11.78 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.288 3.325 . . . . 0.0 111.423 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -143.51 12.63 1.73 Allowed 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.155 0.582 . . . . 0.0 110.911 178.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -149.99 151.68 33.71 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.407 0.683 . . . . 0.0 109.248 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -148.48 174.09 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 C-N-CA 123.015 0.526 . . . . 0.0 110.62 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -169.5 12.3 0.05 OUTLIER Glycine 0 CA--C 1.531 1.043 0 CA-C-O 119.588 -0.562 . . . . 0.0 112.207 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t 55.66 -178.59 0.04 OUTLIER 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.446 1.099 . . . . 0.0 112.161 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 54.0 p30 -150.7 13.45 0.72 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.411 0.684 . . . . 0.0 110.941 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -172.9 7.71 0.03 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.935 -0.369 . . . . 0.0 112.951 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -151.86 178.62 9.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.097 0.948 . . . . 0.0 109.008 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.74 -1.73 0.87 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.19 0.596 . . . . 0.0 111.599 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 75.3 m -147.58 167.17 25.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.496 0.718 . . . . 0.0 110.211 178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -159.98 162.88 34.44 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.349 0.66 . . . . 0.0 110.37 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 81.6 p -159.7 171.31 19.79 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.532 0.733 . . . . 0.0 110.403 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 81.3 p -155.02 173.28 16.8 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.023 0.529 . . . . 0.0 110.304 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 40.3 m 46.84 28.57 0.85 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.037 0.935 . . . . 0.0 112.884 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.95 178.92 39.85 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.708 -0.957 . . . . 0.0 110.708 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -147.94 166.79 26.61 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.077 0.551 . . . . 0.0 110.482 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.76 145.18 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.192 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.7 m 46.71 26.58 0.56 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.486 1.114 . . . . 0.0 113.721 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -142.79 4.71 1.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 117.989 0.359 . . . . 0.0 111.245 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 44.9 m -142.47 15.46 2.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.89 0.476 . . . . 0.0 111.018 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.96 13.99 1.03 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.888 0.475 . . . . 0.0 110.901 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -58.8 146.86 74.05 Favored Pre-proline 0 CA--C 1.531 0.246 0 O-C-N 122.055 -0.403 . . . . 0.0 110.75 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.59 -26.67 56.22 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.005 3.137 . . . . 0.0 113.811 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -149.62 153.88 37.23 Favored Pre-proline 0 C--O 1.232 0.164 0 C-N-CA 123.158 0.583 . . . . 0.0 110.022 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -78.64 1.0 9.47 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.94 3.093 . . . . 0.0 111.56 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.09 -172.29 0.06 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.483 1.113 . . . . 0.0 112.558 -176.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.1 t -152.95 176.04 12.28 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.182 0.593 . . . . 0.0 110.002 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.88 6.57 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.947 0.899 . . . . 0.0 110.531 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.5 t -154.79 151.32 28.52 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 13.9 pt20 -159.65 35.55 0.05 OUTLIER Pre-proline 0 CA--C 1.545 0.759 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 61.5 Cg_endo -67.24 162.7 37.38 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.203 1.935 . . . . 0.0 110.847 -177.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.28 153.77 4.36 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.472 3.448 . . . . 0.0 113.7 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.62 68.08 5.6 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.71 166.79 27.61 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.827 3.018 . . . . 0.0 110.615 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.1 pt -144.19 158.48 54.95 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.292 0.637 . . . . 0.0 110.177 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.78 162.2 3.9 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.832 3.021 . . . . 0.0 113.222 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.44 158.88 3.52 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 124.267 3.311 . . . . 0.0 112.353 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.38 170.8 18.37 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.534 2.822 . . . . 0.0 110.3 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 42.41 50.53 5.36 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.951 0.9 . . . . 0.0 113.168 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.02 161.57 45.46 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.474 2.783 . . . . 0.0 111.068 -177.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.79 161.08 46.17 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.972 2.448 . . . . 0.0 109.939 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.3 154.89 56.38 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.991 3.127 . . . . 0.0 110.609 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 56.4 m -147.24 9.01 0.94 Allowed 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.426 0.69 . . . . 0.0 110.433 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.48 -168.26 40.22 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -139.96 168.82 18.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.935 0.894 . . . . 0.0 109.592 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -59.2 142.39 86.09 Favored Pre-proline 0 CA--C 1.531 0.23 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo -75.86 -10.45 19.84 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 124.077 3.185 . . . . 0.0 111.77 -178.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.481 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 167' ' ' LEU . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.492 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.41 171.91 10.07 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -159.47 161.37 35.43 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.057 0.543 . . . . 0.0 109.998 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 98.5 171.78 32.0 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -79.89 170.31 16.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.867 0.467 . . . . 0.0 110.398 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.9 m -63.72 -0.77 1.09 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.708 0.803 . . . . 0.0 112.766 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 51.8 p-80 -128.67 11.05 6.16 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.298 0.499 . . . . 0.0 110.718 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.6 20.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.91 157.61 14.91 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.96 1.304 . . . . 0.0 113.373 -172.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.492 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.409 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.479 HD22 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.62 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 55.99 25.35 8.66 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.0 mt -123.06 -167.07 1.54 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.51 1.124 . . . . 0.0 111.01 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.493 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 25.1 t-80 -143.18 -175.61 4.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.493 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 3.3 tp -136.88 17.3 3.04 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 229' ' ' LEU . 2.9 mm? 52.52 -155.32 0.18 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.326 1.05 . . . . 0.0 111.033 178.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.99 15.97 7.35 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.698 0.799 . . . . 0.0 110.869 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 52.23 21.08 1.52 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.93 1.292 . . . . 0.0 113.132 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.6 t60 -59.89 153.68 20.41 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.798 -0.564 . . . . 0.0 110.185 176.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -73.58 166.51 23.12 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.974 0.416 . . . . 0.0 111.659 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -74.32 16.67 0.23 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.701 0.8 . . . . 0.0 111.897 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -65.25 -5.93 8.33 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.872 0.869 . . . . 0.0 112.55 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 54.9 t60 . . . . . 0 C--O 1.25 1.122 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.201 -179.596 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 C4'-C3'-C2' 99.308 -3.392 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.394 0 C4'-C3'-C2' 99.24 -3.46 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.468 0 C4'-C3'-C2' 99.824 -2.876 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.19 -3.51 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.764 1 O4'-C1'-N19 112.264 4.064 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 98.962 -3.738 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.172 -3.528 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C4'-C3'-C2' 99.44 -3.26 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 99.011 -3.689 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 O4'-C1'-N19 111.789 3.589 . 0.408 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.509 0 O4'-C1'-N19 111.644 3.444 . 0.789 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 C4'-C3'-C2' 99.717 -2.983 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.479 3.279 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.351 -3.349 . 0.74 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.235 -3.465 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.332 -3.368 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.507 -3.193 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 99.04 -3.66 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 C4'-C3'-C2' 99.2 -3.5 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 99.103 -3.597 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 98.879 -3.821 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.315 -3.385 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.493 1 C4'-C3'-C2' 98.494 -4.206 . 0.713 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C5'-C4'-C3' 109.968 -3.688 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.802 3.602 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.013 -3.687 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 99.092 -3.608 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.035 -3.665 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 C4'-C3'-C2' 99.19 -3.51 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.478 -3.222 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.361 0 C4'-C3'-C2' 99.462 -3.238 . 0.693 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.113 1 C4'-C3'-C2' 98.549 -4.151 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.421 1 C4'-C3'-C2' 98.607 -4.093 . 0.741 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.567 0 C5'-C4'-C3' 111.61 -2.594 . 0.6 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.458 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.54 2.304 1 C5'-C4'-C3' 108.067 -4.955 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.57 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.239 1 P-O3'-C3' 125.039 4.449 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.616 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.624 3.111 1 C4'-C3'-C2' 97.174 -5.526 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.616 ' C8 ' ' N3 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.41 -3.577 0 N19-C1'-C2' 119.673 3.921 . 0.377 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 99.163 -3.537 . 0.5 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 1 C4'-C3'-C2' 98.637 -4.063 . 0.866 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.579 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.945 0 N19-C1'-C2' 107.748 -3.532 . 0.603 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.414 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.501 0 O4'-C1'-N19 110.769 2.569 . 0.925 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 1 C4'-C3'-C2' 98.312 -4.388 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 C4'-C3'-C2' 99.376 -3.324 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 98.966 -3.734 . 0.886 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.716 0 C4'-C3'-C2' 99.402 -3.298 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.879 -2.821 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 99.167 -3.533 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 100.393 -2.307 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.846 1 O4'-C1'-N19 112.998 4.798 . 0.571 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C4'-C3'-C2' 98.932 -3.768 . 0.561 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 C4'-C3'-C2' 99.998 -2.702 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C4'-C3'-C2' 99.222 -3.478 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 O4'-C1'-N19 111.824 3.624 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 O4'-C1'-N19 111.102 2.902 . 0.346 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.409 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.623 -3.077 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.54 -3.16 . 0.576 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.659 3.459 . 0.642 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 O4'-C1'-N19 111.814 3.614 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 C4'-C3'-C2' 99.299 -3.401 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 C4'-C3'-C2' 99.148 -3.552 . 0.671 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.693 0 O4'-C1'-N19 111.282 3.082 . 0.502 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.245 0 C4'-C3'-C2' 99.757 -2.943 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.47 -3.23 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.014 -3.686 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 C4'-C3'-C2' 98.898 -3.802 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 1 C4'-C3'-C2' 98.315 -4.385 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 O4'-C1'-N19 112.106 3.906 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.259 -3.441 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.542 1 C4'-C3'-C2' 97.792 -4.908 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.425 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.273 0 O4'-C1'-N19 111.382 3.182 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo . . . . . 0 N--CA 1.476 0.484 0 CA-C-O 119.745 -0.189 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.31 -179.46 45.86 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 120.079 -0.29 . . . . 0.0 112.422 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.38 179.97 5.87 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 124.769 3.646 . . . . 0.0 110.993 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -141.77 11.03 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.344 0.657 . . . . 0.0 111.897 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -152.32 153.58 31.03 Favored Pre-proline 0 CA--C 1.535 0.389 0 O-C-N 121.96 -0.462 . . . . 0.0 111.412 -177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.67 -25.32 41.3 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 124.02 3.147 . . . . 0.0 115.376 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.486 HD13 HD13 ' A' ' 66' ' ' LEU . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.589 ' N ' HD22 ' A' ' 20' ' ' LEU . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.556 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' H ' HD22 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.561 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.561 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.556 ' HG2' HD23 ' A' ' 24' ' ' LEU . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.565 HG23 HD23 ' A' ' 20' ' ' LEU . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.462 ' HB2' HD21 ' A' ' 35' ' ' LEU . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.486 HD13 HD13 ' A' ' 16' ' ' ILE . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -150.01 63.18 6.08 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.63 -22.67 17.81 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.569 2.846 . . . . 0.0 112.68 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -165.22 -15.42 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -156.22 177.94 10.87 Favored 'General case' 0 CA--C 1.527 0.061 0 CA-C-O 121.116 0.484 . . . . 0.0 111.36 -175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 46.4 m -140.36 3.51 1.94 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.457 1.103 . . . . 0.0 110.616 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -143.03 169.43 17.59 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.602 0.761 . . . . 0.0 110.403 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -153.6 14.88 0.5 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.585 0.354 . . . . 0.0 111.869 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.86 165.12 29.04 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 122.615 0.366 . . . . 0.0 110.74 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -156.41 156.27 33.55 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.43 176.53 10.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.353 0.661 . . . . 0.0 109.806 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -131.7 11.15 4.78 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.691 0.796 . . . . 0.0 111.115 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -175.49 175.98 47.3 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -142.23 167.87 21.09 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.379 0.672 . . . . 0.0 109.906 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.2 p -144.31 11.38 1.51 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.013 0.925 . . . . 0.0 110.234 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.53 -179.1 7.1 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.452 0.701 . . . . 0.0 110.698 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 51.2 m -139.87 168.87 18.83 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.312 1.045 . . . . 0.0 109.935 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.4 m -143.22 170.01 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.646 0.778 . . . . 0.0 110.882 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -156.13 167.37 30.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.904 0.882 . . . . 0.0 109.773 -177.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.8 p -69.41 154.17 42.44 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.301 -0.249 . . . . 0.0 110.476 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -159.93 166.65 29.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.231 0.613 . . . . 0.0 109.867 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -152.44 176.84 11.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.173 0.589 . . . . 0.0 110.685 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.5 t -149.33 178.0 9.17 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.945 0.498 . . . . 0.0 110.734 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.7 m -138.61 10.63 2.7 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.945 0.898 . . . . 0.0 109.985 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.12 5.21 0.73 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.887 0.875 . . . . 0.0 112.206 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -136.24 18.99 3.17 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.763 0.825 . . . . 0.0 110.618 -176.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.64 171.77 14.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.159 0.584 . . . . 0.0 111.485 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -156.11 161.95 40.31 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.367 0.667 . . . . 0.0 110.353 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -153.8 110.33 2.53 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.69 160.54 37.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.776 2.318 . . . . 0.0 110.726 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.75 27.36 0.33 Allowed 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 110.249 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 p -130.74 24.05 5.03 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.304 0.641 . . . . 0.0 111.667 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.518 ' H ' HD23 ' A' ' 103' ' ' LEU . 1.6 pt? -141.54 172.24 12.96 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.303 0.641 . . . . 0.0 111.657 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.62 175.26 11.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.376 0.67 . . . . 0.0 109.721 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -140.77 9.18 2.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.991 0.516 . . . . 0.0 111.554 -177.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.08 -0.93 55.07 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.32 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -71.92 4.53 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.916 0.858 . . . . 0.0 112.674 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -144.57 138.46 27.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.001 0.52 . . . . 0.0 109.964 -178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 75.2 p -151.35 163.63 22.97 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.164 0.585 . . . . 0.0 109.906 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -55.18 -12.9 5.96 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.786 2.991 . . . . 0.0 113.479 175.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -77.02 -5.5 49.0 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.198 0.599 . . . . 0.0 111.749 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -138.42 0.24 2.06 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -159.22 145.94 16.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.151 0.58 . . . . 0.0 109.757 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 35.18 59.35 2.54 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.789 1.236 . . . . 0.0 113.396 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.84 155.67 7.9 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.728 2.286 . . . . 0.0 112.65 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -74.15 172.11 16.65 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.592 2.861 . . . . 0.0 110.426 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -61.88 -17.64 57.29 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.825 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -70.54 -0.4 8.44 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 122.965 0.506 . . . . 0.0 111.414 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.6 t -138.92 19.31 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 124.409 1.083 . . . . 0.0 108.343 -177.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.72 10.58 6.73 Favored Glycine 0 CA--C 1.534 1.229 0 N-CA-C 111.792 -0.523 . . . . 0.0 111.792 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.9 t -153.2 169.01 24.06 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.516 0.727 . . . . 0.0 110.065 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -146.43 174.86 11.01 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.153 0.581 . . . . 0.0 110.27 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -176.8 38.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.1 166.1 23.84 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 117.2 0.5 . . . . 0.0 110.953 -175.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -148.99 167.26 26.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.391 0.676 . . . . 0.0 109.998 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 88.9 p -151.46 -179.59 7.52 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.182 0.593 . . . . 0.0 111.113 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -147.49 169.47 19.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.877 0.871 . . . . 0.0 110.009 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.0 p -156.43 -178.75 7.56 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.006 0.432 . . . . 0.0 111.463 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -140.92 17.02 2.3 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.306 1.042 . . . . 0.0 110.598 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.9 m -146.39 175.26 10.68 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 124.492 1.117 . . . . 0.0 109.344 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -169.4 10.67 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 CA-C-O 119.599 -0.556 . . . . 0.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.47 158.77 28.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.106 0.953 . . . . 0.0 111.08 178.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.8 m -148.18 167.34 4.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 124.039 0.936 . . . . 0.0 109.724 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 85.1 p -152.01 6.56 0.45 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.76 0.424 . . . . 0.0 111.802 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.5 tp -154.2 152.6 30.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.164 0.586 . . . . 0.0 109.908 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.7 t -155.21 168.09 28.2 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.07 6.59 0.88 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.486 0.715 . . . . 0.0 111.008 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -67.94 166.7 21.37 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 124.166 0.986 . . . . 0.0 111.161 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.02 -177.66 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 125.075 3.85 . . . . 0.0 113.605 173.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.1 p -133.51 143.16 46.78 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.416 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.34 158.23 3.93 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 124.138 3.226 . . . . 0.0 113.572 177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.22 17.42 0.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.162 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.3 m -140.77 -178.26 5.45 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.419 0.687 . . . . 0.0 109.664 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 70.8 mt 55.79 14.61 1.37 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.063 0.945 . . . . 0.0 112.568 -176.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 32.3 p -142.1 0.26 1.35 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.31 1.044 . . . . 0.0 110.589 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -76.11 164.88 57.29 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 123.934 0.894 . . . . 0.0 109.911 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -51.82 162.47 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 124.002 3.135 . . . . 0.0 112.557 174.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.32 -8.06 22.04 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.405 2.736 . . . . 0.0 112.327 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.9 mt 33.63 64.48 1.49 Allowed Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 125.408 1.483 . . . . 0.0 112.439 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.02 -4.87 15.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.22 2.613 . . . . 0.0 112.291 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 26.3 pt -144.22 149.17 44.06 Favored Pre-proline 0 C--O 1.235 0.308 0 C-N-CA 123.108 0.563 . . . . 0.0 109.684 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -76.18 163.21 33.08 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 123.589 2.86 . . . . 0.0 110.9 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.75 167.73 26.42 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.538 2.826 . . . . 0.0 109.756 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.55 161.62 45.17 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.731 2.288 . . . . 0.0 110.538 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -153.86 160.99 30.32 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 110.124 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.89 152.54 9.81 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.469 3.446 . . . . 0.0 112.788 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.89 167.28 27.71 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.252 2.634 . . . . 0.0 111.006 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.87 176.31 7.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 123.428 2.752 . . . . 0.0 110.254 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 22.9 t -148.0 171.64 15.49 Favored 'General case' 0 C--O 1.232 0.14 0 O-C-N 122.077 -0.389 . . . . 0.0 111.081 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.12 29.05 0.19 Allowed Glycine 0 CA--C 1.532 1.148 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -136.77 -167.99 2.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.847 1.259 . . . . 0.0 108.962 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -130.22 82.12 66.64 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-O 121.667 0.746 . . . . 0.0 110.326 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -83.4 -12.32 9.14 Favored 'Trans proline' 0 N--CA 1.449 -1.13 1 C-N-CA 125.66 4.24 . . . . 0.0 110.483 -175.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.429 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.498 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.54 169.35 17.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 32.8 t -155.76 163.64 39.59 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.76 177.43 18.91 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 123.45 0.548 . . . . 0.0 112.383 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.98 164.22 26.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 122.871 0.469 . . . . 0.0 110.149 176.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.2 m -63.34 4.61 0.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.037 0.935 . . . . 0.0 113.41 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -138.8 16.97 2.68 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.82 1.21 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.935 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -57.74 166.57 1.35 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.158 0.583 . . . . 0.0 111.487 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.498 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.436 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.429 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 50.79 24.47 1.75 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.27 102.7 5.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.415 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 20.4 t-80 -65.07 -175.37 0.2 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.244 1.018 . . . . 0.0 111.5 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.415 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 14.3 tp -133.38 9.02 4.0 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 99.1 mt -132.24 9.16 4.4 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.796 -0.565 . . . . 0.0 111.865 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.26 173.82 5.33 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.149 0.431 . . . . 0.0 110.369 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -146.69 165.45 29.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.193 0.52 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -82.95 5.66 21.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.327 1.051 . . . . 0.0 112.065 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -140.19 155.07 47.08 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.576 -0.703 . . . . 0.0 109.553 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -146.28 21.39 1.37 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.945 0.498 . . . . 0.0 111.904 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -132.78 25.69 4.34 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 123.207 0.603 . . . . 0.0 110.657 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.902 179.525 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.166 0 C5'-C4'-O4' 114.097 3.498 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 O4'-C1'-N19 111.693 3.493 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.143 2.943 . 0.857 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.157 0 C4'-C3'-C2' 99.567 -3.133 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.406 4.206 . 0.592 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 C4'-C3'-C2' 98.773 -3.927 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.057 0 O4'-C1'-N19 111.984 3.784 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 C4'-C3'-C2' 99.135 -3.565 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.752 -2.948 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.398 0 C4'-C3'-C2' 99.176 -3.524 . 0.667 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C4'-C3'-C2' 99.517 -3.183 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.344 -3.356 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.661 -3.039 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 C4'-C3'-C2' 99.406 -3.294 . 0.728 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 C4'-C3'-C2' 99.033 -3.667 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 99.23 -3.47 . 0.654 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.463 -3.237 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 0 C4'-C3'-C2' 99.162 -3.538 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.019 0 C4'-C3'-C2' 99.595 -3.105 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.591 0 C4'-C3'-C2' 99.998 -2.702 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.457 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.991 0 C4'-C3'-C2' 99.392 -3.308 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.457 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.336 -3.364 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.217 0 C4'-C3'-C2' 98.957 -3.743 . 0.793 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.737 -2.963 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 O4'-C1'-N19 111.354 3.154 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-C2' 99.118 -3.582 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.81 1 C4'-C3'-C2' 98.138 -4.562 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.365 -3.335 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 100.341 -2.359 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.435 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.545 -3.155 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.435 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 N19-C1'-C2' 108.824 -2.86 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.295 -3.405 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.965 1 O4'-C1'-N19 112.203 4.003 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.461 0 C5'-C4'-C3' 112.13 -2.247 . 0.417 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C5'-C4'-C3' 107.578 -5.281 . 0.394 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.498 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.182 2 C5'-C4'-C3' 108.459 -4.694 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.574 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.747 -2.953 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.574 ' C8 ' ' N3 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.885 1 N19-C1'-C2' 121.254 4.908 . 0.417 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.544 2.622 0 O4'-C1'-N19 111.994 3.794 . 0.545 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . 0.414 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.475 -3.225 . 0.763 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.543 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.003 0 C4'-C3'-C2' 99.819 -2.881 . 0.572 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.543 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.413 -3.319 0 C4'-C3'-C2' 99.179 -3.521 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.741 1 C4'-C3'-C2' 98.51 -4.19 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.215 -3.485 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C4'-C3'-C2' 98.801 -3.899 . 0.851 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.795 -2.905 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 100.174 -2.526 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.404 -3.296 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C5'-C4'-C3' 111.797 -2.468 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 1 O4'-C1'-N19 113.072 4.872 . 0.553 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.404 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.173 -3.527 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.404 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 C5'-C4'-C3' 112.141 -2.24 . 0.764 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.388 0 O4'-C1'-N19 111.721 3.521 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 O4'-C1'-N19 111.741 3.541 . 0.845 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.764 0 O4'-C1'-N19 111.616 3.416 . 0.544 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 C4'-C3'-C2' 98.878 -3.822 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.8 0 C4'-C3'-C2' 99.635 -3.065 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.362 1 O4'-C1'-N19 112.329 4.129 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 C4'-C3'-C2' 99.092 -3.608 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.397 0 O4'-C1'-N19 111.681 3.481 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.849 -3.851 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.867 -3.833 . 0.542 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 111.163 2.963 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.808 -2.892 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C4'-C3'-C2' 98.839 -3.861 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.362 0 C4'-C3'-C2' 98.924 -3.776 . 0.705 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C4'-C3'-C2' 98.712 -3.988 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.888 3.688 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 99.379 -3.321 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.617 2.352 1 C4'-C3'-C2' 98.202 -4.498 . 0.813 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.535 0 O4'-C1'-N19 111.41 3.21 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo . . . . . 0 CA--C 1.53 0.303 0 N-CA-C 112.699 0.231 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.7 -64.49 0.07 OUTLIER Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.383 -178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.08 -7.17 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.693 3.595 . . . . 0.0 114.495 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.62 11.85 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.814 0.846 . . . . 0.0 110.811 -177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.9 tp -150.56 69.83 8.77 Favored Pre-proline 0 N--CA 1.454 -0.249 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.3 -25.37 9.82 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 124.514 3.476 . . . . 0.0 113.756 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.525 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.665 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.52 ' CD1' HD21 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.578 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' VAL . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.5 p80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.578 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 24' ' ' LEU . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.537 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.442 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.724 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -146.87 57.83 3.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.724 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -72.84 -15.23 26.66 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 124.103 3.202 . . . . 0.0 114.351 -175.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -155.55 -13.71 0.11 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.716 0.689 . . . . 0.0 112.389 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -153.68 171.42 18.85 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.5 t -157.99 161.89 38.16 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.15 14.22 0.7 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.48 1.112 . . . . 0.0 109.449 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.01 -178.32 6.22 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.443 1.097 . . . . 0.0 109.836 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -147.41 177.74 8.99 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.033 0.533 . . . . 0.0 110.564 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.97 157.46 43.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.322 0.649 . . . . 0.0 109.359 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.17 179.55 8.0 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.365 0.666 . . . . 0.0 110.751 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 76.0 mtm -142.75 177.97 7.96 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.338 0.655 . . . . 0.0 110.167 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.85 179.32 38.37 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.359 0.504 . . . . 0.0 112.404 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -138.38 169.24 18.13 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.475 0.71 . . . . 0.0 109.531 -177.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -156.29 179.17 9.49 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.622 0.769 . . . . 0.0 110.039 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 pp -143.41 177.85 8.16 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.987 0.515 . . . . 0.0 110.691 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.6 p -155.35 -176.95 6.2 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.594 0.358 . . . . 0.0 110.648 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.6 p -139.61 156.63 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -148.49 20.24 1.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.796 0.438 . . . . 0.0 110.814 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -145.87 175.3 10.52 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 122.927 0.491 . . . . 0.0 110.203 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.3 176.39 10.03 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.448 0.699 . . . . 0.0 110.678 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -150.13 -178.73 6.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.021 0.928 . . . . 0.0 110.324 -177.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.8 p -137.56 176.75 8.43 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.182 0.593 . . . . 0.0 110.364 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.7 m -143.39 -177.11 5.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.913 0.485 . . . . 0.0 110.695 -177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -53.5 157.52 2.09 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.296 1.038 . . . . 0.0 112.009 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -133.97 -176.18 4.09 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.931 0.892 . . . . 0.0 110.114 -173.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.32 172.15 13.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.088 0.47 . . . . 0.0 110.448 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -153.43 170.96 19.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.965 0.506 . . . . 0.0 110.376 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -142.8 152.72 59.91 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.32 173.69 14.08 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.788 2.992 . . . . 0.0 111.384 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -149.08 146.31 27.66 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.101 0.561 . . . . 0.0 109.716 177.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.3 t -163.49 178.07 8.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.954 0.502 . . . . 0.0 109.88 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.1 mp -64.2 -177.16 0.26 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.816 1.246 . . . . 0.0 110.639 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -135.2 164.15 28.34 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.298 0.639 . . . . 0.0 109.956 -177.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -146.43 -179.68 6.92 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.682 0.393 . . . . 0.0 110.618 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -163.55 -174.68 33.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -141.67 22.27 2.15 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.614 0.765 . . . . 0.0 110.595 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -135.01 172.28 13.23 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 123.294 0.637 . . . . 0.0 109.94 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 49.5 p -140.89 158.21 65.66 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 123.076 0.55 . . . . 0.0 109.803 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -74.23 165.63 31.44 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.591 2.861 . . . . 0.0 111.462 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -85.85 22.12 1.74 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.83 0.852 . . . . 0.0 111.025 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -110.58 6.49 21.9 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -69.09 171.53 8.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.141 0.577 . . . . 0.0 110.842 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -154.21 153.48 28.33 Favored Pre-proline 0 N--CA 1.456 -0.144 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.226 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.07 163.86 34.36 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 123.67 2.914 . . . . 0.0 111.419 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.35 174.63 12.51 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.333 3.355 . . . . 0.0 110.844 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.23 29.86 1.16 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.205 0.526 . . . . 0.0 111.298 -179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -129.23 161.84 29.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.156 0.582 . . . . 0.0 109.998 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.26 6.79 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.29 0.636 . . . . 0.0 110.584 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.27 -179.75 41.96 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.874 -0.891 . . . . 0.0 110.874 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.1 t -61.11 155.64 20.01 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.827 0.851 . . . . 0.0 111.096 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -157.04 175.78 13.63 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.246 0.618 . . . . 0.0 110.797 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 168.49 41.29 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -159.57 -179.71 8.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.016 0.526 . . . . 0.0 109.818 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -134.44 16.71 3.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.2 m -142.85 -179.23 6.22 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.111 0.964 . . . . 0.0 109.643 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -149.97 171.02 17.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.745 0.307 . . . . 0.0 111.178 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.7 p -152.57 178.56 9.46 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.008 0.923 . . . . 0.0 110.235 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 45.6 m -55.66 140.44 41.37 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.664 0.269 . . . . 0.0 111.166 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 13.2 t -158.85 178.35 10.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.769 0.828 . . . . 0.0 109.56 -178.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -172.65 178.94 44.47 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -144.21 11.84 1.55 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.217 0.607 . . . . 0.0 111.084 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 49.4 t -59.26 156.93 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 123.701 0.8 . . . . 0.0 109.898 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.6 p -139.63 4.49 2.15 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.019 0.528 . . . . 0.0 112.036 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.96 126.3 26.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.0 p -162.51 178.5 8.54 Favored 'General case' 0 C--O 1.23 0.039 0 O-C-N 121.95 -0.469 . . . . 0.0 110.96 -177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.62 175.54 12.68 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.418 0.687 . . . . 0.0 109.719 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.6 m -60.9 156.31 47.79 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 122.803 0.441 . . . . 0.0 110.517 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -51.62 158.26 4.41 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 123.858 3.039 . . . . 0.0 113.061 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.2 m -61.44 158.58 37.76 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.506 0.722 . . . . 0.0 110.82 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.89 171.42 16.63 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.083 2.522 . . . . 0.0 110.933 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.19 168.72 23.81 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.223 0.609 . . . . 0.0 110.233 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.5 m -75.5 6.47 4.64 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.179 0.591 . . . . 0.0 112.045 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 97.6 mt -138.06 152.64 49.01 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.931 0.492 . . . . 0.0 109.75 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 10.4 m 59.06 0.02 0.16 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.272 1.029 . . . . 0.0 112.871 -176.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -148.56 160.47 36.14 Favored Pre-proline 0 C--O 1.237 0.398 0 C-N-CA 124.137 0.975 . . . . 0.0 109.013 -178.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.32 135.4 46.29 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.469 2.779 . . . . 0.0 111.824 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -78.68 -10.37 15.73 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.499 2.799 . . . . 0.0 111.05 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 34.9 tp -155.4 71.45 5.55 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 123.923 0.889 . . . . 0.0 109.204 -176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.14 -31.78 29.7 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.921 3.08 . . . . 0.0 113.04 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 50.5 mt -148.82 128.19 6.33 Favored Pre-proline 0 C--N 1.343 0.31 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.21 151.39 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.494 2.796 . . . . 0.0 112.001 176.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.86 159.19 31.2 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.996 2.464 . . . . 0.0 110.706 177.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.27 168.91 1.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.879 3.053 . . . . 0.0 112.745 172.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -151.75 162.9 25.35 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.98 155.48 5.91 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.381 3.387 . . . . 0.0 113.406 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.77 164.04 35.68 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.774 2.983 . . . . 0.0 111.041 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -73.04 177.95 7.12 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.88 3.053 . . . . 0.0 111.262 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 18.6 m -134.06 16.55 3.83 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.709 0.803 . . . . 0.0 110.847 -178.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.95 -175.9 39.82 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -54.6 144.08 22.72 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 117.452 0.626 . . . . 0.0 110.853 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.446 ' HB3' ' HD2' ' A' ' 163' ' ' PRO . 8.0 m120 -67.7 162.85 54.18 Favored Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.464 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo -71.12 -12.42 30.23 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.584 2.189 . . . . 0.0 109.831 -174.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.485 ' CG ' HG13 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -133.09 151.14 52.04 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 30.9 t -166.05 163.27 18.23 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.619 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 122.48 175.62 14.77 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 123.835 0.731 . . . . 0.0 111.725 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -72.77 162.99 28.8 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 14.8 m -60.94 -13.81 18.44 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -119.74 13.99 12.5 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 122.561 0.344 . . . . 0.0 111.188 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -146.7 17.12 1.28 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -57.88 153.89 13.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.526 1.131 . . . . 0.0 110.904 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.485 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.8 m120 58.09 34.61 24.38 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.8 mt -138.05 -164.93 1.7 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.927 0.891 . . . . 0.0 109.813 -175.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.471 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 22.7 t-80 -146.08 -167.3 2.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.471 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.3 tp -139.95 7.78 2.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 117.827 0.285 . . . . 0.0 111.175 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 20.1 tp -151.62 16.11 0.69 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.92 0.488 . . . . 0.0 110.646 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -139.46 25.69 2.4 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.359 0.664 . . . . 0.0 111.388 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -64.31 -2.56 2.25 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -149.96 155.19 39.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.571 0.623 . . . . 0.0 109.858 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 -155.99 -9.58 0.11 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -70.69 150.6 45.8 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.74 -0.6 . . . . 0.0 110.726 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -157.55 -13.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.109 -177.575 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.034 -3.666 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 112.049 3.849 . 0.719 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.992 0 C4'-C3'-C2' 99.482 -3.218 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.075 -3.625 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.639 3.439 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C4'-C3'-C2' 99.152 -3.548 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.798 -3.902 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C4'-C3'-C2' 98.976 -3.724 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.38 0 C4'-C3'-C2' 99.187 -3.513 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C4'-C3'-C2' 99.565 -3.135 . 0.659 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 98.738 -3.962 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 C4'-C3'-C2' 98.596 -4.104 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 C4'-C3'-C2' 99.374 -3.326 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.572 0 C4'-C3'-C2' 99.761 -2.939 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 99.17 -3.53 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.15 -3.55 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.561 -3.139 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C4'-C3'-C2' 99.493 -3.207 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 O4'-C1'-N19 111.406 3.206 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 C4'-C3'-C2' 99.162 -3.538 . 0.676 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.457 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.182 -3.518 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.457 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.109 -3.591 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.922 1 O4'-C1'-N19 112.553 4.353 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 99.677 -3.023 . 0.759 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 110.924 2.724 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.941 0 C4'-C3'-C2' 98.717 -3.983 . 0.871 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.194 -3.506 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.069 0 C4'-C3'-C2' 99.556 -3.144 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.505 0 C4'-C3'-C2' 98.956 -3.744 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 C4'-C3'-C2' 99.719 -2.981 . 0.617 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.396 -3.304 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . 0.446 " H2'" ' C6 ' ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.852 0 C4'-C3'-C2' 99.136 -3.564 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . 0.446 ' C6 ' " H2'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.211 -3.489 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 C5'-C4'-C3' 111.444 -2.704 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.538 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.857 1 C5'-C4'-C3' 108.024 -4.984 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.538 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 3 P-O3'-C3' 125.004 4.42 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.407 -3.825 0 C4'-C3'-C2' 98.956 -3.744 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 100.115 -2.585 . 0.67 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.596 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.531 1 C4'-C3'-C2' 98.198 -4.502 . 0.706 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.441 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 111.675 3.475 . 0.622 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.441 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C5'-C4'-O4' 113.168 2.834 . 0.891 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 O4'-C1'-N19 111.729 3.529 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.316 -3.384 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 98.998 -3.702 . 0.913 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.063 1 C4'-C3'-C2' 98.544 -4.156 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.712 -2.988 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.185 0 C4'-C3'-C2' 99.155 -3.545 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 99.239 -3.461 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.096 1 O4'-C1'-N19 113.651 5.451 . 0.826 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C5'-C4'-O4' 113.465 3.046 . 0.369 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.354 0 O4'-C1'-N19 110.62 2.42 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.112 0 C4'-C3'-C2' 99.795 -2.905 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.289 1 C4'-C3'-C2' 98.079 -4.621 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.407 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.45 -3.25 . 0.461 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.407 ' C6 ' " H2'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 110.959 2.759 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.891 0 O4'-C1'-N19 111.875 3.675 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.895 3.695 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.152 0 O4'-C1'-N19 110.929 2.729 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 O4'-C1'-N19 111.362 3.162 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 98.704 -3.996 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C4'-C3'-C2' 99.152 -3.548 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 O4'-C1'-N19 110.871 2.671 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 110.976 2.776 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.26 0 C4'-C3'-C2' 99.2 -3.5 . 0.566 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C4'-C3'-C2' 98.984 -3.716 . 0.694 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C4'-C3'-C2' 98.953 -3.747 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.832 0 O4'-C1'-N19 112.009 3.809 . 0.836 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.718 -2.982 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.784 1 C4'-C3'-C2' 97.653 -5.047 . 0.74 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.973 1 O4'-C1'-N19 112.209 4.009 . 0.76 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.529 0.273 0 N-CA-C 113.042 0.362 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.48 176.44 44.71 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -52.49 -31.84 50.4 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 124.507 3.471 . . . . 0.0 114.991 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.3 p -154.32 -8.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.4 tp 44.45 70.42 1.95 Allowed Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.207 1.003 . . . . 0.0 111.589 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.62 -26.1 12.27 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 124.664 3.576 . . . . 0.0 113.956 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HB2' ' A' ' 66' ' ' LEU . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.619 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.619 ' N ' HD22 ' A' ' 20' ' ' LEU . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.606 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.614 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 31' ' ' VAL . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.614 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.448 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.409 HG21 ' CE2' ' A' ' 69' ' ' PHE . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 39' ' ' SER . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.446 ' O ' HG22 ' A' ' 53' ' ' THR . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 52' ' ' PRO 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.614 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.407 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CD2' ' HE3' ' A' ' 64' ' ' LYS . 5.9 t60 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.412 ' HE3' ' CD2' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HB2' HD11 ' A' ' 16' ' ' ILE . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -145.62 62.06 8.21 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -72.49 -23.0 20.63 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 124.088 3.192 . . . . 0.0 112.862 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -158.81 9.07 0.13 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.117 0.567 . . . . 0.0 110.627 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 170.96 5.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 122.936 0.494 . . . . 0.0 111.341 -178.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 46.2 m -109.36 -1.93 18.14 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.495 0.718 . . . . 0.0 110.965 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -76.11 16.89 0.39 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.644 0.778 . . . . 0.0 111.338 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -131.26 13.2 5.1 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.494 1.117 . . . . 0.0 110.578 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.8 t60 -146.16 170.94 15.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.16 0.984 . . . . 0.0 109.427 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.1 tp -153.33 155.87 37.3 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 122.233 -0.292 . . . . 0.0 110.976 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.09 16.56 1.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.147 0.579 . . . . 0.0 110.784 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.4 tpt -146.11 164.59 31.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.29 -167.64 34.06 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.31 -0.471 . . . . 0.0 112.611 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -137.76 -173.73 3.58 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.27 1.028 . . . . 0.0 108.697 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -140.28 164.49 29.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.511 0.672 . . . . 0.0 111.406 -178.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -153.48 -176.18 5.69 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.679 1.192 . . . . 0.0 110.143 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 t -140.66 -0.09 1.58 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.849 0.459 . . . . 0.0 111.565 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -66.31 143.57 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -156.68 156.24 33.1 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -162.01 176.37 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -59.86 158.73 10.09 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.154 0.582 . . . . 0.0 110.582 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.8 p90 -155.59 7.67 0.24 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -144.22 166.4 25.15 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.288 0.566 . . . . 0.0 110.752 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 95.0 p -161.79 -172.09 3.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.506 0.722 . . . . 0.0 110.52 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -123.21 9.17 9.19 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.876 0.471 . . . . 0.0 111.128 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 44.78 36.4 1.82 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.962 1.305 . . . . 0.0 113.007 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.28 166.66 1.1 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.209 0.528 . . . . 0.0 111.461 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -150.75 171.53 17.03 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.42 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -142.88 154.2 61.86 Favored Pre-proline 0 N--CA 1.454 -0.229 0 C-N-CA 124.155 0.982 . . . . 0.0 109.015 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.6 171.41 15.43 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.816 3.011 . . . . 0.0 111.922 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -151.82 28.36 0.61 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.032 0.533 . . . . 0.0 110.557 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.9 p -127.88 3.69 5.98 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.414 0.686 . . . . 0.0 111.456 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.2 173.31 14.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.543 0.737 . . . . 0.0 110.747 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.51 22.71 2.16 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.921 0.488 . . . . 0.0 111.113 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.7 t30 51.46 28.33 4.41 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.125 0.97 . . . . 0.0 111.237 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.16 -174.21 38.12 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -140.52 -178.33 5.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.189 0.595 . . . . 0.0 110.631 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -137.7 2.6 2.44 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.981 0.512 . . . . 0.0 110.808 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.3 p -69.89 157.83 88.74 Favored Pre-proline 0 N--CA 1.457 -0.122 0 O-C-N 122.007 -0.433 . . . . 0.0 110.774 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -72.97 179.04 5.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.972 2.448 . . . . 0.0 111.223 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -149.11 163.23 38.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.755 0.422 . . . . 0.0 109.872 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 97.0 mttt 50.34 17.66 0.36 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.578 1.151 . . . . 0.0 112.458 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 t -158.59 177.24 11.43 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.305 1.042 . . . . 0.0 108.621 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 41.01 56.76 8.47 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.859 1.263 . . . . 0.0 113.085 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.61 156.27 66.75 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.252 2.635 . . . . 0.0 111.112 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -77.36 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.422 3.414 . . . . 0.0 112.612 -177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.04 156.57 40.21 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.441 0.564 . . . . 0.0 110.991 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -160.73 173.6 15.17 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.702 0.801 . . . . 0.0 109.838 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.54 157.54 4.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.186 0.594 . . . . 0.0 109.484 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 122' ' ' ASN . . . 172.3 -171.07 44.03 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.7 m -69.29 20.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.083 0.953 . . . . 0.0 112.663 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 120' ' ' GLY . 39.7 p-10 -136.65 20.08 3.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 110.376 -176.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -161.82 -161.21 11.63 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -143.41 159.46 42.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -72.91 -6.46 45.31 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.5 m 51.59 24.83 2.47 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.857 0.863 . . . . 0.0 111.775 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 129' ' ' SER . 46.4 t80 -65.06 177.05 1.08 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.552 1.141 . . . . 0.0 111.29 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' SER . . . . . 0.42 ' N ' ' CG ' ' A' ' 127' ' ' PHE . 41.7 m -68.52 18.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.462 1.105 . . . . 0.0 112.318 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 127' ' ' PHE . 49.9 m -142.31 -172.02 3.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.589 1.156 . . . . 0.0 109.728 -177.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.3 t -134.55 13.21 3.76 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.84 0.856 . . . . 0.0 111.213 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 177.41 178.01 46.71 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -142.12 17.46 2.09 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.304 1.042 . . . . 0.0 110.263 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.8 14.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.159 0 C-N-CA 123.158 0.583 . . . . 0.0 110.716 -176.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 78.6 p -144.17 173.94 11.31 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.899 0.88 . . . . 0.0 110.936 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.05 166.22 7.93 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.071 0.548 . . . . 0.0 110.81 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 24.1 t -151.28 -179.61 7.5 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.524 1.13 . . . . 0.0 109.103 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.5 158.7 9.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.667 0.387 . . . . 0.0 111.569 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.5 p -156.63 164.79 20.37 Favored Pre-proline 0 N--CA 1.464 0.246 0 C-N-CA 123.819 0.848 . . . . 0.0 109.783 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.83 161.96 2.84 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.965 3.11 . . . . 0.0 113.247 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.6 p -153.81 144.29 15.8 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.38 -15.55 8.68 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.122 3.215 . . . . 0.0 115.431 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -68.59 169.84 10.31 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.267 0.485 . . . . 0.0 111.471 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.8 p -150.28 2.76 0.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.407 ' N ' HD22 ' A' ' 144' ' ' LEU . 3.7 mm? -70.48 159.94 33.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.606 -0.684 . . . . 0.0 109.509 177.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.3 p -142.56 3.5 1.49 Allowed 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -143.25 147.83 42.06 Favored Pre-proline 0 CA--C 1.531 0.222 0 O-C-N 121.715 -0.616 . . . . 0.0 109.733 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -79.02 169.25 19.55 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 123.574 2.85 . . . . 0.0 110.916 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.52 166.42 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.063 3.175 . . . . 0.0 112.404 171.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.401 ' N ' ' CD ' ' A' ' 150' ' ' PRO . 95.1 mt -141.04 47.12 0.99 Allowed Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 123.576 0.751 . . . . 0.0 112.071 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 149' ' ' LEU . 58.3 Cg_endo -67.38 149.32 80.63 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.535 2.157 . . . . 0.0 110.159 178.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 25.3 pt -147.51 49.86 0.84 Allowed Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 123.374 0.67 . . . . 0.0 112.54 -174.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.98 157.83 59.73 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 122.23 1.953 . . . . 0.0 110.542 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.06 122.97 10.1 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.374 2.716 . . . . 0.0 111.292 -174.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -85.2 8.9 4.36 Favored 'Trans proline' 0 N--CA 1.45 -1.046 0 C-N-CA 124.341 3.361 . . . . 0.0 111.985 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -54.44 132.84 62.81 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 118.445 0.566 . . . . 0.0 112.008 -174.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -78.91 167.9 21.52 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 123.696 2.931 . . . . 0.0 110.265 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.14 164.37 34.2 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 123.604 2.87 . . . . 0.0 109.835 175.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.25 162.75 41.17 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 123.301 2.667 . . . . 0.0 110.865 -178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 54.4 m -150.75 174.14 13.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.91 0.884 . . . . 0.0 110.071 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -176.55 22.98 0.05 OUTLIER Glycine 0 CA--C 1.529 0.941 0 CA-C-O 119.74 -0.478 . . . . 0.0 112.394 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -140.53 19.22 2.37 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-N 117.72 0.76 . . . . 0.0 111.827 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -50.06 112.91 3.02 Favored Pre-proline 0 CA--C 1.531 0.249 0 C-N-CA 123.37 0.668 . . . . 0.0 112.199 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.454 ' HA ' HD12 ' A' ' 166' ' ' ILE . 89.4 Cg_endo -83.42 -11.04 9.65 Favored 'Trans proline' 0 N--CA 1.443 -1.451 0 C-N-CA 124.008 3.139 . . . . 0.0 111.81 -172.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.424 HG11 H5'' ' B' ' 291' ' ' ' C' . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' MET . . . . . 0.432 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' A' ' 163' ' ' PRO . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG13 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.86 169.11 18.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 54.8 m -151.82 147.74 27.0 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 146.47 -174.36 26.38 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.86 12.11 3.39 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.445 0.698 . . . . 0.0 111.299 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 51.0 m 106.42 -8.61 0.01 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 127.78 2.432 . . . . 0.0 112.35 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -121.92 5.98 9.87 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.339 0.4 . . . . 0.0 111.327 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.66 17.04 1.01 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -58.28 143.33 44.99 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.197 1.399 . . . . 0.0 110.981 -174.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.2 m120 58.19 40.38 24.95 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.8 mt -135.77 -175.07 3.84 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.61 0.764 . . . . 0.0 110.844 -175.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -138.69 18.25 2.69 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 19.0 tp 55.55 29.43 13.43 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.474 0.71 . . . . 0.0 112.026 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 56.8 tp -148.68 137.46 21.43 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.061 0.545 . . . . 0.0 109.858 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -145.27 1.53 0.96 Allowed 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 123.358 0.411 . . . . 0.0 111.0 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -65.18 161.03 20.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.012 0.434 . . . . 0.0 110.722 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -156.89 173.29 17.22 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.64 0.776 . . . . 0.0 110.794 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -146.85 169.98 17.98 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 121.234 0.54 . . . . 0.0 110.29 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -146.89 8.47 0.97 Allowed 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.625 0.77 . . . . 0.0 110.536 178.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -152.97 173.39 15.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.488 0.715 . . . . 0.0 110.088 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.692 179.241 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 114.069 3.478 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 O4'-C1'-N19 111.342 3.142 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 100.244 -2.456 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.617 -3.083 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.568 0 O4'-C1'-N19 112.12 3.92 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 C4'-C3'-C2' 99.342 -3.358 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.633 0 C4'-C3'-C2' 99.03 -3.67 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 N19-C1'-C2' 108.769 -2.894 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.239 -3.461 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.366 -3.334 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 O4'-C1'-N19 111.26 3.06 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.224 0 C4'-C3'-C2' 99.144 -3.556 . 0.726 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 C4'-C3'-C2' 98.914 -3.786 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 99.929 -2.771 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C4'-C3'-C2' 98.73 -3.97 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.812 -2.888 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.397 -3.303 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.236 0 C4'-C3'-C2' 98.703 -3.997 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.012 -3.688 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.094 0 C4'-C3'-C2' 99.118 -3.582 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.242 -3.458 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C4'-C3'-C2' 99.629 -3.071 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.465 1 O4'-C1'-N19 112.363 4.163 . 0.729 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C5'-C4'-C3' 110.377 -3.415 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C4'-C3'-C2' 99.27 -3.43 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 C4'-C3'-C2' 99.625 -3.075 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 99.163 -3.537 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C4'-C3'-C2' 99.199 -3.501 . 0.875 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.51 -3.19 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 O4'-C1'-N19 111.474 3.274 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.445 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C4'-C3'-C2' 99.292 -3.408 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.686 -3.014 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C3'-C2'-C1' 104.347 3.163 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . 0.489 ' N2 ' ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.45 1 C5'-C4'-C3' 108.769 -4.487 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.518 " O5'" ' C6 ' ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C3'-C2'-C1' 104.626 3.473 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.505 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.994 3 P-O3'-C3' 125.007 4.423 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.627 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.541 0 C4'-C3'-C2' 98.913 -3.787 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.627 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.403 -4.15 1 N19-C1'-C2' 121.602 5.126 . 0.2 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C4'-C3'-C2' 99.465 -3.235 . 0.412 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . 0.417 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.274 0 C4'-C3'-C2' 99.027 -3.673 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.614 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.414 -3.234 0 C4'-C3'-C2' 99.992 -2.708 . 0.538 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.523 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 C4'-C3'-C2' 99.395 -3.305 . 0.92 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 98.877 -3.823 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.175 -3.525 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.108 -3.592 . 0.897 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.415 -3.285 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.335 -3.365 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.012 0 C4'-C3'-C2' 99.996 -2.704 . 0.904 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.212 0 C4'-C3'-C2' 99.971 -2.729 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.321 1 O4'-C1'-N19 112.815 4.615 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-O4' 113.549 3.106 . 0.589 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 110.614 2.414 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C4'-C3'-C2' 99.307 -3.393 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 98.946 -3.754 . 0.851 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.432 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C4'-C3'-C2' 99.416 -3.284 . 0.539 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 O4'-C1'-N19 111.862 3.662 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C4'-C3'-C2' 99.213 -3.487 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.369 -3.331 . 0.646 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 100.217 -2.483 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.977 0 C4'-C3'-C2' 99.376 -3.324 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.431 -3.269 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 O4'-C1'-N19 111.699 3.499 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.898 2.698 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.141 0 C4'-C3'-C2' 100.093 -2.607 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.442 0 C4'-C3'-C2' 99.277 -3.423 . 0.634 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.163 0 C4'-C3'-C2' 99.187 -3.513 . 0.682 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 1 C4'-C3'-C2' 98.631 -4.069 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C4'-C3'-C2' 99.183 -3.517 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C4'-C3'-C2' 99.95 -2.75 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.512 1 C4'-C3'-C2' 97.965 -4.735 . 0.782 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.472 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.003 1 O4'-C1'-N19 112.297 4.097 . 0.816 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.474 0.352 0 N-CA-C 112.587 0.187 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.89 -176.53 42.48 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.24 -14.12 3.91 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.836 3.69 . . . . 0.0 114.062 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -76.07 -20.02 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.822 0.449 . . . . 0.0 110.915 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.69 63.61 4.06 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.763 0.825 . . . . 0.0 109.217 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.58 -26.1 44.21 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.765 2.977 . . . . 0.0 113.452 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 66' ' ' LEU . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.682 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.672 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.603 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.542 ' CB ' HG22 ' A' ' 37' ' ' VAL . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.5 HG11 " H1'" ' B' ' 287' ' ' ' U' . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' HD2' HD21 ' A' ' 24' ' ' LEU . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.672 ' HG2' HD23 ' A' ' 24' ' ' LEU . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.518 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.602 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.456 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.628 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 16' ' ' ILE . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.734 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.408 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 22.5 m-85 -146.38 50.69 1.05 Allowed Pre-proline 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.734 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 79.0 Cg_endo -70.63 -24.77 25.33 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.329 3.352 . . . . 0.0 113.032 -176.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -161.01 11.38 0.09 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.454 0.57 . . . . 0.0 112.136 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.19 170.72 17.81 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.935 0.494 . . . . 0.0 111.078 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -140.51 23.77 2.3 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.222 1.009 . . . . 0.0 109.977 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -121.79 17.67 11.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.165 0.986 . . . . 0.0 110.5 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.64 -3.48 3.23 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.011 0.524 . . . . 0.0 112.29 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -69.86 7.99 0.8 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.892 0.877 . . . . 0.0 111.451 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.8 tp -131.57 14.46 4.95 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.542 1.137 . . . . 0.0 109.328 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.21 -178.61 5.93 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.915 0.886 . . . . 0.0 110.073 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -147.86 171.61 15.46 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 121.201 0.524 . . . . 0.0 110.74 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 177.9 -175.35 47.47 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -150.92 172.41 15.71 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.066 0.547 . . . . 0.0 110.453 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -148.05 176.79 9.9 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.885 0.874 . . . . 0.0 108.99 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -117.27 166.81 11.84 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.354 0.662 . . . . 0.0 110.373 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.1 t -151.83 -179.68 7.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.4 m -138.78 169.19 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.993 0.425 . . . . 0.0 111.218 -175.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.16 -174.47 4.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.271 1.028 . . . . 0.0 108.779 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.4 p -128.87 169.13 14.97 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.757 0.423 . . . . 0.0 110.026 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.71 166.41 32.26 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -151.97 174.96 13.01 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.33 0.652 . . . . 0.0 110.723 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -148.97 -176.85 5.5 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.631 0.772 . . . . 0.0 109.658 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.7 p -140.54 169.86 16.87 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.354 0.662 . . . . 0.0 110.332 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -153.22 168.25 26.62 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -148.49 149.73 32.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -158.22 -178.24 7.15 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.509 0.724 . . . . 0.0 109.55 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -150.46 149.06 29.5 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 122.93 0.492 . . . . 0.0 110.202 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.461 ' CD1' ' HD2' ' A' ' 100' ' ' PRO . 57.2 t80 -154.29 144.8 15.92 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.676 0.791 . . . . 0.0 109.425 -179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.461 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 67.3 Cg_endo -69.62 171.83 13.61 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.775 2.316 . . . . 0.0 111.74 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -150.28 168.51 23.85 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.138 0.575 . . . . 0.0 110.302 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.1 p -66.7 -5.44 11.86 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.268 0.627 . . . . 0.0 112.36 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.5 tp -152.15 147.54 26.56 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.437 0.695 . . . . 0.0 109.318 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -154.83 15.12 0.42 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.904 0.482 . . . . 0.0 110.811 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 50.46 33.33 7.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.965 0.506 . . . . 0.0 111.22 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -140.39 -174.66 14.01 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -145.3 179.9 7.08 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.779 0.431 . . . . 0.0 110.849 -173.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -149.09 161.75 41.32 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.8 m -138.76 73.02 41.23 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 123.6 0.76 . . . . 0.0 109.645 -177.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.72 9.55 1.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 124.903 3.735 . . . . 0.0 113.127 -173.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -140.05 163.63 32.18 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.423 0.556 . . . . 0.0 111.499 -178.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -72.51 1.39 8.17 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -177.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.8 m -59.41 163.81 3.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.449 0.7 . . . . 0.0 111.509 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.27 136.03 91.36 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -50.63 150.64 11.75 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.309 2.673 . . . . 0.0 112.976 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.38 3.27 6.45 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.255 3.303 . . . . 0.0 112.356 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -65.6 146.25 55.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 122.149 -0.345 . . . . 0.0 111.327 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -150.81 -174.11 4.68 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.966 0.907 . . . . 0.0 109.844 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -57.36 172.6 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 123.592 0.757 . . . . 0.0 112.263 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -151.35 -165.11 12.63 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -177.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 30.2 m -131.93 18.82 4.59 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.06 0.544 . . . . 0.0 112.146 -175.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 50.1 28.61 3.1 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.875 0.87 . . . . 0.0 112.21 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -156.59 29.36 0.56 Allowed Glycine 0 CA--C 1.53 0.998 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -142.65 165.24 27.92 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.76 0.824 . . . . 0.0 110.095 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.91 168.87 25.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.05 0.452 . . . . 0.0 110.582 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.8 p -157.24 -176.32 5.9 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.059 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -139.36 168.78 19.05 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.269 0.628 . . . . 0.0 109.564 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.3 p -149.12 8.92 0.74 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 26.8 t -64.84 -19.48 65.89 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.004 -0.435 . . . . 0.0 111.381 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 78.7 p -160.98 167.19 27.01 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.545 0.738 . . . . 0.0 109.808 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.12 -166.84 37.18 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -61.23 171.25 1.4 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.362 0.601 . . . . 0.0 110.652 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 9.9 p -134.56 13.7 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.064 0.546 . . . . 0.0 111.622 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.9 t -139.61 163.99 31.11 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.101 0.56 . . . . 0.0 110.295 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -151.63 12.77 0.62 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.323 0.649 . . . . 0.0 110.213 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 34.6 m -61.86 162.17 9.31 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.117 0.567 . . . . 0.0 111.45 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.83 -177.72 6.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.255 0.622 . . . . 0.0 109.815 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 t -150.95 145.52 18.26 Favored Pre-proline 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 109.591 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.54 -5.12 15.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.555 2.837 . . . . 0.0 112.478 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.8 m -146.04 159.67 45.57 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 122.96 0.504 . . . . 0.0 110.238 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.96 -11.4 3.63 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.996 3.131 . . . . 0.0 114.23 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.95 -178.14 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.57 1.148 . . . . 0.0 112.912 -175.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 78.5 p -143.36 6.62 1.5 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 32.9 tp -65.43 -9.23 23.69 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.903 0.481 . . . . 0.0 111.742 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 46.1 p -100.21 0.44 40.39 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.4 1.08 . . . . 0.0 111.096 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.481 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 28.1 pt20 -152.19 36.08 0.09 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.527 0.731 . . . . 0.0 112.793 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.481 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 90.9 Cg_endo -72.73 168.17 25.25 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.447 2.098 . . . . 0.0 109.895 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.15 140.37 49.19 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.263 1.975 . . . . 0.0 109.294 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 81.6 mt -147.82 158.28 42.74 Favored Pre-proline 0 N--CA 1.456 -0.147 0 C-N-CA 123.422 0.689 . . . . 0.0 110.511 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -71.57 174.21 11.33 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.535 2.823 . . . . 0.0 110.179 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 28.9 pt -141.91 157.98 63.15 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.642 0.777 . . . . 0.0 109.32 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 169.35 16.29 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.04 2.494 . . . . 0.0 111.07 177.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.95 161.46 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 124.629 3.552 . . . . 0.0 112.984 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.8 -0.08 6.43 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 123.56 2.84 . . . . 0.0 112.338 -178.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -141.64 144.81 34.66 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.28 150.12 34.32 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.497 2.798 . . . . 0.0 112.803 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.54 152.15 16.94 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 124.054 3.169 . . . . 0.0 112.66 175.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -75.18 1.24 8.04 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.787 2.991 . . . . 0.0 112.404 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.1 p -145.62 19.14 1.5 Allowed 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 123.363 0.665 . . . . 0.0 110.297 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -157.67 37.67 0.54 Allowed Glycine 0 C--N 1.335 0.508 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -175.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -54.38 -23.42 15.55 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.35 0.66 . . . . 0.0 112.21 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -148.27 151.03 36.18 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.194 0.598 . . . . 0.0 110.092 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.421 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 81.0 Cg_endo -75.18 -15.27 20.44 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.744 2.963 . . . . 0.0 110.806 178.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -121.88 168.71 11.56 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 24.4 m -151.95 31.45 0.56 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -170.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -153.89 169.14 32.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 119.269 0.941 . . . . 0.0 113.995 -178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -73.65 165.56 24.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.33 0.652 . . . . 0.0 111.127 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 21.9 m -60.1 -2.01 0.38 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -124.14 6.86 8.52 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 119.255 0.934 . . . . 0.0 111.463 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -149.53 17.3 0.91 Allowed 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -60.7 155.51 18.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.053 1.341 . . . . 0.0 112.802 -173.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.406 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.434 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.62 32.17 21.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.5 -171.28 2.51 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.436 0.694 . . . . 0.0 110.44 -175.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -142.76 21.32 1.98 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.521 0.2 . . . . 0.0 111.025 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 20.3 tp 63.59 11.82 6.01 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.534 1.134 . . . . 0.0 112.042 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.44 ' C ' HD12 ' A' ' 229' ' ' LEU . 3.1 pp -148.42 177.68 9.24 Favored 'General case' 0 C--N 1.342 0.267 0 O-C-N 121.586 -0.696 . . . . 0.0 110.987 176.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -149.34 177.6 9.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.412 0.685 . . . . 0.0 110.35 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -143.28 6.57 1.52 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.672 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -82.36 -14.65 54.93 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 119.58 -0.247 . . . . 0.0 111.238 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 44.32 25.65 0.13 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.458 1.103 . . . . 0.0 113.971 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -73.7 6.98 2.73 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.528 0.731 . . . . 0.0 112.155 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -139.25 16.55 2.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.866 -0.521 . . . . 0.0 110.898 -177.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.844 -177.295 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 98.79 -3.91 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.694 0 C4'-C3'-C2' 99.091 -3.609 . 0.701 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.373 -3.327 . 0.775 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.52 -3.18 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 O4'-C1'-N19 112.155 3.955 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.039 -3.661 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 98.803 -3.897 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.751 0 C4'-C3'-C2' 99.726 -2.974 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.606 -3.094 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.329 -3.371 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.877 3.677 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.747 3.547 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.742 0 C4'-C3'-C2' 99.41 -3.29 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.132 -3.568 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.099 -3.601 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.014 -3.686 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.242 -3.458 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C4'-C3'-C2' 99.123 -3.577 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.208 0 C4'-C3'-C2' 99.399 -3.301 . 0.759 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.449 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C4'-C3'-C2' 99.655 -3.045 . 0.834 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.449 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C4'-C3'-C2' 98.854 -3.846 . 0.876 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 2.207 1 O4'-C1'-N19 113.437 5.237 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 O4'-C1'-N19 111.548 3.348 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 1 C4'-C3'-C2' 98.697 -4.003 . 0.803 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C4'-C3'-C2' 98.34 -4.36 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 99.499 -3.201 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 C4'-C3'-C2' 99.265 -3.435 . 0.93 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.831 -2.869 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.417 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.375 -3.325 . 0.701 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.483 ' H3 ' ' H22' ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.611 -3.089 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . 0.482 " H2'" ' C6 ' ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.032 0 C4'-C3'-C2' 99.352 -3.348 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . 0.482 ' C6 ' " H2'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.948 1 C4'-C3'-C2' 98.172 -4.528 . 0.728 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.508 1 C5'-C4'-C3' 107.776 -5.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.54 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.038 1 P-O3'-C3' 125.131 4.526 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.54 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.411 -3.476 0 C3'-C2'-C1' 105.081 3.979 OUTLIER-DELTA 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.458 H5'' " H3'" ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.333 1 C4'-C3'-C2' 98.104 -4.596 . 0.0 OUTLIER beta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.437 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.118 0 C4'-C3'-C2' 99.432 -3.268 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C4'-C3'-C2' 99.277 -3.423 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 98.747 -3.953 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.628 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.412 -3.432 1 C4'-C3'-C2' 98.599 -4.101 . 0.626 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.488 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.089 2.889 . 0.873 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.202 1 C4'-C3'-C2' 98.095 -4.605 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C4'-C3'-C2' 99.949 -2.751 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.334 -3.366 . 0.878 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.075 0 C4'-C3'-C2' 99.362 -3.338 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.022 0 C4'-C3'-C2' 99.635 -3.065 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.404 -3.296 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.153 0 C4'-C3'-C2' 100.201 -2.499 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.938 1 O4'-C1'-N19 112.553 4.353 . 0.557 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.5 " H1'" HG11 ' A' ' 31' ' ' VAL . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.32 3.12 . 0.519 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.433 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C5'-C4'-C3' 111.311 -2.793 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.528 -3.172 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.926 0 O4'-C1'-N19 111.478 3.278 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 C4'-C3'-C2' 99.368 -3.332 . 0.436 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-O4' 113.033 2.738 . 0.621 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 99.05 -3.65 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O4'-C1'-N19 111.713 3.513 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 O4'-C1'-N19 111.477 3.277 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 99.0 -3.7 . 0.793 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.53 -3.17 . 0.665 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.131 1 O4'-C1'-N19 112.465 4.265 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 O4'-C1'-N19 111.774 3.574 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 99.808 -2.892 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.563 -3.137 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C4'-C3'-C2' 99.228 -3.472 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 98.797 -3.903 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.464 4.264 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C4'-C3'-C2' 99.415 -3.285 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.437 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 98.727 -3.973 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.437 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.821 3.621 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 N--CA 1.473 0.271 0 CA-C-O 120.462 0.109 . . . . 0.0 111.878 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 173.34 43.43 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -75.68 -179.74 5.43 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.95 3.767 . . . . 0.0 111.088 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.8 t -138.91 151.9 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 124.034 0.934 . . . . 0.0 108.89 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' N ' ' A' ' 5' ' ' LEU . 1.3 pt? -153.03 153.63 29.95 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.734 0.413 . . . . 0.0 110.903 -177.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.6 -12.66 29.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.419 2.746 . . . . 0.0 113.145 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.462 HD13 HD13 ' A' ' 66' ' ' LEU . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HD2' ' CD1' ' A' ' 20' ' ' LEU . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.683 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.526 ' H ' HD22 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.554 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.554 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.683 ' HG2' HD23 ' A' ' 24' ' ' LEU . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.519 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.645 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 16' ' ' ILE . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 47' ' ' PHE . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.774 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -145.15 58.76 5.42 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.774 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 86.8 Cg_endo -70.55 -9.02 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.235 1 C-N-CA 125.502 4.135 . . . . 0.0 112.514 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -154.07 171.47 19.05 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 122.929 0.492 . . . . 0.0 110.558 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.37 19.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.147 0.979 . . . . 0.0 112.217 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.8 p -140.07 -179.51 6.01 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.491 0.717 . . . . 0.0 111.14 -174.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.18 153.63 11.55 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.155 0.582 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.43 179.04 8.92 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.939 0.896 . . . . 0.0 110.409 -178.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -142.75 168.72 19.06 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 122.456 0.302 . . . . 0.0 110.418 -176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' C ' ' H ' ' A' ' 82' ' ' MET . 19.3 tp -147.8 23.62 1.1 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.939 0.496 . . . . 0.0 110.896 -177.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.42 15.3 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.071 0.948 . . . . 0.0 112.658 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' MET . . . . . 0.426 ' H ' ' C ' ' A' ' 80' ' ' LEU . 3.3 ppp? -138.83 12.56 2.68 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.538 0.735 . . . . 0.0 111.299 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -117.86 174.59 15.33 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.434 ' HG2' ' H ' ' A' ' 85' ' ' THR . 59.0 ttp85 -157.65 177.87 10.91 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.434 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 10.1 t -144.45 167.25 22.95 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 121.37 0.605 . . . . 0.0 110.287 177.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 pp -152.51 180.0 8.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.576 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.8 t -152.07 166.76 30.63 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 122.985 0.514 . . . . 0.0 110.496 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.9 m -145.75 -176.07 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.108 0 C-N-CA 123.749 0.82 . . . . 0.0 109.272 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -142.02 167.79 21.28 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 122.849 0.46 . . . . 0.0 111.184 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.7 p -142.31 6.34 1.7 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.565 0.746 . . . . 0.0 111.044 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -151.14 149.31 29.32 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.55 0.74 . . . . 0.0 109.206 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -160.37 174.38 14.23 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 59.8 p -77.42 12.78 1.41 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.964 0.905 . . . . 0.0 112.367 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 37.5 t -57.97 164.59 2.18 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.61 0.764 . . . . 0.0 111.408 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -142.66 4.79 1.54 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.693 0.797 . . . . 0.0 111.37 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.47 -1.43 6.57 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.392 0.677 . . . . 0.0 111.017 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.53 9.7 1.0 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.938 0.895 . . . . 0.0 113.342 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 55.0 -166.89 0.09 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.073 0.949 . . . . 0.0 112.09 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -139.63 155.5 71.57 Favored Pre-proline 0 C--N 1.341 0.2 0 C-N-CA 123.419 0.688 . . . . 0.0 109.891 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -70.36 173.39 11.57 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 124.257 3.305 . . . . 0.0 111.632 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.23 174.39 12.44 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.085 0.554 . . . . 0.0 110.701 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 75.9 p -142.62 15.36 1.98 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.629 0.772 . . . . 0.0 111.225 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 49.0 tp -57.71 151.29 17.77 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.89 0.376 . . . . 0.0 110.968 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -151.73 164.52 36.8 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.543 0.737 . . . . 0.0 109.686 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 48.6 p30 -154.95 179.06 9.49 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 122.828 0.451 . . . . 0.0 110.729 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.59 -170.67 39.44 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -142.64 169.37 17.7 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.144 0.497 . . . . 0.0 111.445 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -152.88 165.68 34.69 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 58.2 p -57.03 154.56 19.04 Favored Pre-proline 0 C--O 1.233 0.227 0 O-C-N 121.75 -0.594 . . . . 0.0 110.599 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.89 162.43 2.59 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.572 2.848 . . . . 0.0 113.319 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -150.88 158.42 44.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.713 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -146.3 -176.09 5.03 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.687 0.795 . . . . 0.0 109.946 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.1 m -137.76 23.59 2.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.141 0.576 . . . . 0.0 111.607 -176.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.54 153.67 28.21 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.437 0.295 . . . . 0.0 110.648 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.49 163.35 38.39 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.538 2.825 . . . . 0.0 111.423 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.06 120.38 4.19 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.815 3.677 . . . . 0.0 112.941 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -156.03 8.79 0.24 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.997 0.519 . . . . 0.0 110.8 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -151.62 175.27 12.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.351 1.06 . . . . 0.0 109.632 -176.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.1 m -141.77 172.35 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 C-N-CA 123.538 0.735 . . . . 0.0 109.548 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -168.97 -13.46 0.02 OUTLIER Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -72.1 0.08 10.49 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.461 0.63 . . . . 0.0 111.586 174.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -152.41 166.83 30.7 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.176 0.59 . . . . 0.0 110.275 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.22 -2.03 0.03 OUTLIER Glycine 0 CA--C 1.525 0.695 0 C-N-CA 123.7 0.666 . . . . 0.0 112.264 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -72.17 -3.88 25.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 117.412 0.606 . . . . 0.0 112.034 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -60.93 140.12 57.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.274 0.488 . . . . 0.0 109.693 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.0 p -91.68 -3.3 56.45 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.088 0.555 . . . . 0.0 110.906 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 49.45 27.56 2.07 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.111 0.965 . . . . 0.0 112.111 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.8 m 50.34 25.07 1.71 Allowed 'General case' 0 C--N 1.342 0.271 0 C-N-CA 124.286 1.035 . . . . 0.0 112.012 -177.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.8 m -139.36 8.65 2.44 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.642 0.777 . . . . 0.0 111.923 -178.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 86.1 p 44.37 30.28 0.46 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.666 1.186 . . . . 0.0 112.829 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -166.18 -168.05 27.76 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.72 163.57 32.53 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.685 0.394 . . . . 0.0 110.229 -176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.52 169.54 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 123.541 0.736 . . . . 0.0 111.754 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.8 p -151.59 22.4 0.71 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.976 0.911 . . . . 0.0 109.675 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.9 tp -131.37 5.91 4.44 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.424 0.69 . . . . 0.0 110.54 -173.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.7 p -151.46 163.02 39.93 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.411 0.684 . . . . 0.0 110.629 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.44 168.7 25.79 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.477 0.311 . . . . 0.0 110.902 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 69.3 m -145.17 163.66 31.27 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.213 0.605 . . . . 0.0 109.993 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -50.53 160.27 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 124.38 3.386 . . . . 0.0 113.401 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.508 ' N ' ' HD3' ' A' ' 141' ' ' PRO . 27.5 m -138.45 38.08 0.33 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.508 ' HD3' ' N ' ' A' ' 140' ' ' VAL . 71.3 Cg_exo -48.17 162.54 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.753 2.302 . . . . 0.0 112.559 173.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.18 2.38 1.69 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.435 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 17.3 t -155.22 -175.22 5.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 177.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 26.4 tp -155.93 169.68 23.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.464 0.706 . . . . 0.0 109.934 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 3.0 m 52.97 35.15 18.55 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.956 0.902 . . . . 0.0 112.18 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -145.39 158.12 51.5 Favored Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 122.089 -0.382 . . . . 0.0 110.337 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.67 164.46 35.36 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.171 2.581 . . . . 0.0 109.902 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.11 179.18 5.15 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 124.013 3.142 . . . . 0.0 110.676 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 23.2 tp -145.39 136.6 12.59 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -51.52 155.75 6.99 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 123.409 2.74 . . . . 0.0 112.666 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 10.1 tp -64.81 140.47 98.07 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.851 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -54.12 166.71 1.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.4 2.734 . . . . 0.0 111.108 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.53 156.1 54.28 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.394 2.063 . . . . 0.0 110.672 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.83 -176.99 1.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.547 2.831 . . . . 0.0 111.735 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -129.44 153.8 80.65 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 109.689 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.49 135.34 47.56 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.767 . . . . 0.0 111.598 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 159' ' ' SER . 89.3 Cg_endo -76.27 174.0 13.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.795 2.997 . . . . 0.0 109.64 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.48 7.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.464 1 C-N-CA 125.485 4.124 . . . . 0.0 114.331 172.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 157' ' ' PRO . 86.1 p -147.54 -175.94 5.05 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.582 0.753 . . . . 0.0 109.502 -177.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.65 169.2 40.55 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.024 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.2 mtmm -142.6 16.57 2.0 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.808 0.443 . . . . 0.0 110.828 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 43.6 t30 46.79 81.7 0.25 Allowed Pre-proline 0 C--O 1.234 0.28 0 C-N-CA 124.384 1.073 . . . . 0.0 111.356 -175.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HB3' HD21 ' A' ' 228' ' ' LEU . 88.8 Cg_endo -79.7 -13.23 13.29 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.766 3.644 . . . . 0.0 110.455 -169.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.429 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.407 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.448 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.4 168.49 18.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 88.6 p -162.86 164.92 25.8 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.826 0.85 . . . . 0.0 110.01 177.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 119.48 -156.1 15.89 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.614 -0.594 . . . . 0.0 111.614 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.08 172.1 11.73 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.969 1.308 . . . . 0.0 108.816 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.2 m -60.45 -8.12 2.52 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -175.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -125.58 11.17 7.91 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.896 0.478 . . . . 0.0 111.11 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -152.14 16.68 0.65 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.436 0.295 . . . . 0.0 110.542 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -57.87 153.37 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.171 0.988 . . . . 0.0 111.106 -177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.448 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.425 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.463 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.9 m120 58.1 42.22 22.68 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.3 mt -136.84 -168.54 2.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.151 0.98 . . . . 0.0 110.953 -175.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -136.51 162.99 31.56 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.481 HD21 ' HB3' ' A' ' 163' ' ' PRO . 14.1 tp -152.93 29.71 0.51 Allowed 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.801 -169.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.461 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 37.4 tp -140.67 166.21 25.36 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.744 0.817 . . . . 0.0 109.054 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -137.31 6.57 2.81 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 231' ' ' HIS . . . . . 0.461 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 28.1 t-80 -63.17 153.69 33.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -68.23 163.73 22.14 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 -156.95 174.46 15.48 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.075 0.464 . . . . 0.0 110.704 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -149.37 173.48 13.48 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.422 0.689 . . . . 0.0 109.661 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -151.33 171.67 17.11 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.717 0.294 . . . . 0.0 110.98 -176.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.0 t60 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 116.983 -1.484 . . . . 0.0 109.513 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 C5'-C4'-O4' 113.993 3.423 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 O4'-C1'-N19 111.856 3.656 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C4'-C3'-C2' 99.084 -3.616 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.182 -3.518 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 O4'-C1'-N19 112.299 4.099 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 98.839 -3.861 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 98.946 -3.754 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.775 -2.925 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.847 0 C4'-C3'-C2' 99.879 -2.821 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.512 -3.188 . 0.569 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 99.28 -3.42 . 0.865 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.094 -3.606 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 N19-C1'-C2' 109.021 -2.737 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.928 0 C4'-C3'-C2' 99.368 -3.332 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.564 0 C4'-C3'-C2' 99.453 -3.247 . 0.67 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.533 3.333 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.0 0 C4'-C3'-C2' 99.816 -2.884 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.642 0 C4'-C3'-C2' 99.633 -3.067 . 0.764 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.397 -3.303 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 99.208 -3.492 . 0.766 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.452 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.793 -2.907 . 0.869 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.452 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.626 -3.074 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 1 O4'-C1'-N19 112.585 4.385 . 0.712 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C4'-C3'-C2' 99.838 -2.862 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.605 0 C4'-C3'-C2' 99.414 -3.286 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.316 -3.384 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C4'-C3'-C2' 98.63 -4.07 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 99.426 -3.274 . 0.896 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 99.869 -2.831 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.411 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.682 -3.018 . 0.776 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.411 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 O4'-C1'-N19 111.568 3.368 . 0.743 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.465 -3.235 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.213 0 C4'-C3'-C2' 99.428 -3.272 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.139 0 N19-C1'-C2' 108.36 -3.15 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.487 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.62 2.728 1 C4'-C3'-O3' 121.225 4.087 OUTLIER-EPSILON 0.112 1a . 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.529 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.642 3 C3'-C2'-C1' 105.963 4.959 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.407 -3.861 0 C4'-C3'-C2' 100.128 -2.572 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.13 -3.57 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.618 2.521 0 C4'-C3'-C2' 99.421 -3.279 . 0.591 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . 0.406 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 P--O5' 1.616 2.303 0 C4'-C3'-C2' 99.512 -3.188 . 0.659 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.645 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.042 -3.658 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.477 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.22 -3.48 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.071 1 C4'-C3'-C2' 97.998 -4.702 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.19 -3.51 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 98.891 -3.809 . 0.9 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.091 -3.609 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 0 C4'-C3'-C2' 99.926 -2.774 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.105 0 C4'-C3'-C2' 99.337 -3.363 . 0.877 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 100.364 -2.336 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.821 4.621 . 0.585 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.845 0 O4'-C1'-N19 111.596 3.396 . 0.603 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C4'-C3'-C2' 100.455 -2.245 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.382 3.182 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 99.2 -3.5 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.411 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 C4'-C3'-C2' 99.618 -3.082 . 0.51 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.425 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-C3' 111.219 -2.854 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.401 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.363 -3.337 . 0.678 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.995 -3.705 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 99.359 -3.341 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.389 -3.311 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.51 0 C4'-C3'-C2' 98.932 -3.768 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.018 -3.682 . 0.664 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.481 3.281 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . 0.437 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C4'-C3'-C2' 99.745 -2.955 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . 0.437 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.266 -3.434 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C4'-C3'-C2' 99.026 -3.674 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.015 -3.685 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 1 O4'-C1'-N19 112.393 4.193 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 O4'-C1'-N19 111.578 3.378 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.417 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.89 1 C4'-C3'-C2' 97.904 -4.796 . 0.752 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.417 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.908 0 O4'-C1'-N19 112.183 3.983 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 112.791 0.266 . . . . 0.0 112.791 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.9 177.06 48.36 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.11 154.56 62.23 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.511 2.808 . . . . 0.0 111.223 -178.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.81 7.46 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.336 0.654 . . . . 0.0 109.966 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.18 155.92 34.97 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.72 0.808 . . . . 0.0 109.566 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -73.82 -14.69 24.14 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.394 2.73 . . . . 0.0 112.344 -175.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 20' ' ' LEU . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.689 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.689 ' N ' HD22 ' A' ' 20' ' ' LEU . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.632 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.565 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.565 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.632 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.501 ' CG2' HD23 ' A' ' 20' ' ' LEU . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 20' ' ' LEU . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.6 t30 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.588 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.48 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.419 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -148.62 64.07 7.52 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.21 -4.11 14.84 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 124.043 3.162 . . . . 0.0 111.462 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -150.54 29.45 0.69 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.057 0.543 . . . . 0.0 110.747 -176.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 62.39 16.32 8.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.139 0.976 . . . . 0.0 113.498 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.2 m -141.35 167.27 22.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.7 143.71 55.75 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.722 0.296 . . . . 0.0 110.448 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -156.97 9.16 0.2 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.177 0.591 . . . . 0.0 111.452 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -155.29 168.45 27.01 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 121.969 -0.457 . . . . 0.0 110.74 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 80' ' ' LEU . 3.3 mm? -70.48 -174.68 0.9 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.797 0.839 . . . . 0.0 109.66 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.08 155.92 49.03 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.09 0.471 . . . . 0.0 109.944 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.9 mtm -147.66 166.18 28.21 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 171.08 177.89 41.23 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -152.63 167.36 29.15 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 124.201 1.0 . . . . 0.0 110.537 177.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.0 p -142.6 177.84 8.02 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 122.866 0.466 . . . . 0.0 111.084 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.401 ' H ' HD23 ' A' ' 86' ' ' LEU . 1.7 pt? -149.4 -178.63 6.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.878 0.871 . . . . 0.0 110.7 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.3 m -132.21 26.52 4.52 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 122.996 0.518 . . . . 0.0 111.464 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.0 p -56.88 155.92 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.43 0.692 . . . . 0.0 110.877 179.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -139.25 7.27 2.39 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.283 0.633 . . . . 0.0 111.351 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.6 p -72.63 -5.19 35.69 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.882 0.473 . . . . 0.0 111.426 177.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 49.98 28.89 3.12 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.08 0.952 . . . . 0.0 112.031 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -145.24 160.59 41.24 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 121.974 -0.454 . . . . 0.0 111.171 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.6 m -69.2 167.47 16.17 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.133 0.973 . . . . 0.0 111.373 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.4 p -146.35 175.42 10.54 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.229 0.612 . . . . 0.0 109.879 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -155.48 168.19 27.93 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.176 0.59 . . . . 0.0 110.693 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -70.59 -3.76 19.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.996 0.518 . . . . 0.0 111.776 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.96 163.74 5.58 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.567 0.747 . . . . 0.0 111.874 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -95.94 -0.5 50.68 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.76 0.424 . . . . 0.0 111.847 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 39.01 59.19 5.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 123.956 0.902 . . . . 0.0 112.726 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.95 172.48 11.77 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.833 3.022 . . . . 0.0 110.137 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -149.28 174.57 12.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.432 0.293 . . . . 0.0 110.99 -176.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -150.76 168.09 25.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.889 178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.77 -3.26 55.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.995 0.518 . . . . 0.0 110.829 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 50.55 17.5 0.38 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.097 1.359 . . . . 0.0 113.349 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -146.02 167.95 22.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.933 0.893 . . . . 0.0 109.894 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 174.03 -170.05 43.14 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -145.12 166.2 26.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.472 0.709 . . . . 0.0 110.059 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -149.26 162.96 38.98 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.903 0.481 . . . . 0.0 110.036 -175.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.7 t -148.25 145.33 20.29 Favored Pre-proline 0 N--CA 1.451 -0.384 0 C-N-CA 123.381 0.672 . . . . 0.0 110.113 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.01 6.64 3.69 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 124.049 3.166 . . . . 0.0 111.823 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.06 145.46 16.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.105 0.411 . . . . 0.0 111.787 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -158.35 153.52 25.54 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.6 m -143.52 165.87 26.36 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.935 0.398 . . . . 0.0 111.057 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -146.87 138.72 13.53 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -177.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.72 166.52 25.83 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.04 2.493 . . . . 0.0 111.314 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.67 -174.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 1 C-N-CA 125.523 4.149 . . . . 0.0 113.877 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -131.12 -179.52 5.39 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.218 -178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -133.54 4.53 3.66 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.867 0.467 . . . . 0.0 111.804 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.2 p -158.33 162.53 1.41 Allowed 'Isoleucine or valine' 0 CA--C 1.526 0.057 0 C-N-CA 124.471 1.108 . . . . 0.0 108.296 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 171.58 -0.8 0.03 OUTLIER Glycine 0 CA--C 1.525 0.68 0 CA-C-O 119.704 -0.498 . . . . 0.0 113.493 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.4 t -152.55 165.94 33.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 110.612 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -153.1 10.8 0.46 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.103 0.561 . . . . 0.0 110.392 -179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.65 22.69 0.13 Allowed Glycine 0 CA--C 1.529 0.922 0 O-C-N 121.638 -0.664 . . . . 0.0 112.625 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -141.67 13.36 2.12 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 117.716 0.758 . . . . 0.0 111.518 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -152.68 163.12 40.28 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.071 0.548 . . . . 0.0 109.723 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 32.3 t -151.92 165.72 33.7 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.933 0.493 . . . . 0.0 110.115 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -155.8 174.14 15.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.223 0.609 . . . . 0.0 110.337 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 47.84 27.77 1.2 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.052 0.941 . . . . 0.0 113.059 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 50.9 m -142.98 178.37 7.73 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.084 0.554 . . . . 0.0 110.62 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -149.02 176.09 10.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.453 ' C ' ' H ' ' A' ' 133' ' ' VAL . . . 178.41 -171.16 43.45 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -175.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.08 24.04 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.904 1.282 . . . . 0.0 112.164 178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.453 ' H ' ' C ' ' A' ' 131' ' ' GLY . 27.5 m -124.13 -1.54 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.746 0.819 . . . . 0.0 111.533 -177.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.4 m 41.55 39.51 1.12 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.11 -10.87 7.0 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 26.5 t -157.54 170.48 22.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -146.34 3.78 0.9 Allowed 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.084 0.554 . . . . 0.0 111.015 179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.438 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 42.2 m -145.98 41.15 0.28 Allowed Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 123.59 0.756 . . . . 0.0 111.715 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 138' ' ' SER . 45.0 Cg_endo -78.81 4.32 6.56 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.649 2.233 . . . . 0.0 112.38 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 42.3 t -56.04 -43.73 99.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.48 10.04 3.2 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 123.213 2.608 . . . . 0.0 111.448 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.57 20.49 2.36 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.402 0.681 . . . . 0.0 110.991 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 77.5 p -64.53 -4.27 3.89 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.269 0.627 . . . . 0.0 111.936 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 tp -147.78 151.15 35.54 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.7 p -146.87 173.22 12.61 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.337 0.655 . . . . 0.0 110.168 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.42 ' N ' ' HD3' ' A' ' 147' ' ' PRO . 77.5 mt-30 -141.35 61.97 14.81 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 122.836 0.454 . . . . 0.0 111.041 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 146' ' ' GLN . 76.8 Cg_exo -50.74 156.22 4.75 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.728 2.952 . . . . 0.0 112.826 177.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.34 172.95 13.91 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.529 2.819 . . . . 0.0 109.976 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.5 tp -146.97 71.5 12.28 Favored Pre-proline 0 CA--C 1.535 0.378 0 O-C-N 121.941 -0.474 . . . . 0.0 111.47 -178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.06 163.88 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.638 2.892 . . . . 0.0 111.353 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.1 tt -148.55 141.15 15.07 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 122.562 0.345 . . . . 0.0 110.468 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.78 166.31 2.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.527 2.818 . . . . 0.0 112.239 172.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -51.59 148.84 19.81 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.698 2.932 . . . . 0.0 112.133 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -74.63 174.64 12.29 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.681 2.921 . . . . 0.0 110.995 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -60.61 158.04 33.53 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.55 145.76 28.4 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.585 2.857 . . . . 0.0 112.472 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.47 161.7 41.8 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.812 3.008 . . . . 0.0 110.851 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.67 -13.8 19.94 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.969 3.113 . . . . 0.0 111.221 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 87.7 p -156.48 176.11 13.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.084 0.554 . . . . 0.0 110.35 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -175.08 170.68 43.82 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.45 163.84 36.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.11 0.564 . . . . 0.0 110.944 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -69.44 117.72 55.44 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 123.078 0.551 . . . . 0.0 110.23 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.08 -13.44 11.37 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 124.456 3.437 . . . . 0.0 111.913 -171.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.507 ' CG ' HG13 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -76.98 176.85 8.25 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 68.3 m -145.52 27.67 1.22 Allowed 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.432 0.693 . . . . 0.0 111.354 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.37 -171.02 14.68 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -139.56 0.82 1.88 Allowed 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.167 -0.921 . . . . 0.0 113.091 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 69.1 m 114.46 -10.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.849 2.46 . . . . 0.0 111.628 174.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -86.96 -32.17 20.24 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -144.7 151.86 39.54 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm -153.39 147.6 25.75 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 119.813 -0.755 . . . . 0.0 112.389 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 190' ' ' PHE . . . . . 0.428 ' CZ ' " H5'" ' B' ' 247' ' ' ' U' . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 210' ' ' LEU . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.473 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 210' ' ' LEU . . . . . 0.438 HD12 ' HA3' ' A' ' 205' ' ' GLY . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.3 m120 56.22 31.79 19.08 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 78.8 mt -139.26 -168.9 2.55 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.565 1.146 . . . . 0.0 110.097 -174.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -148.87 171.49 16.22 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.973 -0.455 . . . . 0.0 110.025 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.45 9.75 0.75 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.214 1.006 . . . . 0.0 111.822 -179.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 50.6 tp -140.93 146.64 37.66 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.292 0.637 . . . . 0.0 109.838 178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -139.83 20.79 2.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.796 0.838 . . . . 0.0 109.749 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 62.1 m80 -140.42 -177.98 5.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.0 0.52 . . . . 0.0 110.069 -174.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -143.74 28.57 1.43 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.478 0.711 . . . . 0.0 109.96 -175.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -69.27 -2.98 12.06 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -64.19 168.38 5.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.88 0.472 . . . . 0.0 110.998 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -70.56 -7.59 45.04 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.165 0.586 . . . . 0.0 112.089 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.635 -1.174 . . . . 0.0 110.54 -178.934 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.92 1 C4'-C3'-C2' 98.627 -4.073 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 99.186 -3.514 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 O4'-C1'-N19 110.891 2.691 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 98.74 -3.96 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.385 1 O4'-C1'-N19 112.209 4.009 . 0.687 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.568 3.368 . 0.756 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.817 3.617 . 0.609 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.347 -3.353 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.216 0 N19-C1'-C2' 108.196 -3.253 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . 0.428 " H5'" ' CZ ' ' A' ' 190' ' ' PHE . . . . . . . . 0 O4'--C4' 1.416 -3.048 0 O4'-C1'-N19 111.38 3.18 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.133 -3.567 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.898 0 C4'-C3'-C2' 99.283 -3.417 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C4'-C3'-C2' 100.098 -2.602 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.551 0 C4'-C3'-C2' 98.802 -3.898 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.569 -3.131 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.417 -3.283 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.132 -3.568 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C4'-C3'-C2' 100.047 -2.653 . 0.632 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.721 -2.979 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.432 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.207 0 C4'-C3'-C2' 99.789 -2.911 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.432 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C4'-C3'-C2' 98.789 -3.911 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 O4'-C1'-N19 112.25 4.05 . 0.728 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.006 0 C4'-C3'-C2' 99.017 -3.683 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 C4'-C3'-C2' 98.581 -4.119 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 1 C4'-C3'-C2' 98.58 -4.12 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.072 0 C4'-C3'-C2' 99.513 -3.187 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.537 -3.163 . 0.912 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.875 0 C4'-C3'-C2' 99.76 -2.94 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.429 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.377 3.177 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.429 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.862 3.662 . 0.624 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.368 -3.332 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.125 -3.575 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.04 0 N19-C1'-C2' 108.461 -3.087 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.485 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 2 C4'-C3'-O3' 121.535 4.206 . 0.328 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.485 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.415 -3.15 1 P-O3'-C3' 125.075 4.479 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.036 1 C4'-C3'-C2' 98.438 -4.262 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 O4'-C1'-N19 111.416 3.216 . 0.581 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.196 0 C4'-C3'-C2' 99.135 -3.565 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 O4'-C1'-N19 111.677 3.477 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.588 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.625 0 C4'-C3'-C2' 99.109 -3.591 . 0.694 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.481 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 98.926 -3.774 . 0.912 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.01 1 C4'-C3'-C2' 98.607 -4.093 . 0.833 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.552 0 C4'-C3'-C2' 99.481 -3.219 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 1 C4'-C3'-C2' 98.57 -4.13 . 0.883 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 98.88 -3.82 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.589 -3.111 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 C4'-C3'-C2' 99.896 -2.804 . 0.933 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.824 -2.876 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 1 O4'-C1'-N19 113.46 5.26 . 0.519 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.438 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.623 3.007 0 C5'-C4'-O4' 113.788 3.277 . 0.475 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.438 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C5'-C4'-C3' 111.155 -2.897 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.218 0 C4'-C3'-C2' 99.001 -3.699 . 0.836 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.346 2 O4'-C1'-N19 112.419 4.219 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.402 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 110.815 2.615 . 0.404 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.473 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 O4'-C1'-N19 111.335 3.135 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.401 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.023 -3.677 . 0.746 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.77 3.57 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 O4'-C1'-N19 111.145 2.945 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.954 -3.746 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.113 -3.587 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C4'-C3'-C2' 99.119 -3.581 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 100.169 -2.531 . 0.866 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 99.828 -2.872 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.44 0 C4'-C3'-C2' 98.989 -3.711 . 0.528 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.456 0 C4'-C3'-C2' 99.06 -3.64 . 0.637 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.245 -3.455 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 112.154 3.954 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C4'-C3'-C2' 99.531 -3.169 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.456 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 97.968 -4.732 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.456 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.353 0 O4'-C1'-N19 111.882 3.682 . 0.73 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 CA--C 1.529 0.257 0 CA-C-O 120.36 0.067 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.93 54.72 0.12 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.511 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.31 155.96 65.91 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.449 2.766 . . . . 0.0 111.142 -176.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.7 p -159.4 151.81 6.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 123.267 0.627 . . . . 0.0 109.348 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -160.85 162.66 22.33 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 122.834 0.454 . . . . 0.0 109.92 178.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.11 -39.61 79.55 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.246 2.63 . . . . 0.0 114.338 -178.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 16' ' ' ILE . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 HD13 ' A' ' 66' ' ' LEU . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.677 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.677 ' N ' HD22 ' A' ' 20' ' ' LEU . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.537 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.537 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.64 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.415 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.64 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.468 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.467 HG23 HD23 ' A' ' 20' ' ' LEU . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.434 ' HB2' HD11 ' A' ' 35' ' ' LEU . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.579 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.424 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 16' ' ' ILE . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 66' ' ' LEU . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -148.03 63.68 7.65 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -69.88 -42.58 3.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.248 2.632 . . . . 0.0 110.712 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -173.25 -18.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.732 0.813 . . . . 0.0 110.637 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -153.83 -176.34 5.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.254 0.621 . . . . 0.0 110.93 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.3 p -67.84 20.12 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.715 1.606 . . . . 0.0 113.757 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.25 -14.45 11.09 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.607 0.64 . . . . 0.0 112.343 -177.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.07 -16.75 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.856 0.462 . . . . 0.0 111.71 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -75.37 -0.36 19.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.22 0.608 . . . . 0.0 111.332 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.2 mt -131.73 22.1 4.63 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.055 0.942 . . . . 0.0 109.657 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.73 -178.6 6.18 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.24 1.016 . . . . 0.0 110.3 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -58.97 165.19 2.53 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.218 0.533 . . . . 0.0 111.817 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -171.16 -173.13 37.98 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -56.46 158.01 4.68 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.642 0.777 . . . . 0.0 112.584 -178.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.8 m -149.65 152.94 36.23 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.205 1.002 . . . . 0.0 108.737 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.9 tp -152.63 137.71 17.31 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.5 t -155.55 7.66 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.274 0.358 . . . . 0.0 111.24 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.51 142.25 15.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.105 0 CA-C-O 120.944 0.402 . . . . 0.0 110.678 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -151.24 17.62 0.74 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.344 0.658 . . . . 0.0 110.673 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.4 p -140.27 -179.56 6.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.506 1.122 . . . . 0.0 110.868 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -145.22 168.41 20.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.461 0.705 . . . . 0.0 109.815 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.51 159.11 10.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.27 0.557 . . . . 0.0 111.163 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.4 p -73.1 171.49 12.82 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.196 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.7 m -79.87 11.1 3.49 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.122 0.569 . . . . 0.0 111.835 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.56 167.92 2.41 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.356 1.063 . . . . 0.0 111.378 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -146.05 152.96 40.18 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.93 15.86 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -141.84 143.48 33.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.946 0.499 . . . . 0.0 110.126 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -157.48 165.79 17.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 122.949 0.5 . . . . 0.0 109.957 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.91 173.93 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.675 3.583 . . . . 0.0 115.19 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -130.86 17.19 5.18 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.95 0.9 . . . . 0.0 110.248 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 41.0 p -131.94 15.35 4.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.93 0.892 . . . . 0.0 109.93 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp -149.95 165.92 31.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.041 0.936 . . . . 0.0 108.918 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -150.27 166.79 28.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.624 0.25 . . . . 0.0 111.032 -176.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -152.67 -15.48 0.16 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 156.23 -1.6 0.15 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.645 -0.66 . . . . 0.0 112.996 -177.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -71.46 23.8 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.071 0.949 . . . . 0.0 112.415 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 60.35 6.35 1.02 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.123 0.969 . . . . 0.0 112.566 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.524 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 27.3 p -78.63 -13.65 0.21 Allowed Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 115.713 1.745 . . . . 0.0 115.713 175.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 109' ' ' THR . 55.6 Cg_exo -52.4 -14.73 3.19 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.093 2.529 . . . . 0.0 115.272 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.4 124.37 20.44 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.243 0.474 . . . . 0.0 110.782 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -159.04 174.36 15.04 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.591 0.756 . . . . 0.0 111.136 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.9 m -145.67 155.13 42.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.108 0.963 . . . . 0.0 109.122 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -147.92 156.69 44.12 Favored Pre-proline 0 N--CA 1.455 -0.207 0 C-N-CA 122.86 0.464 . . . . 0.0 110.284 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.91 166.84 27.72 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.367 2.711 . . . . 0.0 110.469 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.76 177.03 6.72 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.927 3.084 . . . . 0.0 111.325 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -143.1 22.2 1.9 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.582 0.353 . . . . 0.0 110.301 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -139.92 170.9 15.01 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.728 0.299 . . . . 0.0 110.275 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.02 174.76 4.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 C-N-CA 122.925 0.49 . . . . 0.0 110.776 -176.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.14 -16.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.1 t -155.81 153.25 29.5 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.762 0.825 . . . . 0.0 109.35 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -156.53 -3.0 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.493 0.317 . . . . 0.0 111.367 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.09 29.26 0.04 OUTLIER Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.31 10.75 1.91 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.895 0.478 . . . . 0.0 111.403 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.58 -179.93 1.52 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.107 0.48 . . . . 0.0 111.123 175.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.0 p -143.03 27.67 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.262 0.625 . . . . 0.0 110.82 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -114.53 5.01 15.37 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.2 p -152.49 172.32 16.73 Favored 'General case' 0 N--CA 1.458 -0.062 0 CA-C-O 121.068 0.461 . . . . 0.0 110.619 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.6 m -147.03 -177.32 5.6 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 0.0 109.741 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 92.5 p -149.05 -178.94 6.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.363 0.601 . . . . 0.0 111.44 -177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -101.74 24.89 29.91 Favored Glycine 0 CA--C 1.53 1.003 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -136.52 26.14 3.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.628 0.771 . . . . 0.0 110.344 -177.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.7 p -136.46 20.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 122.942 0.497 . . . . 0.0 109.935 -177.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.0 m 53.83 31.26 12.8 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.794 0.838 . . . . 0.0 112.673 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 44.9 tp -52.3 144.54 12.65 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.222 0.609 . . . . 0.0 110.828 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.3 m -64.2 170.37 3.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.313 0.645 . . . . 0.0 111.58 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -150.87 170.02 20.31 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.198 0.599 . . . . 0.0 110.475 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -150.97 157.8 35.23 Favored Pre-proline 0 C--O 1.23 0.065 0 C-N-CA 123.181 0.592 . . . . 0.0 110.251 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.85 161.33 42.68 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.918 2.412 . . . . 0.0 111.297 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.411 ' HB ' ' HD2' ' A' ' 141' ' ' PRO . 15.5 m -145.82 161.28 40.92 Favored Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 124.02 0.928 . . . . 0.0 110.149 -176.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' HB ' ' A' ' 140' ' ' VAL . 61.0 Cg_endo -68.51 170.47 14.93 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.544 2.163 . . . . 0.0 110.532 175.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.04 170.36 17.31 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.108 0.48 . . . . 0.0 111.27 -178.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.4 t -151.31 -172.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.106 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.547 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.6 pt? -137.5 -177.69 4.9 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 2.5 m -136.74 18.21 3.07 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.936 0.494 . . . . 0.0 111.006 -175.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 85.7 mt-30 -138.81 39.43 0.38 Allowed Pre-proline 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 0.0 111.898 -178.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 92.2 Cg_endo -71.73 166.66 28.8 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.922 2.415 . . . . 0.0 110.183 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.79 165.52 29.41 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.268 2.645 . . . . 0.0 110.089 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.8 mp -62.23 147.47 91.08 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.16 170.77 19.03 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.767 2.978 . . . . 0.0 110.92 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.3 mm -139.25 131.6 15.35 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.06 152.86 9.88 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.964 3.11 . . . . 0.0 112.902 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 154' ' ' PRO . 73.2 Cg_endo -70.2 155.68 63.93 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.951 3.101 . . . . 0.0 110.902 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 153' ' ' PRO . 32.3 Cg_exo -58.82 -13.02 16.55 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.313 3.342 . . . . 0.0 113.984 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -155.28 154.25 28.23 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.03 0.532 . . . . 0.0 110.116 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.03 155.77 64.25 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.6 2.866 . . . . 0.0 110.892 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.44 158.37 54.26 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.493 2.795 . . . . 0.0 111.147 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -80.37 11.46 2.86 Favored 'Trans proline' 0 N--CA 1.454 -0.794 1 C-N-CA 125.508 4.138 . . . . 0.0 111.972 178.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 71.9 p -61.73 169.73 2.32 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.577 0.751 . . . . 0.0 112.575 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.07 -175.21 38.83 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -70.31 -11.18 60.73 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.891 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.558 ' HB3' ' HD2' ' A' ' 163' ' ' PRO . 72.1 m-20 60.5 168.66 0.08 OUTLIER Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.95 0.9 . . . . 0.0 110.999 -178.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' A' ' 162' ' ' ASN . 72.8 Cg_endo -74.97 -11.47 21.54 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.686 1.59 . . . . 0.0 111.061 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.466 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.16 168.13 17.98 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.0 t -163.04 164.04 25.7 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.67 175.12 18.6 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 123.445 0.466 . . . . 0.0 112.354 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.82 167.6 21.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.97 0.508 . . . . 0.0 110.115 175.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 43.3 m -61.62 -8.0 3.98 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -130.93 13.82 5.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 118.071 0.396 . . . . 0.0 110.626 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 20.42 1.13 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.06 157.86 9.53 Favored 'General case' 0 C--O 1.23 0.041 0 C-N-CA 124.933 1.293 . . . . 0.0 111.065 -177.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.453 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 9.0 m120 59.08 36.41 24.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 94.3 mt -137.98 -166.79 2.03 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.543 1.137 . . . . 0.0 110.537 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 26.5 t-80 -147.97 -173.08 4.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.311 0.645 . . . . 0.0 109.361 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 11.9 tp -137.94 -2.5 1.89 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.7 tp -146.79 -6.21 0.52 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.43 -0.794 . . . . 0.0 112.304 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.64 6.18 3.46 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.971 0.508 . . . . 0.0 111.714 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -152.51 8.52 0.45 Allowed 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.885 0.374 . . . . 0.0 111.116 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -156.58 163.97 38.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -146.37 165.19 30.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.09 0.556 . . . . 0.0 110.762 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -149.19 6.58 0.68 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.979 0.419 . . . . 0.0 111.149 -178.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -146.31 11.75 1.18 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.251 0.62 . . . . 0.0 110.757 -177.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 74.4 t60 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 117.291 -1.338 . . . . 0.0 110.025 -177.932 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.08 -3.62 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 98.935 -3.765 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 99.21 -3.49 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.349 -3.351 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 O4'-C1'-N19 112.139 3.939 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.562 0 C4'-C3'-C2' 98.867 -3.833 . 0.764 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 C4'-C3'-C2' 99.188 -3.512 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C4'-C3'-C2' 100.013 -2.687 . 0.712 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.803 0 C4'-C3'-C2' 99.046 -3.654 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.182 0 C4'-C3'-C2' 99.172 -3.528 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.826 0 C4'-C3'-C2' 98.737 -3.963 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.676 -3.024 . 0.71 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.1 0 C4'-C3'-C2' 99.545 -3.155 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.612 -3.088 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.694 0 C4'-C3'-C2' 98.724 -3.976 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.492 -3.208 . 0.617 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.711 3.511 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 C4'-C3'-C2' 99.625 -3.075 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.274 -3.426 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 99.406 -3.294 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.426 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.89 0 C4'-C3'-C2' 100.045 -2.655 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.426 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 99.487 -3.213 . 0.907 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.468 1 O4'-C1'-N19 113.098 4.898 . 0.726 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 O4'-C1'-N19 111.277 3.077 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.834 0 C4'-C3'-C2' 98.816 -3.884 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.87 1 C4'-C3'-C2' 98.669 -4.031 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.503 -3.197 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.199 -3.501 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.437 0 C4'-C3'-C2' 100.06 -2.64 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 C4'-C3'-C2' 99.854 -2.846 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.445 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 99.45 -3.25 . 0.78 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C4'-C3'-C2' 100.005 -2.695 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.124 0 N19-C1'-C2' 108.76 -2.9 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C5'-C4'-C3' 109.357 -4.096 . 0.241 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.508 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.545 2.73 0 C4'-C3'-O3' 120.434 3.782 OUTLIER-EPSILON 0.088 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.564 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.824 2 P-O3'-C3' 125.998 5.248 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.563 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.914 1 C4'-C3'-C2' 98.105 -4.595 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.563 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.404 -4.057 1 N19-C1'-C2' 120.874 4.671 . 0.297 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 P-O3'-C3' 123.061 2.801 . 0.424 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C4'-C3'-C2' 98.967 -3.733 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.579 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.565 1 C4'-C3'-C2' 98.675 -4.025 . 0.608 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.479 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.083 2.883 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 C4'-C3'-C2' 98.572 -4.128 . 0.821 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C4'-C3'-C2' 98.873 -3.827 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C4'-C3'-C2' 99.287 -3.413 . 0.911 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C4'-C3'-C2' 99.304 -3.396 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C4'-C3'-C2' 99.906 -2.794 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 100.029 -2.671 . 0.928 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 C4'-C3'-C2' 99.93 -2.77 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.261 2 O4'-C1'-N19 113.233 5.033 . 0.578 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.405 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 111.489 3.289 . 0.464 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.405 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.438 -2.708 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.202 -3.498 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.116 -3.584 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C4'-C3'-C2' 99.816 -2.884 . 0.535 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.415 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 O4'-C1'-N19 111.578 3.378 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.415 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 C4'-C3'-C2' 99.625 -3.075 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 1 C4'-C3'-C2' 98.643 -4.057 . 0.747 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.158 -3.542 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 C4'-C3'-C2' 99.152 -3.548 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 98.839 -3.861 . 0.623 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.165 -3.535 . 0.533 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.93 0 C5'-C4'-C3' 111.191 -2.873 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 O4'-C1'-N19 111.069 2.869 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.185 -3.515 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C4'-C3'-C2' 98.787 -3.913 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.49 1 C4'-C3'-C2' 98.636 -4.064 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.144 3.944 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.457 -3.243 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.35 1 C4'-C3'-C2' 98.18 -4.52 . 0.774 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.472 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.759 3.559 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 CA--C 1.531 0.345 0 N-CA-C 113.028 0.357 . . . . 0.0 113.028 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.79 -173.26 44.68 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 -178.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.28 -6.97 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 124.195 3.263 . . . . 0.0 111.789 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m 44.75 33.05 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 125.191 1.396 . . . . 0.0 112.647 178.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -50.28 145.61 9.88 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 123.231 0.612 . . . . 0.0 111.968 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -79.53 -13.35 13.46 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.092 2.528 . . . . 0.0 112.329 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.413 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CD1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.546 HD13 ' HG2' ' A' ' 38' ' ' MET . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.56 ' C ' HG23 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.512 ' CB ' HG22 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.56 HG23 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.546 ' HG2' HD13 ' A' ' 24' ' ' LEU . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.425 ' HB3' HG12 ' A' ' 37' ' ' VAL . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.501 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.419 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -147.15 64.53 8.94 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.26 -8.32 23.2 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.648 2.898 . . . . 0.0 112.098 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -159.22 171.71 19.37 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.714 0.806 . . . . 0.0 109.13 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.73 156.2 20.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 117.86 0.3 . . . . 0.0 110.378 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.5 m -147.19 172.49 13.73 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.918 0.389 . . . . 0.0 110.32 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -156.29 168.98 25.63 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.462 0.705 . . . . 0.0 109.343 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.63 166.1 34.42 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.629 0.252 . . . . 0.0 110.97 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.7 t-80 -146.66 11.3 1.1 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.437 0.695 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.38 19.2 9.74 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.896 1.278 . . . . 0.0 109.062 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.26 -175.34 3.96 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.826 0.851 . . . . 0.0 110.095 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -140.58 173.27 11.66 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.126 0.571 . . . . 0.0 111.516 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.09 17.41 0.46 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -64.45 -11.13 30.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.662 0.731 . . . . 0.0 112.122 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 95.1 m -58.19 149.24 24.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.1 tp -148.76 165.78 30.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.423 0.689 . . . . 0.0 109.572 -179.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.9 m -142.27 173.49 11.48 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.45 0.7 . . . . 0.0 111.035 -177.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 90' ' ' THR . 16.1 t -61.43 166.8 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.036 0.934 . . . . 0.0 110.438 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -124.84 18.14 8.61 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.505 0.722 . . . . 0.0 111.842 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.4 ' H ' HG12 ' A' ' 88' ' ' VAL . 63.3 p -142.83 165.93 26.04 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -155.6 173.44 16.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.254 -0.279 . . . . 0.0 111.122 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -150.74 167.82 26.24 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.267 1.027 . . . . 0.0 108.843 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.8 t -62.76 161.52 12.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.999 0.428 . . . . 0.0 110.718 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.5 m -149.04 165.76 30.71 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.393 0.677 . . . . 0.0 109.979 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.66 173.86 16.33 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.175 0.59 . . . . 0.0 110.416 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.69 169.44 21.6 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 122.949 0.499 . . . . 0.0 110.358 178.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.88 164.83 37.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 110.238 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -157.82 170.25 22.77 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.005 0.922 . . . . 0.0 108.946 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -60.32 147.62 81.46 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 122.838 0.455 . . . . 0.0 110.32 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -72.5 169.25 22.23 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.492 2.795 . . . . 0.0 111.393 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -148.66 3.32 0.64 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.286 0.634 . . . . 0.0 110.038 178.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 40.1 p -71.47 177.45 3.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.334 0.654 . . . . 0.0 110.562 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 22.8 tp -142.49 18.03 2.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.294 0.638 . . . . 0.0 110.096 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -139.4 17.01 2.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.806 0.442 . . . . 0.0 111.308 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -77.39 12.39 1.57 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.275 0.63 . . . . 0.0 110.808 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.71 -173.99 24.19 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -136.65 3.12 2.73 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 117.246 0.523 . . . . 0.0 112.177 -174.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 47.27 -159.58 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.365 1.066 . . . . 0.0 113.082 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.7 p -62.75 159.42 44.48 Favored Pre-proline 0 C--O 1.235 0.299 0 C-N-CA 124.056 0.943 . . . . 0.0 111.736 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.13 -179.44 3.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.952 3.101 . . . . 0.0 111.152 177.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -136.39 12.15 3.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.114 0.566 . . . . 0.0 111.721 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -143.31 12.13 1.75 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 123.525 0.73 . . . . 0.0 111.682 -178.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.4 m -144.33 7.64 1.35 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.25 0.62 . . . . 0.0 111.981 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.31 160.42 58.53 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.535 0.734 . . . . 0.0 110.717 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.432 ' N ' ' HD2' ' A' ' 116' ' ' PRO . 65.4 Cg_exo -50.34 -43.73 42.49 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 124.477 3.451 . . . . 0.0 115.634 177.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 115' ' ' PRO . 98.2 Cg_endo -74.27 -169.12 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.9 2.4 . . . . 0.0 111.286 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -133.4 145.88 50.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.286 0.565 . . . . 0.0 111.094 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -150.31 172.76 14.87 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.685 1.194 . . . . 0.0 109.719 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.5 p -153.16 154.92 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.289 0.636 . . . . 0.0 109.703 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.03 -15.77 0.11 Allowed Glycine 0 CA--C 1.528 0.879 0 CA-C-O 119.891 -0.394 . . . . 0.0 112.691 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.8 m -71.09 -1.64 12.96 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 117.529 0.664 . . . . 0.0 111.986 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -150.74 173.89 13.66 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.269 0.628 . . . . 0.0 110.361 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.6 21.66 0.16 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.37 172.27 3.33 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.361 0.664 . . . . 0.0 112.579 -178.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -152.92 177.57 10.62 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.477 0.711 . . . . 0.0 109.695 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 22.7 t -149.15 176.02 10.86 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -150.39 169.51 21.25 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.433 0.693 . . . . 0.0 110.133 -176.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 77.8 p -154.27 -179.77 8.24 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.711 0.405 . . . . 0.0 111.112 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 78.6 p -151.13 171.27 17.63 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.833 0.853 . . . . 0.0 109.786 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.2 m -73.59 -7.85 53.59 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.45 178.56 40.23 Favored Glycine 0 CA--C 1.527 0.824 0 O-C-N 122.16 -0.337 . . . . 0.0 112.533 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -151.12 163.37 38.96 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.572 0.749 . . . . 0.0 109.423 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 m 37.76 41.55 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.4 1.08 . . . . 0.0 112.718 -176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.7 m -128.97 19.37 6.01 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.108 0.563 . . . . 0.0 110.976 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.7 mt 54.09 28.19 8.56 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.896 0.878 . . . . 0.0 113.055 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 22.3 t -141.34 -3.98 1.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.318 -0.239 . . . . 0.0 111.543 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.69 169.89 14.81 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.1 p -160.53 160.2 25.84 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.158 178.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.18 162.31 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 124.069 3.179 . . . . 0.0 112.736 174.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 23.8 t -141.87 125.08 9.63 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.58 0.352 . . . . 0.0 110.313 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.76 -179.82 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 124.35 3.367 . . . . 0.0 113.418 173.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 54.44 18.25 1.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.547 1.139 . . . . 0.0 113.834 176.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 86.1 p -146.43 1.06 0.81 Allowed 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 118.057 0.389 . . . . 0.0 111.677 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 95.6 mt -142.87 3.13 1.4 Allowed 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.353 1.061 . . . . 0.0 110.18 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 15.1 t -159.64 175.46 13.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.857 0.863 . . . . 0.0 110.451 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -142.37 151.86 59.11 Favored Pre-proline 0 N--CA 1.456 -0.174 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.72 168.56 24.18 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 122.88 2.387 . . . . 0.0 111.961 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.53 169.81 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 124.986 3.79 . . . . 0.0 113.355 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -53.9 148.1 21.81 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.167 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.51 -1.05 11.08 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 124.031 3.154 . . . . 0.0 113.507 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 44.6 mm -61.89 133.63 93.88 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -177.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.17 170.88 18.77 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.896 3.064 . . . . 0.0 111.109 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -49.49 159.34 1.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.062 3.175 . . . . 0.0 112.728 175.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.52 152.87 11.52 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.761 2.974 . . . . 0.0 113.41 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.45 158.81 32.68 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.725 0.81 . . . . 0.0 109.051 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -48.08 115.56 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.843 3.029 . . . . 0.0 112.707 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -80.03 166.59 20.81 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 124.539 3.492 . . . . 0.0 111.049 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.57 166.55 29.06 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.331 2.688 . . . . 0.0 110.241 173.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.9 t -150.59 1.68 0.45 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 169.93 -6.89 0.04 OUTLIER Glycine 0 C--N 1.344 1.021 0 CA-C-N 118.266 0.484 . . . . 0.0 112.803 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -143.9 172.44 12.86 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.92 0.888 . . . . 0.0 109.115 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 50.8 p30 -144.22 155.72 57.98 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 122.854 0.462 . . . . 0.0 110.249 -178.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.77 -19.8 23.49 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.05 2.5 . . . . 0.0 111.454 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.449 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.25 166.44 24.52 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 89.4 p -163.86 156.14 17.36 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 123.577 0.751 . . . . 0.0 109.809 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 158.79 -163.63 33.24 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-O 121.335 0.408 . . . . 0.0 112.329 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -128.49 6.31 5.72 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.141 0.576 . . . . 0.0 111.402 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.9 m 102.86 -21.27 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 128.023 2.529 . . . . 0.0 111.885 173.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -111.12 4.83 19.66 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.95 0.795 . . . . 0.0 111.691 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.94 18.0 0.98 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 177.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -61.43 153.37 27.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.26 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 205' ' ' GLY . . . . . 0.406 ' CA ' HD12 ' A' ' 210' ' ' LEU . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 210' ' ' LEU . . . . . 0.406 HD12 ' CA ' ' A' ' 205' ' ' GLY . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.449 ' CD2' HD13 ' A' ' 170' ' ' LEU . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 10.0 m120 59.71 34.66 22.12 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.42 -155.74 0.62 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.623 1.169 . . . . 0.0 109.068 -176.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -138.39 -55.34 0.63 Allowed 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 121.339 -0.851 . . . . 0.0 110.606 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 5.7 tp -168.4 23.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.402 0.681 . . . . 0.0 110.224 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.482 ' N ' HD12 ' A' ' 229' ' ' LEU . 6.0 mp 56.0 16.0 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.36 1.064 . . . . 0.0 111.742 -178.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 2.2 9.71 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.898 -0.501 . . . . 0.0 111.941 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -148.37 178.8 8.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.293 0.637 . . . . 0.0 110.332 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -140.65 31.69 1.85 Allowed 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 122.655 0.382 . . . . 0.0 110.982 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 64.3 m80 55.54 17.92 2.49 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.831 0.852 . . . . 0.0 112.206 -176.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -64.05 174.39 1.55 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.962 0.905 . . . . 0.0 111.008 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -151.59 165.82 33.11 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.554 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.8 t60 . . . . . 0 C--O 1.252 1.227 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.62 -177.845 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.173 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 O4'-C1'-N19 111.963 3.763 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.007 1 O4'-C1'-N19 112.225 4.025 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C4'-C3'-C2' 99.121 -3.579 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 1 O4'-C1'-N19 112.525 4.325 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C5'-C4'-O4' 113.251 2.894 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.839 -3.861 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.607 -3.093 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.833 -2.867 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.163 2.963 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.308 0 C4'-C3'-C2' 99.111 -3.589 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.092 -3.608 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.418 -3.282 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.505 -3.195 . 0.754 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.637 -4.063 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.142 -3.558 . 0.657 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.266 -3.434 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.015 0 C4'-C3'-C2' 98.965 -3.735 . 0.715 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 O4'-C1'-N19 111.134 2.934 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 C4'-C3'-C2' 99.143 -3.557 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.446 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.144 0 C4'-C3'-C2' 99.862 -2.838 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.446 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.809 -3.891 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 O4'-C1'-N19 112.157 3.957 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C5'-C4'-C3' 110.549 -3.3 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.808 3.608 . 0.852 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 98.724 -3.976 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.284 1 C4'-C3'-C2' 98.584 -4.116 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.502 -3.198 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.482 -3.218 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.561 3.361 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.117 -3.583 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 99.294 -3.406 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 98.991 -3.709 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 N19-C1'-C2' 108.367 -3.146 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.474 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.546 2.735 1 C4'-C3'-O3' 121.228 4.088 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.519 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.699 2 P-O3'-C3' 125.568 4.89 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.625 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.241 1 C4'-C3'-C2' 98.601 -4.099 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.625 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.895 2 N19-C1'-C2' 123.308 6.192 . 0.297 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.032 2.832 . 0.372 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.815 -3.885 . 0.882 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.501 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.415 -3.146 0 C4'-C3'-C2' 99.111 -3.589 . 0.713 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.489 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-O4' 112.718 2.513 . 0.889 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.242 -3.458 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.24 -3.46 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.034 -3.666 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.082 0 C4'-C3'-C2' 98.839 -3.861 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.427 -3.273 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.831 1 C4'-C3'-C2' 98.432 -4.268 . 0.861 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-C3' 111.442 -2.705 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.191 1 O4'-C1'-N19 113.072 4.872 . 0.537 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.461 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.618 2.49 0 C5'-C4'-O4' 113.183 2.845 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.461 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 C4'-C3'-C2' 100.073 -2.627 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 O4'-C1'-N19 111.611 3.411 . 0.881 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 112.087 3.887 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 O4'-C1'-N19 111.166 2.966 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.682 0 C4'-C3'-C2' 99.981 -2.719 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 C4'-C3'-C2' 99.793 -2.907 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 O4'-C1'-N19 111.902 3.702 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 O4'-C1'-N19 110.915 2.715 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.943 -3.757 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 99.251 -3.449 . 0.602 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.824 3.624 . 0.642 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 O4'-C1'-N19 111.097 2.897 . 0.849 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C4'-C3'-C2' 100.04 -2.66 . 0.64 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.274 -3.426 . 0.626 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 98.89 -3.81 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 1 C4'-C3'-C2' 97.836 -4.864 . 0.813 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 O4'-C1'-N19 112.177 3.977 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.783 0 C4'-C3'-C2' 99.114 -3.586 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.431 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.342 1 C4'-C3'-C2' 97.5 -5.2 . 0.708 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.431 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 O4'-C1'-N19 111.618 3.418 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.473 0.273 0 N-CA-C 112.148 0.018 . . . . 0.0 112.148 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.05 -169.77 42.73 Favored Glycine 0 C--N 1.34 0.8 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.84 1.74 0.06 OUTLIER 'Trans proline' 0 CA--C 1.53 0.311 1 C-N-CA 125.885 4.39 . . . . 0.0 114.849 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.0 t -121.43 -5.75 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 118.469 0.577 . . . . 0.0 110.147 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.7 tp -153.21 54.2 1.14 Allowed Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.347 0.659 . . . . 0.0 109.619 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.09 -14.77 18.73 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.28 2.653 . . . . 0.0 111.509 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.672 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.728 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.599 ' H ' HD22 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 31' ' ' VAL . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.404 ' HD2' HD21 ' A' ' 24' ' ' LEU . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.728 ' HG2' HD23 ' A' ' 24' ' ' LEU . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.6 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.621 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.3 t60 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.751 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -152.26 53.76 1.14 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.751 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 73.0 Cg_endo -68.45 -10.25 28.43 Favored 'Trans proline' 0 N--CA 1.452 -0.946 1 C-N-CA 125.544 4.163 . . . . 0.0 114.356 -175.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -160.74 -34.26 0.05 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -160.38 175.11 13.18 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.523 -0.736 . . . . 0.0 111.669 -175.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 m -70.77 21.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.449 1.5 . . . . 0.0 112.737 178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -71.56 18.54 0.07 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.974 0.909 . . . . 0.0 112.153 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -138.59 175.44 9.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.94 0.896 . . . . 0.0 109.929 179.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -146.47 166.96 24.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.728 0.411 . . . . 0.0 111.13 -175.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.86 171.41 17.8 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.999 0.52 . . . . 0.0 111.639 -178.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.28 -175.84 5.33 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.683 0.393 . . . . 0.0 110.399 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -145.39 172.5 13.1 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.363 0.665 . . . . 0.0 110.254 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -178.46 39.37 0.08 OUTLIER Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp180 -128.69 178.2 6.51 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.566 0.746 . . . . 0.0 110.823 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 72.9 p -72.68 26.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.86 1.264 . . . . 0.0 113.069 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 mp 55.66 29.22 13.28 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.232 0.613 . . . . 0.0 110.556 -174.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.4 t -144.32 175.39 10.13 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.228 0.611 . . . . 0.0 110.253 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.1 8.42 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.78 0.832 . . . . 0.0 111.099 -175.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -143.7 169.24 18.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.431 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 48.7 p -142.81 175.0 10.16 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 125.159 1.384 . . . . 0.0 109.795 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -154.3 170.48 21.18 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.808 0.443 . . . . 0.0 110.164 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -151.54 176.97 10.8 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.809 0.444 . . . . 0.0 110.488 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.4 t -150.36 169.64 20.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.475 0.31 . . . . 0.0 110.591 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.3 p -153.96 178.26 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.14 0.576 . . . . 0.0 110.701 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.09 24.63 1.3 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.765 0.826 . . . . 0.0 110.496 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -144.68 178.41 8.0 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.136 0.574 . . . . 0.0 110.402 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -142.73 17.75 1.99 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.176 0.59 . . . . 0.0 110.992 -177.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -148.81 160.72 42.95 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 122.714 0.405 . . . . 0.0 109.924 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -87.87 155.7 52.78 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 122.833 0.453 . . . . 0.0 111.681 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -74.77 177.94 7.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.225 3.283 . . . . 0.0 111.553 175.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -147.97 171.08 16.36 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.928 0.491 . . . . 0.0 109.991 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -149.57 179.05 8.29 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 120.896 0.379 . . . . 0.0 110.917 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.1 tp -147.64 160.26 42.86 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -149.46 174.12 12.83 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.918 0.487 . . . . 0.0 110.742 -176.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -62.1 163.4 8.08 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.046 0.538 . . . . 0.0 111.608 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -174.72 179.65 45.89 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -146.34 171.75 14.53 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.945 0.498 . . . . 0.0 110.467 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -141.66 -177.15 5.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.6 0.76 . . . . 0.0 109.578 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 41.3 m -138.6 136.71 19.1 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.58 171.65 14.95 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.703 2.935 . . . . 0.0 111.531 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -153.5 174.82 13.91 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.408 0.683 . . . . 0.0 109.345 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.72 13.7 1.92 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.4 m -144.13 165.32 28.15 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.007 0.523 . . . . 0.0 110.407 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -159.51 161.63 26.79 Favored Pre-proline 0 N--CA 1.454 -0.252 0 C-N-CA 123.287 0.635 . . . . 0.0 110.094 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.66 166.05 3.05 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.467 2.778 . . . . 0.0 112.157 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.85 -32.57 30.19 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.636 2.89 . . . . 0.0 112.436 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -164.07 -44.37 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.658 0.783 . . . . 0.0 109.778 173.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.401 ' H ' ' H ' ' A' ' 119' ' ' VAL . 41.8 t80 -166.16 -20.76 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.733 0.813 . . . . 0.0 110.304 176.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.401 ' H ' ' H ' ' A' ' 118' ' ' TYR . 35.9 m -144.39 173.27 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 124.417 1.087 . . . . 0.0 109.861 -179.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.32 6.96 0.03 OUTLIER Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.505 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 17.8 t -155.5 176.5 12.51 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.071 0.935 . . . . 0.0 110.4 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -149.45 9.06 0.72 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.29 0.636 . . . . 0.0 111.559 -178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.7 174.32 46.79 Favored Glycine 0 CA--C 1.531 1.092 0 O-C-N 121.958 -0.464 . . . . 0.0 112.621 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -72.64 -0.05 11.94 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -151.3 156.35 40.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.6 m -151.47 175.12 12.6 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.776 0.831 . . . . 0.0 109.639 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -150.98 169.55 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.759 0.423 . . . . 0.0 110.254 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 84.4 p -149.56 4.96 0.6 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.8 p -155.09 171.26 20.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.131 0.572 . . . . 0.0 110.266 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.8 t -69.37 161.5 29.25 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.805 0.442 . . . . 0.0 111.185 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.59 -6.45 0.08 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.75 -0.472 . . . . 0.0 111.962 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.04 169.31 21.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.755 0.822 . . . . 0.0 108.821 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 5.2 t 59.59 4.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.693 1.197 . . . . 0.0 112.018 -176.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -69.77 8.8 0.61 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.351 1.06 . . . . 0.0 112.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 19.1 tp -138.24 10.39 2.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.897 0.879 . . . . 0.0 110.438 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.7 m -138.32 12.74 2.8 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.068 0.947 . . . . 0.0 111.26 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -143.0 8.94 1.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.069 0.548 . . . . 0.0 110.794 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 45.8 m -61.81 160.32 28.95 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.277 0.631 . . . . 0.0 111.834 -178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.07 158.64 1.27 Allowed 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.459 3.44 . . . . 0.0 114.7 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.414 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 48.1 t -55.45 -39.28 76.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 140' ' ' VAL . 72.0 Cg_exo -53.25 0.35 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 124.157 3.238 . . . . 0.0 115.481 172.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -128.13 -3.45 5.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.078 0.853 . . . . 0.0 111.777 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 50.7 m -77.0 7.64 4.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.839 0.456 . . . . 0.0 112.097 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.7 pt? -140.67 9.35 2.2 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 122.876 0.47 . . . . 0.0 112.188 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.7 t -147.93 -4.35 0.49 Allowed 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.047 -0.408 . . . . 0.0 111.312 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.465 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 57.1 tp60 -150.99 42.53 0.24 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.068 0.547 . . . . 0.0 110.835 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 98.4 Cg_endo -71.85 169.67 20.66 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.908 2.405 . . . . 0.0 111.17 -178.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.68 166.39 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 124.53 3.487 . . . . 0.0 113.418 174.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.91 154.05 69.85 Favored Pre-proline 0 N--CA 1.455 -0.213 0 C-N-CA 122.613 0.365 . . . . 0.0 110.69 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.86 176.37 9.96 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.849 3.033 . . . . 0.0 111.02 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 37.3 mm -137.79 137.74 22.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.96 159.64 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.655 2.903 . . . . 0.0 112.747 176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.64 163.35 39.28 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.203 2.602 . . . . 0.0 110.852 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.83 166.21 30.21 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.424 2.749 . . . . 0.0 111.713 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -155.65 155.48 29.64 Favored Pre-proline 0 CA--C 1.532 0.25 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.75 147.3 39.61 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.796 2.331 . . . . 0.0 110.686 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.9 167.4 23.76 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.654 2.902 . . . . 0.0 110.839 176.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.02 161.52 6.43 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.355 2.703 . . . . 0.0 112.379 173.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 92.0 p -149.79 8.13 0.66 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 122.704 0.402 . . . . 0.0 111.976 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -178.12 17.37 0.03 OUTLIER Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.664 -0.52 . . . . 0.0 111.899 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -146.01 17.91 1.41 Allowed 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 117.708 0.754 . . . . 0.0 111.143 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -57.66 147.76 59.92 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 122.792 0.437 . . . . 0.0 111.014 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 166' ' ' ILE . 73.9 Cg_endo -73.15 -14.57 25.87 Favored 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 124.536 3.49 . . . . 0.0 111.287 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 163' ' ' PRO . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.415 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CD1' HG13 ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' PHE . . . . . 0.58 ' C ' HD22 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.58 HD22 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.94 174.26 10.67 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.8 t -153.08 143.47 22.53 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.275 0.63 . . . . 0.0 109.739 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.32 -170.78 17.24 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -131.79 -59.04 0.96 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 117.23 0.515 . . . . 0.0 110.507 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.1 p -172.36 -35.16 0.01 OUTLIER 'General case' 0 C--O 1.23 0.071 0 C-N-CA 122.789 0.436 . . . . 0.0 110.563 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -67.65 -19.42 65.2 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.343 175.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.53 147.8 17.53 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.708 -1.589 . . . . 0.0 106.708 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -160.52 156.71 26.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 117.699 0.227 . . . . 0.0 111.006 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 209' ' ' LYS . . . . . 0.403 ' HE3' ' P ' ' B' ' 292' ' ' ' C' . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.413 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.4 m120 56.06 36.86 28.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 81.8 mt -136.62 -165.73 1.78 Allowed 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.344 1.058 . . . . 0.0 110.401 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.603 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 36.8 t-80 -144.95 -168.78 3.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.427 0.691 . . . . 0.0 109.255 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.603 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.0 tp -123.43 17.65 9.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.743 0.417 . . . . 0.0 111.188 -176.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 231' ' ' HIS . 64.9 mt 51.73 29.59 5.93 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.868 1.267 . . . . 0.0 113.943 176.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.51 9.32 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.558 0.743 . . . . 0.0 111.985 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 231' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 229' ' ' LEU . 11.7 p80 -137.26 7.23 2.86 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.376 1.07 . . . . 0.0 111.097 -178.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -142.97 1.35 1.27 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.179 0.592 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -151.21 154.75 37.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -157.88 -174.77 5.01 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -142.01 13.74 2.06 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.021 0.529 . . . . 0.0 112.354 -177.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.697 -179.902 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.282 -3.418 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.157 -3.543 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 98.829 -3.871 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.253 0 C4'-C3'-C2' 99.527 -3.173 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.742 1 O4'-C1'-N19 112.428 4.228 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 98.95 -3.75 . 0.748 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C4'-C3'-C2' 98.897 -3.803 . 0.577 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 99.335 -3.365 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.33 0 C4'-C3'-C2' 99.577 -3.123 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.9 -2.8 . 0.315 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 O4'-C1'-N19 111.569 3.369 . 0.873 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.715 -2.985 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 C4'-C3'-C2' 99.382 -3.318 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.728 -2.972 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 99.384 -3.316 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.32 -3.38 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C4'-C3'-C2' 99.532 -3.168 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 C4'-C3'-C2' 98.919 -3.781 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C4'-C3'-C2' 100.229 -2.471 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.454 -3.246 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.458 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.52 -3.18 . 0.826 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.458 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.369 0 C4'-C3'-C2' 99.911 -2.789 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.048 -3.652 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.69 -3.01 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 O4'-C1'-N19 111.033 2.833 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.272 -3.428 . 0.853 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.169 -3.531 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.245 -3.455 . 0.873 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.244 -3.456 . 0.734 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.285 3.085 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C5'-C4'-O4' 113.99 3.422 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.744 1 C4'-C3'-C2' 98.321 -4.379 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.694 1 C4'-C3'-C2' 98.636 -4.064 . 0.676 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . 0.448 " H1'" ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.39 0 N19-C1'-C2' 108.306 -3.184 . 0.718 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.405 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O5'--C5' 1.404 -2.269 1 C4'-C3'-O3' 121.357 4.137 . 0.346 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.437 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.259 1 P-O3'-C3' 125.818 5.098 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 014 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.627 3.407 1 C4'-C3'-C2' 97.902 -4.798 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.448 ' H61' " H1'" ' B' ' 270' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.541 -3.159 . 0.66 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C4'-C3'-C2' 99.028 -3.672 . 0.646 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 1 C4'-C3'-C2' 98.439 -4.261 . 0.746 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.621 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.416 -3.091 0 O4'-C1'-N19 111.759 3.559 . 0.575 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.86 0 C4'-C3'-C2' 99.404 -3.296 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.889 1 C4'-C3'-C2' 98.497 -4.203 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.327 -3.373 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.808 -3.892 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.122 0 C4'-C3'-C2' 98.831 -3.869 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.984 0 C4'-C3'-C2' 100.005 -2.695 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 O4'-C1'-N19 111.669 3.469 . 0.901 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 110.335 2.135 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 O4'-C1'-N19 113.049 4.849 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.984 0 C4'-C3'-C2' 99.495 -3.205 . 0.571 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 100.341 -2.359 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C4'-C3'-C2' 99.35 -3.35 . 0.841 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 O4'-C1'-N19 111.481 3.281 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 2.297 0 O4'-C1'-N19 111.434 3.234 . 0.543 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.409 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.443 0 O4'-C1'-N19 110.712 2.512 . 0.6 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.409 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 O4'-C1'-N19 111.601 3.401 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.519 -4.181 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.198 -3.502 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.13 0 C4'-C3'-C2' 99.628 -3.072 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.416 0 C4'-C3'-C2' 98.933 -3.767 . 0.661 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C4'-C3'-C2' 99.371 -3.329 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C4'-C3'-C2' 99.813 -2.887 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 100.254 -2.446 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.91 0 O4'-C1'-N19 111.48 3.28 . 0.615 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 O4'-C1'-N19 111.626 3.426 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 98.443 -4.257 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 O4'-C1'-N19 112.084 3.884 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C4'-C3'-C2' 99.478 -3.222 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.454 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.62 2.739 1 C4'-C3'-C2' 97.573 -5.127 . 0.747 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.454 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 112.157 3.957 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo . . . . . 0 C--O 1.23 0.098 0 CA-C-O 120.632 0.18 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.83 54.69 0.21 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.159 -0.8 . . . . 0.0 111.888 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.41 172.48 14.1 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 124.141 3.227 . . . . 0.0 110.936 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -144.07 174.34 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.254 1.022 . . . . 0.0 109.929 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.403 ' N ' ' HD3' ' A' ' 6' ' ' PRO . 1.9 tt -144.89 62.93 9.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 122.84 0.456 . . . . 0.0 109.909 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.403 ' HD3' ' N ' ' A' ' 5' ' ' LEU . 72.1 Cg_exo -52.17 -28.08 32.18 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.68 2.92 . . . . 0.0 114.17 -175.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.414 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.493 HD12 HD11 ' A' ' 16' ' ' ILE . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 13' ' ' LEU . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.456 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.621 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.646 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.535 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.453 HG21 " H1'" ' B' ' 287' ' ' ' U' . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.535 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.646 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.558 HG23 HD23 ' A' ' 20' ' ' LEU . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 55' ' ' LYS . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 53' ' ' THR . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -143.9 64.55 13.1 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.37 4.03 4.23 Favored 'Trans proline' 0 N--CA 1.453 -0.896 1 C-N-CA 125.478 4.118 . . . . 0.0 112.931 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -145.95 167.92 22.13 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.229 0.612 . . . . 0.0 109.498 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.62 11.66 1.12 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.687 0.395 . . . . 0.0 111.877 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 48.8 m -61.26 167.08 3.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 117.999 0.363 . . . . 0.0 110.839 178.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.46 156.42 16.18 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 122.064 -0.398 . . . . 0.0 111.693 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.56 176.02 12.54 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.656 0.382 . . . . 0.0 110.745 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -148.34 7.44 0.78 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.56 0.744 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.45 169.49 10.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.442 0.697 . . . . 0.0 110.584 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.0 176.65 10.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.433 0.693 . . . . 0.0 109.767 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.0 mtm -144.79 172.23 13.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.376 0.67 . . . . 0.0 110.216 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.46 11.35 0.31 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -155.33 161.26 41.11 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -178.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.5 t -149.18 174.15 12.67 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.799 0.44 . . . . 0.0 110.455 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.0 tp -145.89 16.54 1.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.848 0.859 . . . . 0.0 109.354 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -142.22 162.35 35.69 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.472 0.709 . . . . 0.0 110.753 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -71.15 150.66 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 122.74 0.416 . . . . 0.0 111.279 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -146.19 9.94 1.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.671 0.788 . . . . 0.0 111.594 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.9 p -144.96 -175.44 4.69 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.562 1.145 . . . . 0.0 109.286 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -146.11 172.67 13.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.483 0.659 . . . . 0.0 111.364 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -144.29 8.75 1.4 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.272 0.629 . . . . 0.0 111.242 -178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.3 m -59.48 158.62 9.39 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.973 0.909 . . . . 0.0 110.481 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 81.1 p -149.21 171.2 16.85 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.929 0.491 . . . . 0.0 109.822 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -62.04 161.06 11.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.141 0.496 . . . . 0.0 111.652 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -153.99 169.04 24.45 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.63 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -156.07 165.17 37.21 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.667 0.387 . . . . 0.0 110.521 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -77.66 174.51 10.86 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.7 0.286 . . . . 0.0 110.784 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -142.84 154.75 62.71 Favored Pre-proline 0 C--O 1.233 0.236 0 C-N-CA 123.499 0.72 . . . . 0.0 110.063 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.9 164.28 36.18 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.474 2.783 . . . . 0.0 111.675 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -150.27 7.94 0.61 Allowed 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.227 0.611 . . . . 0.0 111.437 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 42.3 p -143.32 174.37 10.79 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.052 0.941 . . . . 0.0 110.24 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.638 HD13 ' H ' ' A' ' 104' ' ' PHE . 0.1 OUTLIER -148.45 158.48 44.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.321 0.648 . . . . 0.0 109.585 179.385 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.638 ' H ' HD13 ' A' ' 103' ' ' LEU . 72.6 m-85 -70.9 -177.44 1.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.873 0.869 . . . . 0.0 110.42 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -138.23 170.38 16.14 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.529 0.732 . . . . 0.0 110.221 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.42 27.58 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -144.2 179.72 7.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.769 0.828 . . . . 0.0 109.941 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -143.22 169.05 18.35 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.393 0.616 . . . . 0.0 111.54 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.3 p -66.32 154.38 90.6 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.698 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.66 6.29 2.88 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.433 3.422 . . . . 0.0 111.908 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -148.06 178.22 8.72 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.671 0.388 . . . . 0.0 110.244 -178.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -146.97 154.95 41.86 Favored 'General case' 0 CA--C 1.526 0.055 0 C-N-CA 123.473 0.709 . . . . 0.0 109.214 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.4 p -148.97 12.27 0.85 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -177.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.429 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 8.1 tp10 -140.04 47.02 1.1 Allowed Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 122.283 0.233 . . . . 0.0 111.444 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 88.2 Cg_endo -71.77 168.65 23.2 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.149 1.9 . . . . 0.0 110.454 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.73 160.66 1.67 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 124.409 3.406 . . . . 0.0 112.842 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -154.15 174.4 14.79 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.716 0.406 . . . . 0.0 110.077 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -139.29 175.36 9.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 122.828 0.451 . . . . 0.0 111.127 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.8 m -136.14 19.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 123.652 0.781 . . . . 0.0 111.693 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.44 -178.56 31.61 Favored Glycine 0 C--N 1.337 0.586 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 97.6 p -146.96 -175.28 4.75 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.687 0.795 . . . . 0.0 109.907 -178.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -138.83 1.71 2.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.69 171.85 37.86 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -151.23 3.99 0.45 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.73 0.412 . . . . 0.0 110.945 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -144.72 6.63 1.23 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.286 0.634 . . . . 0.0 110.877 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.1 p -155.26 165.89 35.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.281 0.632 . . . . 0.0 109.964 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -154.92 172.86 17.36 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.978 0.418 . . . . 0.0 111.076 -178.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 70.6 p -157.23 174.12 15.93 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.09 0.956 . . . . 0.0 110.116 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.3 m -63.18 162.62 11.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.733 0.413 . . . . 0.0 110.301 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.3 p -154.47 172.53 17.63 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.096 0.558 . . . . 0.0 110.964 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.73 10.52 0.02 OUTLIER Glycine 0 CA--C 1.531 1.054 0 CA-C-O 119.546 -0.585 . . . . 0.0 112.423 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -147.42 6.97 0.86 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.893 0.846 . . . . 0.0 111.403 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 135' ' ' LEU . 9.9 p -151.1 163.74 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 C-N-CA 123.107 0.563 . . . . 0.0 110.102 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -145.89 25.98 1.26 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.807 0.443 . . . . 0.0 111.218 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.404 ' H ' HG22 ' A' ' 133' ' ' VAL . 4.0 pp -59.72 -9.97 3.27 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.204 0.602 . . . . 0.0 112.488 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.6 m -74.45 13.3 0.62 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.807 0.843 . . . . 0.0 111.828 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.67 26.33 2.81 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.502 1.121 . . . . 0.0 110.253 -176.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 53.0 m -133.22 49.2 4.07 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.809 0.844 . . . . 0.0 111.203 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -70.62 174.34 10.4 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.737 2.958 . . . . 0.0 111.042 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 44.6 t -141.24 142.99 28.94 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.84 156.69 1.23 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 124.679 3.586 . . . . 0.0 113.559 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.85 1.21 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.913 0.485 . . . . 0.0 111.37 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.9 m -134.58 13.78 3.74 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 112.122 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -73.57 -15.53 61.28 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.247 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p 44.45 22.67 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.938 1.695 . . . . 0.0 114.594 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -154.31 141.9 13.8 Favored Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 121.532 -0.73 . . . . 0.0 109.444 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.1 163.23 2.31 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.542 2.828 . . . . 0.0 111.978 174.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.44 166.58 27.96 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.794 2.996 . . . . 0.0 110.285 176.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.05 155.88 85.87 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 122.397 -0.189 . . . . 0.0 110.699 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.82 164.32 2.45 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.5 3.466 . . . . 0.0 112.489 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ILE . . . . . 0.408 ' HA ' ' HD3' ' A' ' 152' ' ' PRO . 15.2 tt -152.82 140.31 13.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 151' ' ' ILE . 67.8 Cg_exo -54.73 164.99 2.78 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.812 3.008 . . . . 0.0 112.025 174.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -52.22 160.24 3.51 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.651 2.901 . . . . 0.0 111.964 175.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -71.76 1.83 5.33 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.825 3.017 . . . . 0.0 112.335 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -134.41 157.48 77.33 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 124.096 0.958 . . . . 0.0 109.642 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 74.7 Cg_exo -52.48 141.28 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.855 3.037 . . . . 0.0 113.061 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 156' ' ' PRO . 50.6 Cg_exo -54.26 159.9 7.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 124.283 3.322 . . . . 0.0 112.324 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -74.6 -11.63 22.3 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.026 3.151 . . . . 0.0 111.996 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.0 t -158.96 167.86 28.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.914 0.885 . . . . 0.0 109.629 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.73 -174.83 47.32 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 120.916 0.176 . . . . 0.0 112.675 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -149.8 174.75 12.29 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.802 1.641 . . . . 0.0 108.358 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -138.19 138.84 23.86 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -176.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.414 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 61.7 Cg_endo -83.16 -5.9 11.17 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.377 3.385 . . . . 0.0 111.612 176.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.414 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.482 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.83 168.52 14.33 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 33.8 t -154.55 162.3 41.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.157 0.583 . . . . 0.0 110.344 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 93.24 173.49 40.4 Favored Glycine 0 C--N 1.338 0.655 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.44 167.99 18.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.194 0.521 . . . . 0.0 109.762 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.3 m -66.7 -0.3 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -174.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -123.05 8.26 9.25 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.958 0.344 . . . . 0.0 110.988 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.05 22.53 1.22 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -61.52 158.98 13.8 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.766 1.226 . . . . 0.0 112.558 -171.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.482 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.431 HG13 HG21 ' A' ' 223' ' ' VAL . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.428 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.431 HG21 HG13 ' A' ' 196' ' ' VAL . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.1 m120 52.79 30.62 9.26 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 93.0 mt -140.11 93.1 2.6 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.631 1.172 . . . . 0.0 109.607 -176.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.66 140.1 42.5 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.521 0.513 . . . . 0.0 109.994 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 42.0 tp -63.69 145.37 55.86 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.49 0.316 . . . . 0.0 111.031 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -155.84 168.3 27.65 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.935 0.494 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -150.5 2.17 0.46 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.445 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -64.48 -6.57 7.63 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -63.05 -3.91 1.98 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.076 0.551 . . . . 0.0 112.401 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -142.02 22.68 2.08 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 121.094 0.473 . . . . 0.0 110.649 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -134.31 25.6 3.82 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.478 0.711 . . . . 0.0 110.832 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -129.95 8.44 5.23 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.963 0.505 . . . . 0.0 111.028 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.1 t60 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.371 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.229 -3.471 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.982 3.782 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C4'-C3'-C2' 99.338 -3.362 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.235 0 C4'-C3'-C2' 99.021 -3.679 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.808 1 O4'-C1'-N19 112.361 4.161 . 0.655 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 98.9 -3.8 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.011 0 C4'-C3'-C2' 98.946 -3.754 . 0.668 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 0 C4'-C3'-C2' 99.603 -3.097 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 100.687 -2.013 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C4'-C3'-C2' 99.661 -3.039 . 0.493 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.484 0 O4'-C1'-N19 112.113 3.913 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.733 0 C4'-C3'-C2' 99.697 -3.003 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C4'-C3'-C2' 99.216 -3.484 . 0.841 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 C4'-C3'-C2' 99.979 -2.721 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.18 -3.52 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 1 C4'-C3'-C2' 98.385 -4.315 . 0.63 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.363 -3.337 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.55 -3.15 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.231 -3.469 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C5'-C4'-O4' 113.702 3.216 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.546 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 99.075 -3.625 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.546 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 98.939 -3.761 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.402 -2.355 1 O4'-C1'-N19 112.844 4.644 . 0.82 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.303 0 C4'-C3'-C2' 99.186 -3.514 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.424 3.224 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.704 0 C4'-C3'-C2' 98.972 -3.728 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.196 -3.504 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C4'-C3'-C2' 99.37 -3.33 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 C4'-C3'-C2' 99.061 -3.639 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 1 O4'-C1'-N19 112.216 4.016 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C4'-C3'-C2' 98.943 -3.757 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.081 0 C4'-C3'-C2' 98.736 -3.964 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C4'-C3'-C2' 99.144 -3.556 . 0.734 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 0 O4'-C1'-N19 111.037 2.837 . 0.669 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.499 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.176 1 C5'-C4'-C3' 109.335 -4.11 . 0.058 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.499 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.087 3 C3'-C2'-C1' 105.909 4.899 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 015 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.448 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.355 1 C4'-C3'-C2' 98.347 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.448 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.786 3.586 . 0.632 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 99.595 -3.105 . 0.63 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.213 -4.487 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 O4'-C1'-N19 112.139 3.939 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C5'-C4'-O4' 113.137 2.812 . 0.914 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.024 1 C4'-C3'-C2' 98.681 -4.019 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.822 -2.878 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.139 -3.561 . 0.922 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.426 0 C4'-C3'-C2' 98.96 -3.74 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.881 -2.819 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.855 1 C4'-C3'-C2' 98.412 -4.288 . 0.898 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C5'-C4'-C3' 111.384 -2.744 . 0.875 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.519 1 O4'-C1'-N19 113.465 5.265 . 0.506 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.453 " H1'" HG21 ' A' ' 31' ' ' VAL . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.739 3.539 . 0.495 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.411 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.097 2.897 . 0.666 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 C4'-C3'-C2' 99.38 -3.32 . 0.852 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 O4'-C1'-N19 111.358 3.158 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 O4'-C1'-N19 111.777 3.577 . 0.558 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.05 0 C4'-C3'-C2' 99.066 -3.634 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.627 -3.073 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.179 0 O4'-C1'-N19 111.652 3.452 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.661 -3.039 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.154 0 C4'-C3'-C2' 99.133 -3.567 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.47 -4.23 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 111.288 3.088 . 0.562 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 O4'-C1'-N19 111.224 3.024 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . 0.415 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 100.005 -2.695 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . 0.415 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.689 1 C4'-C3'-C2' 98.614 -4.086 . 0.651 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 98.917 -3.783 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.829 -3.871 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.971 3.771 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.229 0 C4'-C3'-C2' 99.543 -3.157 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.473 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.564 1 C4'-C3'-C2' 97.41 -5.29 . 0.792 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.473 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 O4'-C1'-N19 111.504 3.304 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.484 0.148 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.01 -174.43 47.07 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.24 176.33 8.03 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.918 3.079 . . . . 0.0 110.707 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.63 1.58 0.87 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 123.017 0.527 . . . . 0.0 110.84 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.29 50.84 0.99 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.116 0.566 . . . . 0.0 112.185 176.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.5 ' O ' HD22 ' A' ' 10' ' ' LEU . 56.0 Cg_endo -66.24 -20.42 55.83 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.177 1.918 . . . . 0.0 110.412 -176.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' MET . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 6' ' ' PRO . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 16' ' ' ILE . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.502 HD11 ' HD2' ' A' ' 17' ' ' LYS . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 12' ' ' GLN . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HD2' HD11 ' A' ' 13' ' ' LEU . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.705 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.617 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.617 ' H ' HD22 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.597 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.523 HG23 HD23 ' A' ' 20' ' ' LEU . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.449 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' HD21 ' A' ' 35' ' ' LEU . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.425 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.464 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.601 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -145.03 56.54 3.74 Favored Pre-proline 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.601 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -75.85 -9.55 19.61 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 124.466 3.444 . . . . 0.0 111.865 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.0 p30 -147.67 5.49 0.79 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.69 34.66 1.84 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.924 0.89 . . . . 0.0 112.815 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.2 t -139.48 -179.7 6.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.301 0.64 . . . . 0.0 111.08 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -134.04 14.22 3.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.209 0.604 . . . . 0.0 110.772 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.98 5.54 1.55 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -141.05 174.93 10.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.832 0.853 . . . . 0.0 109.696 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.8 pt? -146.6 -178.31 6.1 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.98 0.512 . . . . 0.0 111.804 -176.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -144.03 -171.68 3.61 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 109.838 -177.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -132.94 176.74 8.22 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.526 0.33 . . . . 0.0 110.969 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.86 -171.73 37.87 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -146.67 169.86 18.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.3 p -136.57 -175.18 3.93 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.681 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.408 ' N ' HD22 ' A' ' 86' ' ' LEU . 3.6 mm? -63.85 -0.93 1.19 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.632 0.773 . . . . 0.0 112.262 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 94.9 p -65.65 -9.32 26.33 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.928 0.786 . . . . 0.0 111.979 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 97.3 t -141.28 130.48 24.44 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.052 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -163.82 -175.13 3.94 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.923 0.489 . . . . 0.0 111.6 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.3 p -134.98 -178.86 5.28 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.796 1.238 . . . . 0.0 108.246 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -147.65 145.45 28.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.682 0.753 . . . . 0.0 112.137 -176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -159.95 149.31 17.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.087 1.355 . . . . 0.0 108.579 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.0 p -151.27 -178.55 6.71 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.884 0.473 . . . . 0.0 111.606 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 48.0 m -139.69 167.1 22.87 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.822 1.249 . . . . 0.0 109.016 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -147.49 8.44 0.9 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 172.32 15.13 Favored 'General case' 0 C--N 1.342 0.245 0 O-C-N 121.667 -0.646 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.17 5.77 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.644 0.778 . . . . 0.0 110.637 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -146.81 166.87 25.37 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.063 0.945 . . . . 0.0 109.466 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -153.48 144.27 15.96 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -51.74 168.7 0.3 Allowed 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 124.076 3.184 . . . . 0.0 113.764 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -147.44 164.94 31.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.768 0.427 . . . . 0.0 110.525 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -149.19 -171.54 3.91 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.844 0.858 . . . . 0.0 110.193 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.549 ' H ' HD23 ' A' ' 103' ' ' LEU . 2.0 pt? -138.59 178.09 7.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.035 0.934 . . . . 0.0 110.488 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -141.18 27.16 1.96 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.645 0.378 . . . . 0.0 110.827 -173.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -138.35 10.2 2.74 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.015 0.526 . . . . 0.0 111.547 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 172.56 178.55 42.76 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -152.31 -11.98 0.18 Allowed 'General case' 0 CA--C 1.528 0.097 0 O-C-N 122.562 -0.375 . . . . 0.0 110.805 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -160.63 163.31 32.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.327 1.051 . . . . 0.0 109.398 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.514 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 76.0 p -144.32 26.98 0.06 OUTLIER Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 109' ' ' THR . 98.5 Cg_endo -73.26 -5.36 17.02 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.861 1.707 . . . . 0.0 112.293 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -151.74 15.98 0.67 Allowed 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.094 0.558 . . . . 0.0 110.689 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -141.69 162.5 35.32 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.057 0.543 . . . . 0.0 110.593 -175.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.0 m -147.04 -0.65 0.69 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.199 0.6 . . . . 0.0 111.84 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.99 155.3 47.43 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.424 0.689 . . . . 0.0 109.446 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.41 166.39 29.56 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.792 2.994 . . . . 0.0 111.485 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.69 174.85 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 124.985 3.79 . . . . 0.0 113.293 174.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -144.9 166.58 24.86 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.296 0.638 . . . . 0.0 110.619 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -148.9 171.57 16.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.522 0.729 . . . . 0.0 110.548 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.4 p -154.1 158.17 3.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 C-N-CA 123.19 0.596 . . . . 0.0 109.46 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -176.28 -178.41 46.04 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 112.226 -0.35 . . . . 0.0 112.226 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 41.7 m -68.99 4.9 1.31 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.832 0.853 . . . . 0.0 112.009 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -148.15 166.75 26.92 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.88 -0.512 . . . . 0.0 109.908 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.75 -176.39 40.68 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.524 -0.631 . . . . 0.0 111.524 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -149.62 11.97 0.78 Allowed 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -149.82 165.18 33.29 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.819 0.447 . . . . 0.0 109.911 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.6 p -149.77 174.55 12.49 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.73 0.412 . . . . 0.0 111.038 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.97 161.22 21.87 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.004 0.922 . . . . 0.0 110.673 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.3 p -154.33 171.06 19.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.773 0.429 . . . . 0.0 110.345 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 86.4 p -151.86 172.88 15.5 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 122.166 -0.334 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.5 m 52.85 18.58 1.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.43 1.092 . . . . 0.0 113.188 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.78 178.15 44.44 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -148.93 -13.67 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.903 0.352 . . . . 0.0 111.141 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -148.5 173.66 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.705 0.802 . . . . 0.0 110.002 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.0 p -151.02 164.35 36.63 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.27 0.628 . . . . 0.0 109.669 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.0 mp 49.44 20.99 0.52 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.328 1.051 . . . . 0.0 111.497 -177.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.8 p -65.07 168.94 5.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 112.303 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.51 174.67 13.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.933 0.893 . . . . 0.0 109.584 179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 27.0 p -58.1 155.3 25.73 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.047 0.539 . . . . 0.0 110.322 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -73.93 -0.1 9.03 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.783 2.989 . . . . 0.0 112.519 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.64 153.86 58.8 Favored Pre-proline 0 C--N 1.341 0.227 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.32 175.41 9.38 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 123.375 2.717 . . . . 0.0 111.212 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.67 174.06 12.56 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 79.1 p -151.62 19.96 0.72 Allowed 'General case' 0 C--O 1.233 0.195 0 C-N-CA 122.99 0.516 . . . . 0.0 111.727 -176.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 24.3 tp -136.93 -8.55 1.82 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.197 0.453 . . . . 0.0 112.061 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.3 p -145.33 -12.76 0.53 Allowed 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.489 -0.757 . . . . 0.0 111.602 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -161.59 157.48 21.26 Favored Pre-proline 0 CA--C 1.531 0.217 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 149' ' ' LEU . 71.9 Cg_endo -71.91 171.1 17.28 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 122.972 2.448 . . . . 0.0 110.756 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.54 6.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 124.903 3.736 . . . . 0.0 114.647 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.428 ' H ' ' C ' ' A' ' 147' ' ' PRO . 85.3 mt -133.69 160.9 66.78 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.353 0.661 . . . . 0.0 110.395 -175.251 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.18 168.86 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.333 3.355 . . . . 0.0 114.531 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.4 pt -145.03 159.44 49.76 Favored Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 124.407 1.083 . . . . 0.0 108.721 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.44 160.04 51.32 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 122.719 2.279 . . . . 0.0 111.112 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.63 160.55 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.544 3.496 . . . . 0.0 113.65 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -7.29 1.05 Allowed 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 124.39 3.394 . . . . 0.0 114.639 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -142.92 71.18 19.02 Favored Pre-proline 0 C--O 1.233 0.209 0 C-N-CA 123.865 0.866 . . . . 0.0 110.282 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 73.5 Cg_exo -50.35 152.25 8.7 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.841 3.027 . . . . 0.0 113.586 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 156' ' ' PRO . 66.6 Cg_exo -52.26 158.09 5.77 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.538 2.825 . . . . 0.0 112.581 176.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.62 174.56 12.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 124.583 3.522 . . . . 0.0 110.695 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 24.8 t -151.7 172.14 16.58 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.924 0.49 . . . . 0.0 110.637 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 178.12 28.06 0.04 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -176.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -136.53 -159.17 0.93 Allowed 'General case' 0 C--O 1.231 0.117 0 C-N-CA 124.772 1.229 . . . . 0.0 108.903 -175.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -129.96 70.21 82.01 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 121.791 0.805 . . . . 0.0 111.344 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.452 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo -83.65 -9.31 10.09 Favored 'Trans proline' 0 N--CA 1.444 -1.427 1 C-N-CA 125.479 4.119 . . . . 0.0 110.597 -176.484 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' MET . . . . . 0.453 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.452 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.47 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.53 166.8 22.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 82.0 p -160.89 166.83 27.8 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.092 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.82 173.09 24.57 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 176.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -75.6 171.39 14.39 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.98 0.512 . . . . 0.0 110.304 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 39.6 m -66.26 -3.66 6.26 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 36.6 p-80 -129.28 11.31 5.89 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.55 0.34 . . . . 0.0 110.929 -177.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.14 19.13 1.24 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -59.23 156.51 12.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.585 1.154 . . . . 0.0 111.789 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.47 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.4 m120 56.64 35.28 25.88 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.9 mt -138.12 -168.92 2.46 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.347 1.059 . . . . 0.0 109.409 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.466 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 17.0 t-80 -143.14 -169.2 2.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 122.065 -0.397 . . . . 0.0 110.569 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.466 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.3 tp -132.27 10.88 4.53 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.208 0.603 . . . . 0.0 112.429 -175.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.2 mt -132.28 29.0 4.35 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.623 0.769 . . . . 0.0 109.674 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -134.91 23.64 3.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.853 0.861 . . . . 0.0 110.066 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -134.46 13.31 3.8 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.546 0.738 . . . . 0.0 110.618 -176.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -67.84 3.26 1.55 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.527 1.131 . . . . 0.0 112.793 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -67.4 18.98 0.03 OUTLIER 'General case' 0 C--N 1.342 0.248 0 C-N-CA 124.51 1.124 . . . . 0.0 113.148 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -131.49 3.46 4.23 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.122 0.419 . . . . 0.0 111.669 -176.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -147.24 10.92 1.01 Allowed 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.763 -0.586 . . . . 0.0 110.979 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.606 179.294 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 C5'-C4'-O4' 114.198 3.57 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.151 0 C4'-C3'-C2' 99.047 -3.653 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 O4'-C1'-N19 111.605 3.405 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.153 -3.547 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.031 1 O4'-C1'-N19 112.892 4.692 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C4'-C3'-C2' 99.24 -3.46 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.882 0 C4'-C3'-C2' 99.263 -3.437 . 0.675 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.512 -3.188 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.597 -3.103 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.215 0 C4'-C3'-C2' 99.369 -3.331 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 98.775 -3.925 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 O4'-C1'-N19 111.945 3.745 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.702 0 C4'-C3'-C2' 99.501 -3.199 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 0 C4'-C3'-C2' 99.551 -3.149 . 0.729 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.016 0 C4'-C3'-C2' 99.302 -3.398 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 98.969 -3.731 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.423 -3.277 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C4'-C3'-C2' 99.622 -3.078 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 C4'-C3'-C2' 99.142 -3.558 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 C4'-C3'-C2' 99.594 -3.106 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.187 0 C4'-C3'-C2' 99.703 -2.997 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C4'-C3'-C2' 99.121 -3.579 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 C4'-C3'-C2' 98.864 -3.836 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C5'-C4'-C3' 110.323 -3.452 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.102 2.902 . 0.879 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.034 -3.666 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.53 0 C4'-C3'-C2' 98.718 -3.982 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.983 0 C4'-C3'-C2' 99.121 -3.579 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.18 -3.52 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 O4'-C1'-N19 111.163 2.963 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.748 -2.952 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.01 0 C4'-C3'-C2' 98.79 -3.91 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.106 -3.594 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.433 0 N19-C1'-C2' 110.18 -2.012 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.555 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.183 1 C5'-C4'-C3' 107.895 -5.07 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.555 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.413 -3.374 2 C5'-C4'-C3' 108.572 -4.619 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 016 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.656 0 C4'-C3'-C2' 100.27 -2.43 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C4'-C3'-C2' 99.942 -2.758 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.756 0 C4'-C3'-C2' 99.078 -3.622 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 1 C4'-C3'-C2' 98.536 -4.164 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 N19-C1'-C2' 108.374 -3.141 . 0.734 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C4'-C3'-C2' 99.488 -3.212 . 0.89 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 98.744 -3.956 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.225 -3.475 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.677 0 C4'-C3'-C2' 98.856 -3.844 . 0.895 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.719 1 C4'-C3'-C2' 98.496 -4.204 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.479 -3.221 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.466 -3.234 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.7 0 C4'-C3'-C2' 99.755 -2.945 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.13 2 O4'-C1'-N19 113.177 4.977 . 0.802 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.819 -2.881 . 0.488 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C5'-C4'-C3' 110.987 -3.008 . 0.726 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.497 0 C4'-C3'-C2' 99.377 -3.323 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.407 -2.066 0 O4'-C1'-N19 111.98 3.78 . 0.898 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.453 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.46 0 O4'-C1'-N19 111.802 3.602 . 0.511 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C4'-C3'-C2' 99.328 -3.372 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C4'-C3'-C2' 99.452 -3.248 . 0.653 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.034 0 C4'-C3'-C2' 99.316 -3.384 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 112.018 3.818 . 0.844 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C4'-C3'-C2' 99.219 -3.481 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 98.919 -3.781 . 0.622 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 C4'-C3'-C2' 99.605 -3.095 . 0.558 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 99.721 -2.979 . 0.87 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.482 -3.218 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.243 -3.457 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C4'-C3'-C2' 99.058 -3.642 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 1 C4'-C3'-C2' 98.285 -4.415 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 1 O4'-C1'-N19 112.397 4.197 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.517 -3.183 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.439 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.058 1 C4'-C3'-C2' 97.644 -5.056 . 0.697 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.439 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.044 1 O4'-C1'-N19 112.325 4.125 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo . . . . . 0 N--CA 1.472 0.259 0 N-CA-C 113.01 0.35 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.01 -64.85 0.08 OUTLIER Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.85 177.56 7.5 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.715 2.943 . . . . 0.0 110.209 175.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -130.82 16.33 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 123.666 0.786 . . . . 0.0 111.022 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.3 tp 44.73 56.78 14.47 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 124.058 0.943 . . . . 0.0 111.921 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.63 -11.15 24.09 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.6 2.2 . . . . 0.0 111.706 -177.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.694 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.609 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.574 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.574 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.609 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG23 HD23 ' A' ' 20' ' ' LEU . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -148.98 59.33 4.04 Favored Pre-proline 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -79.95 -13.89 12.63 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 124.834 3.69 . . . . 0.0 111.673 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 52.04 10.87 0.13 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.952 1.701 . . . . 0.0 113.684 -175.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.98 11.77 0.3 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.568 0.347 . . . . 0.0 111.894 -178.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.3 t -151.09 178.91 8.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 122.066 -0.396 . . . . 0.0 110.15 -175.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -142.3 21.38 2.06 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.983 1.313 . . . . 0.0 110.316 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.17 6.26 1.01 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -62.02 167.15 4.06 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.428 0.632 . . . . 0.0 111.806 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.441 ' C ' ' H ' ' A' ' 82' ' ' MET . 2.4 pt? -149.85 15.51 0.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.69 0.796 . . . . 0.0 112.14 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.45 19.49 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.409 1.084 . . . . 0.0 112.708 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' MET . . . . . 0.441 ' H ' ' C ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -138.78 15.22 2.7 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.284 1.434 . . . . 0.0 110.812 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -157.3 -169.75 21.44 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.7 mtp-105 -63.03 169.68 3.22 Favored 'General case' 0 C--N 1.339 0.114 0 CA-C-O 121.218 0.532 . . . . 0.0 111.156 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -137.73 -174.31 3.74 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 109.503 -177.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.21 152.93 45.01 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.1 p -156.9 178.64 10.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.67 0.788 . . . . 0.0 110.131 179.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -68.58 172.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.672 0.789 . . . . 0.0 111.77 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -142.96 22.45 1.92 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.052 0.541 . . . . 0.0 110.934 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -140.96 9.54 2.14 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 122.792 0.437 . . . . 0.0 111.568 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.49 -18.26 63.68 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.877 -0.514 . . . . 0.0 111.633 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -67.45 157.97 32.92 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.634 0.374 . . . . 0.0 111.11 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -157.16 170.14 23.19 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.744 0.418 . . . . 0.0 110.415 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.5 p -69.08 172.44 6.76 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.879 0.872 . . . . 0.0 112.163 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -143.41 19.1 1.88 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.419 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -143.97 157.72 44.16 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.338 0.655 . . . . 0.0 109.568 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.38 167.95 25.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.55 0.34 . . . . 0.0 110.488 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -152.62 20.72 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.415 0.686 . . . . 0.0 110.147 -178.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -56.77 153.31 22.74 Favored Pre-proline 0 CA--C 1.535 0.393 0 O-C-N 121.893 -0.505 . . . . 0.0 111.038 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.4 158.14 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 124.023 3.149 . . . . 0.0 113.7 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -147.51 11.27 0.99 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.948 0.899 . . . . 0.0 109.746 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.0 t -151.13 174.86 12.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.991 0.916 . . . . 0.0 109.268 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 54.6 tp -149.95 156.55 41.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -151.88 162.2 41.43 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.159 0.584 . . . . 0.0 109.74 177.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -89.8 -10.41 45.57 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 73.48 -173.6 49.05 Favored Glycine 0 CA--C 1.531 1.08 0 O-C-N 121.84 -0.538 . . . . 0.0 111.95 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -157.82 169.55 24.36 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.886 0.874 . . . . 0.0 109.828 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -152.49 -22.51 0.17 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.463 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 67.2 p -144.4 37.15 0.22 Allowed Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 109' ' ' THR . 93.2 Cg_endo -71.1 146.97 53.3 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.665 2.243 . . . . 0.0 110.729 -176.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -165.1 -37.42 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.03 0.532 . . . . 0.0 111.093 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -148.65 169.94 19.26 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.887 0.875 . . . . 0.0 108.647 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.6 m -146.01 9.52 1.13 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.561 0.344 . . . . 0.0 111.095 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -155.62 136.73 9.2 Favored Pre-proline 0 CA--C 1.533 0.295 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.476 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 68.9 Cg_endo -70.77 144.18 47.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.213 1.942 . . . . 0.0 111.967 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 115' ' ' PRO . 31.6 Cg_exo -60.47 13.72 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.7 1 C-N-CA 125.357 4.038 . . . . 0.0 115.301 174.335 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -135.58 166.41 23.28 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.321 -0.862 . . . . 0.0 111.499 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.24 169.68 5.42 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.826 0.85 . . . . 0.0 112.416 -177.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -140.71 -16.18 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.625 0.77 . . . . 0.0 110.348 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 160.77 -0.18 0.07 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.29 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 98.2 p -152.64 -171.08 3.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 117.705 0.752 . . . . 0.0 110.498 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -129.86 26.11 5.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.622 0.769 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -137.85 26.75 2.85 Favored Glycine 0 C--N 1.34 0.753 0 C-N-CA 124.56 1.076 . . . . 0.0 110.692 179.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.25 16.71 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.684 1.593 . . . . 0.0 111.893 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -138.84 164.64 29.12 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.488 0.715 . . . . 0.0 109.976 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.9 p -146.73 -177.84 5.86 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 122.511 0.324 . . . . 0.0 111.362 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -55.37 156.25 4.55 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.704 0.801 . . . . 0.0 112.251 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 79.4 p -156.83 174.57 15.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.79 0.836 . . . . 0.0 110.048 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -152.27 172.54 16.27 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 177.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.2 m -141.7 17.54 2.17 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.753 0.821 . . . . 0.0 111.626 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.19 174.9 34.74 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -64.16 -6.14 6.09 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.338 0.655 . . . . 0.0 112.081 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 p -64.05 -6.22 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 123.67 0.788 . . . . 0.0 111.612 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.2 m -142.73 13.72 1.92 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.556 0.616 . . . . 0.0 112.242 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.6 mp -134.54 164.53 27.28 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.038 -0.414 . . . . 0.0 110.612 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.9 m -72.06 0.74 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 112.46 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 52.08 23.18 2.14 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.24 1.016 . . . . 0.0 112.633 -178.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t -56.78 142.64 71.75 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.435 0.694 . . . . 0.0 111.243 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.33 -5.9 18.03 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.977 3.118 . . . . 0.0 112.271 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.3 136.84 88.68 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -68.77 170.03 16.27 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.402 2.734 . . . . 0.0 111.862 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -143.75 17.27 1.81 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.499 -178.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 33.8 t -150.82 153.69 35.87 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.846 0.458 . . . . 0.0 110.667 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 tp -159.34 157.63 30.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.065 0.946 . . . . 0.0 108.747 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.2 p -142.48 131.35 22.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -152.99 156.13 32.53 Favored Pre-proline 0 CA--C 1.529 0.141 0 C-N-CA 124.66 1.184 . . . . 0.0 109.168 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.97 165.98 30.58 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.657 2.238 . . . . 0.0 110.11 175.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.39 157.49 4.7 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.365 2.71 . . . . 0.0 112.642 175.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.92 50.86 4.65 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 123.508 0.723 . . . . 0.0 110.936 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -68.51 172.04 12.04 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.272 2.648 . . . . 0.0 111.111 -178.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.87 165.4 31.21 Favored Pre-proline 0 C--O 1.233 0.229 0 C-N-CA 123.621 0.768 . . . . 0.0 109.429 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.92 160.34 1.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.466 2.778 . . . . 0.0 113.7 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 158.02 5.39 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.965 3.11 . . . . 0.0 113.747 -177.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.0 171.54 0.11 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 124.89 3.726 . . . . 0.0 113.381 174.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -48.01 134.89 11.61 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.318 0.647 . . . . 0.0 110.378 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.88 168.79 23.5 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.983 3.122 . . . . 0.0 112.184 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -51.83 157.76 5.34 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.982 3.121 . . . . 0.0 112.713 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.66 39.49 0.64 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.604 3.536 . . . . 0.0 110.927 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.0 m -123.11 23.41 9.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.58 0.752 . . . . 0.0 111.134 -173.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -145.58 164.73 28.06 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.55 163.24 24.0 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.141 0.577 . . . . 0.0 111.519 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -67.9 135.12 92.01 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.454 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.407 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 56.3 Cg_endo -73.56 -13.31 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.976 2.451 . . . . 0.0 111.542 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' MET . . . . . 0.41 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.488 ' OE1' ' HE2' ' A' ' 188' ' ' LYS . 11.0 pt-20 -122.14 159.0 28.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.7 m -149.21 160.93 42.95 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.916 0.886 . . . . 0.0 109.713 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 116.32 176.9 18.13 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -79.59 -77.65 0.18 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 18.1 t -165.8 -31.19 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.348 0.659 . . . . 0.0 109.989 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -84.9 2.42 42.77 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.8 22.0 1.0 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.775 0.322 . . . . 0.0 110.267 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' LYS . . . . . 0.488 ' HE2' ' OE1' ' A' ' 181' ' ' GLU . 31.8 tptt -58.13 161.77 3.92 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.706 0.803 . . . . 0.0 110.884 -175.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 201' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 219' ' ' ALA . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 205' ' ' GLY . . . . . 0.418 ' HA3' ' HB2' ' A' ' 210' ' ' LEU . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 210' ' ' LEU . . . . . 0.418 ' HB2' ' HA3' ' A' ' 205' ' ' GLY . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.407 ' HA ' ' CE2' ' A' ' 201' ' ' PHE . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.3 m120 56.76 33.09 22.4 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -138.14 -161.56 1.19 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.923 1.289 . . . . 0.0 110.143 -174.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 227' ' ' HIS . . . . . 0.645 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 13.2 t-80 -144.93 -164.57 1.96 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.367 0.667 . . . . 0.0 109.679 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.645 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 24.2 tp -127.96 33.8 4.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.4 tp -136.08 164.73 27.35 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -147.33 -171.39 3.78 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.927 0.491 . . . . 0.0 110.566 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -140.11 172.43 12.77 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.446 0.698 . . . . 0.0 110.63 -175.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -120.79 -2.67 9.79 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 122.587 0.355 . . . . 0.0 110.873 -177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 54.54 12.26 0.52 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.079 1.352 . . . . 0.0 114.127 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -155.9 -0.57 0.14 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.703 0.401 . . . . 0.0 111.54 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -156.77 172.88 17.83 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 121.606 -0.684 . . . . 0.0 109.589 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 116.617 -1.658 . . . . 0.0 110.276 -178.761 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C5'-C4'-O4' 113.929 3.378 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.038 0 O4'-C1'-N19 111.537 3.337 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.445 3.245 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.652 -3.048 . 0.709 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 O4'-C1'-N19 111.637 3.437 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.325 0 C4'-C3'-C2' 98.795 -3.905 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.249 0 C4'-C3'-C2' 99.241 -3.459 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.141 -3.559 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 100.016 -2.684 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.033 -3.667 . 0.612 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 C4'-C3'-C2' 98.877 -3.823 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.476 0 C4'-C3'-C2' 99.361 -3.339 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.418 -3.282 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 C4'-C3'-C2' 98.856 -3.844 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 C4'-C3'-C2' 98.972 -3.728 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 98.94 -3.76 . 0.684 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C4'-C3'-C2' 99.14 -3.56 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 98.95 -3.75 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.092 0 C4'-C3'-C2' 99.591 -3.109 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.565 -3.135 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.444 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.333 0 C4'-C3'-C2' 99.379 -3.321 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.444 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 C4'-C3'-C2' 99.187 -3.513 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.108 1 O4'-C1'-N19 113.086 4.886 . 0.68 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.791 -2.909 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.499 -3.201 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.083 0 C4'-C3'-C2' 98.859 -3.841 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.654 0 C4'-C3'-C2' 99.118 -3.582 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 110.774 2.574 . 0.907 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.288 -3.412 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 111.629 3.429 . 0.587 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 C4'-C3'-C2' 99.813 -2.887 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.482 1 C4'-C3'-C2' 98.617 -4.083 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C4'-C3'-C2' 99.459 -3.241 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . 0.467 " H1'" ' N6 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C5'-C4'-C3' 112.006 -2.33 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.522 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.094 1 C5'-C4'-C3' 109.343 -4.105 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.522 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.41 -3.558 2 C3'-C2'-C1' 105.668 4.631 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.53 0 C5'-C4'-C3' 112.545 -1.97 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.467 ' N6 ' " H1'" ' B' ' 270' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.414 -3.227 0 C4'-C3'-C2' 99.863 -2.837 . 0.841 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 C4'-C3'-C2' 98.973 -3.727 . 0.667 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.275 -3.425 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.417 0 O4'-C1'-N19 111.951 3.751 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 C4'-C3'-C2' 99.858 -2.842 . 0.914 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.965 -3.735 . 0.844 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 98.863 -3.837 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.934 -3.766 . 0.871 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.114 0 C4'-C3'-C2' 99.594 -3.106 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.253 -3.447 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 C4'-C3'-C2' 99.636 -3.064 . 0.845 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C5'-C4'-C3' 111.297 -2.802 . 0.896 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 1 O4'-C1'-N19 112.503 4.303 . 0.529 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 O4'-C1'-N19 112.011 3.811 . 0.507 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 100.263 -2.437 . 0.831 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 111.542 3.342 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 C4'-C3'-C2' 98.825 -3.875 . 0.882 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . 0.41 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 O4'-C1'-N19 111.911 3.711 . 0.421 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.476 1 C4'-C3'-C2' 98.644 -4.056 . 0.732 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.168 0 C4'-C3'-C2' 99.951 -2.749 . 0.562 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.449 0 C4'-C3'-C2' 99.415 -3.285 . 0.67 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 110.916 2.716 . 0.87 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.635 3.435 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.164 0 C4'-C3'-C2' 99.053 -3.647 . 0.662 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.534 -3.166 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C5'-C4'-C3' 111.568 -2.621 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C4'-C3'-C2' 99.13 -3.57 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.748 -3.952 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 98.848 -3.852 . 0.649 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.292 0 C4'-C3'-C2' 99.075 -3.625 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 1 O4'-C1'-N19 112.266 4.066 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.022 -3.678 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.462 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 C4'-C3'-C2' 97.329 -5.371 . 0.685 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.462 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.708 1 O4'-C1'-N19 112.445 4.245 . 0.765 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.52 -0.221 0 CA-C-O 120.961 0.317 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.81 178.52 48.51 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.45 123.75 10.85 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.573 3.516 . . . . 0.0 111.868 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.4 p -154.28 11.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.033 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -140.23 156.35 70.0 Favored Pre-proline 0 C--O 1.23 0.059 0 C-N-CA 124.026 0.93 . . . . 0.0 110.068 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.02 -39.7 7.55 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.558 2.172 . . . . 0.0 108.986 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HD2' HD12 ' A' ' 20' ' ' LEU . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.6 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.586 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.586 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.628 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.473 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.628 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG2' HD23 ' A' ' 24' ' ' LEU . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.447 ' CG2' HD23 ' A' ' 20' ' ' LEU . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.433 HG21 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.433 ' CE2' HG21 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -146.02 64.25 9.85 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.5 4.98 2.17 Favored 'Trans proline' 0 CA--C 1.536 0.607 1 C-N-CA 125.364 4.043 . . . . 0.0 112.531 -177.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -144.36 -176.58 5.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.233 0.613 . . . . 0.0 110.385 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -142.76 174.81 10.32 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.184 0.594 . . . . 0.0 110.033 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.3 p -149.79 12.56 0.79 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.434 0.294 . . . . 0.0 111.629 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -147.86 162.34 39.47 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 178.01 10.05 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.059 0.944 . . . . 0.0 109.91 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -146.75 175.08 10.89 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.201 0.6 . . . . 0.0 110.148 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.2 mt -140.3 13.78 2.39 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.703 0.801 . . . . 0.0 110.24 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.87 159.41 44.4 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.567 0.347 . . . . 0.0 110.925 -178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 24.3 ptp -160.73 -178.09 6.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 122.986 0.514 . . . . 0.0 110.387 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -170.54 171.64 43.76 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 ttm180 -156.9 164.7 37.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.202 0.601 . . . . 0.0 110.317 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.3 m -71.43 -5.26 31.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.693 0.797 . . . . 0.0 111.932 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 89.2 mt 49.41 32.48 4.66 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.549 0.74 . . . . 0.0 112.399 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.0 t -130.69 14.65 5.39 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.512 0.725 . . . . 0.0 109.402 178.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 8.3 p -147.65 27.85 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.962 1.305 . . . . 0.0 108.919 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -131.9 8.55 4.47 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.412 -176.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.2 m 48.97 26.56 1.38 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.774 1.23 . . . . 0.0 112.919 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -65.59 -16.78 64.04 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.886 -0.509 . . . . 0.0 110.461 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -158.71 178.26 10.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.251 1.02 . . . . 0.0 108.811 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 81.8 p -139.21 178.45 7.17 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 122.62 0.368 . . . . 0.0 110.918 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.8 p -139.47 13.24 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.274 0.63 . . . . 0.0 111.431 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 55.41 -175.62 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.624 1.17 . . . . 0.0 113.26 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -152.31 152.02 31.6 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.606 0.762 . . . . 0.0 109.396 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.15 7.5 0.39 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 122.555 0.342 . . . . 0.0 111.18 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -149.6 173.55 13.52 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -143.9 155.01 59.34 Favored Pre-proline 0 N--CA 1.454 -0.226 0 C-N-CA 123.255 0.622 . . . . 0.0 109.976 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.05 8.65 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 124.254 3.303 . . . . 0.0 112.784 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -148.94 159.61 44.04 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.236 0.615 . . . . 0.0 110.342 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 77.4 p -143.17 -2.68 0.99 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.704 0.802 . . . . 0.0 112.11 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.09 161.01 25.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.195 0.452 . . . . 0.0 110.076 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.53 -179.47 7.81 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.743 0.417 . . . . 0.0 110.692 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -144.82 -178.32 5.96 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.429 0.691 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.38 -158.87 9.25 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -128.46 7.92 5.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.643 0.377 . . . . 0.0 111.734 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 49.97 -163.11 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.846 1.258 . . . . 0.0 113.592 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 5.2 t -43.42 138.01 2.87 Favored Pre-proline 0 C--N 1.34 0.189 0 C-N-CA 125.699 1.6 . . . . 0.0 112.387 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -79.01 2.4 8.32 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.98 3.12 . . . . 0.0 111.964 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.8 t0 54.86 28.35 10.3 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.17 0.588 . . . . 0.0 111.957 -177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -142.58 159.31 42.47 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.822 1.249 . . . . 0.0 108.828 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.9 p -150.44 163.66 37.83 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -163.03 154.57 14.96 Favored Pre-proline 0 N--CA 1.456 -0.15 0 C-N-CA 124.26 1.024 . . . . 0.0 109.17 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -70.23 156.65 61.64 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.64 2.227 . . . . 0.0 110.219 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.82 175.09 11.75 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 123.735 2.957 . . . . 0.0 111.09 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -143.16 15.17 1.87 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.001 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -146.63 169.21 19.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.345 0.658 . . . . 0.0 109.448 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 57.7 t -141.47 151.05 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 122.787 0.435 . . . . 0.0 109.833 -177.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -179.96 -173.22 44.76 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.0 t -152.59 168.04 26.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.119 0.459 . . . . 0.0 110.738 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -144.24 9.01 1.42 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.041 0.536 . . . . 0.0 111.094 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.42 -173.24 41.0 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 -177.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -143.31 2.76 1.3 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -67.16 0.24 2.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.752 0.821 . . . . 0.0 111.476 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.4 m -136.3 14.75 3.24 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.354 0.662 . . . . 0.0 111.252 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -142.36 -1.9 1.15 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.848 0.459 . . . . 0.0 111.563 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 60.9 m -145.1 5.69 1.12 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.506 0.722 . . . . 0.0 110.697 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.0 m -148.48 177.87 9.09 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.903 0.881 . . . . 0.0 110.635 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.8 p -148.43 168.46 22.61 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.894 0.878 . . . . 0.0 110.56 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 173.14 -161.69 32.8 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -141.71 158.07 44.27 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 5.3 p -149.09 6.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.445 0.698 . . . . 0.0 110.061 -176.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.3 t -66.44 8.28 0.25 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.772 0.829 . . . . 0.0 112.705 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.1 mt -135.12 11.12 3.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.164 0.586 . . . . 0.0 111.042 -178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 63.8 p -147.57 5.85 0.82 Allowed 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.62 -0.08 0.85 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.644 0.656 . . . . 0.0 112.469 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.9 p -158.83 160.79 29.1 Favored Pre-proline 0 C--O 1.234 0.249 0 O-C-N 122.06 -0.4 . . . . 0.0 110.729 179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.23 163.43 4.64 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.63 2.886 . . . . 0.0 112.157 173.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 26.7 m -59.99 152.78 58.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.673 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -77.22 0.34 9.84 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.827 3.018 . . . . 0.0 111.604 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.98 163.29 17.51 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 121.434 0.635 . . . . 0.0 111.628 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 66.7 p -84.49 178.73 7.61 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.26 0.624 . . . . 0.0 110.743 178.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 45.62 40.39 5.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.39 1.076 . . . . 0.0 111.832 178.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 6.2 t -121.2 4.5 10.33 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.597 0.359 . . . . 0.0 111.887 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 36.26 66.73 1.8 Allowed Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 125.626 1.57 . . . . 0.0 112.496 177.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.15 165.79 31.28 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.611 2.874 . . . . 0.0 110.814 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -50.96 155.58 5.77 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.118 3.212 . . . . 0.0 112.794 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.421 ' N ' HD23 ' A' ' 149' ' ' LEU . 2.1 pt? -152.78 153.53 30.23 Favored Pre-proline 0 CA--C 1.531 0.212 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.13 9.62 2.02 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.292 3.328 . . . . 0.0 113.764 -171.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.3 tt -56.78 138.23 77.97 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 118.401 0.546 . . . . 0.0 109.628 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -51.28 133.98 43.44 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.858 2.372 . . . . 0.0 111.438 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.68 166.65 25.22 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.93 3.087 . . . . 0.0 110.552 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.02 173.14 14.11 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.994 2.463 . . . . 0.0 109.836 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -153.04 143.65 15.7 Favored Pre-proline 0 C--O 1.233 0.224 0 O-C-N 121.634 -0.666 . . . . 0.0 110.404 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -52.55 166.85 0.68 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.474 3.449 . . . . 0.0 112.684 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.07 155.61 5.98 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.71 2.94 . . . . 0.0 111.969 177.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.37 15.05 0.68 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.877 3.718 . . . . 0.0 111.685 -177.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 30.6 m -63.53 -5.69 4.16 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -176.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 90.54 11.65 62.05 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 118.574 0.625 . . . . 0.0 112.17 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -146.93 -175.6 4.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 117.439 0.62 . . . . 0.0 111.393 -178.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.436 ' HB2' ' HD2' ' A' ' 163' ' ' PRO . 51.7 p-10 -128.05 159.81 64.85 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.436 ' HD2' ' HB2' ' A' ' 162' ' ' ASN . 59.8 Cg_endo -70.69 -13.81 32.64 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.755 2.303 . . . . 0.0 110.767 -175.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.424 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.411 ' HB2' ' HE2' ' A' ' 188' ' ' LYS . 0.0 OUTLIER -136.39 159.72 40.92 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.4 p -165.1 165.29 20.02 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.158 0.583 . . . . 0.0 109.9 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 123.39 175.75 14.59 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 177.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.37 159.63 34.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 49.4 m -61.99 -6.72 3.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -127.04 12.93 7.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.365 0.266 . . . . 0.0 110.68 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.72 15.59 1.1 Allowed 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 181' ' ' GLU . 63.6 tttt -61.29 158.74 13.64 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.386 1.074 . . . . 0.0 112.285 -176.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 193' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 167' ' ' LEU . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 32.92 22.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.7 mt -132.09 -172.64 2.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.729 0.811 . . . . 0.0 110.573 -175.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -145.77 18.44 1.46 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.954 0.501 . . . . 0.0 111.549 -177.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 228' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 228' ' ' LEU . 15.0 tp 50.14 31.7 5.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.596 1.158 . . . . 0.0 111.9 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 70.7 mt 61.51 8.1 2.09 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.897 1.679 . . . . 0.0 113.497 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.89 155.34 36.7 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.344 -0.847 . . . . 0.0 110.365 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -158.73 170.04 23.04 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.066 -0.396 . . . . 0.0 110.531 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -91.22 0.97 57.43 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.989 0.516 . . . . 0.0 111.501 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -143.56 176.32 9.29 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.564 0.746 . . . . 0.0 109.17 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -151.1 161.96 41.75 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.618 0.247 . . . . 0.0 111.484 -174.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.36 160.08 42.95 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.102 0.961 . . . . 0.0 109.437 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.861 179.105 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.118 -3.582 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.204 -3.496 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C4'-C3'-C2' 99.595 -3.105 . 0.847 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.215 -3.485 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.865 3.665 . 0.599 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.765 -3.935 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.905 -3.795 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.376 -3.324 . 0.713 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 C4'-C3'-C2' 99.702 -2.998 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.364 0 O4'-C1'-N19 111.548 3.348 . 0.524 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 O4'-C1'-N19 111.756 3.556 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 O4'-C1'-N19 111.349 3.149 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.894 0 C4'-C3'-C2' 99.872 -2.828 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.524 -3.176 . 0.775 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.416 -3.284 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.088 -3.612 . 0.631 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.396 0 C4'-C3'-C2' 98.973 -3.727 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.6 -3.1 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.429 0 O4'-C1'-N19 111.031 2.831 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.253 -3.447 . 0.626 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.936 0 C4'-C3'-C2' 99.409 -3.291 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 C4'-C3'-C2' 98.385 -4.315 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 99.083 -3.617 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.42 0 C4'-C3'-C2' 99.939 -2.761 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C4'-C3'-C2' 99.647 -3.053 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.112 -3.588 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C4'-C3'-C2' 98.805 -3.895 . 0.878 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C4'-C3'-C2' 99.937 -2.763 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.646 -3.054 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.425 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.805 0 C4'-C3'-C2' 99.663 -3.037 . 0.667 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.557 -3.143 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.831 -2.869 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 0 N19-C1'-C2' 108.7 -2.938 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.584 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.542 2.455 1 C4'-C3'-O3' 121.345 4.133 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.584 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.921 3 P-O3'-C3' 125.399 4.749 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 018 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.583 0 C4'-C3'-C2' 99.894 -2.806 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C4'-C3'-C2' 99.694 -3.006 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 C4'-C3'-C2' 98.93 -3.77 . 0.581 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . 0.41 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.392 1 C4'-C3'-C2' 98.545 -4.155 . 0.684 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.528 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 100.023 -2.677 . 0.55 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.528 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 99.7 -3.0 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.663 1 C4'-C3'-C2' 98.383 -4.317 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 98.978 -3.722 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.578 1 C4'-C3'-C2' 98.556 -4.144 . 0.906 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.01 -3.69 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.344 0 C4'-C3'-C2' 99.393 -3.307 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C4'-C3'-C2' 99.214 -3.486 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.014 0 C4'-C3'-C2' 100.095 -2.605 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.545 1 O4'-C1'-N19 113.075 4.875 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.424 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.539 -3.161 . 0.542 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.424 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.285 0 C4'-C3'-C2' 99.9 -2.8 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.102 0 O4'-C1'-N19 111.392 3.192 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.149 -3.551 . 0.864 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.761 -2.939 . 0.496 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.275 -3.425 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.519 -3.181 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 1 O4'-C1'-N19 112.227 4.027 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.495 3.295 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.264 0 C4'-C3'-C2' 99.443 -3.257 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C4'-C3'-C2' 99.136 -3.564 . 0.662 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 0 O4'-C1'-N19 112.007 3.807 . 0.584 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 C4'-C3'-C2' 99.473 -3.227 . 0.86 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C4'-C3'-C2' 99.356 -3.344 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 C4'-C3'-C2' 98.815 -3.885 . 0.653 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.899 0 C4'-C3'-C2' 99.255 -3.445 . 0.668 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.112 -3.588 . 0.789 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.877 0 C4'-C3'-C2' 98.782 -3.918 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.977 -2.723 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.455 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.459 1 C4'-C3'-C2' 97.849 -4.851 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.455 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.989 0 O4'-C1'-N19 111.75 3.55 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.983 0.34 . . . . 0.0 112.983 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.4 177.54 48.3 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 178.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -50.89 156.98 4.14 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 124.928 3.752 . . . . 0.0 114.083 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.8 p -154.0 136.35 6.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp 41.73 54.86 8.69 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.467 0.707 . . . . 0.0 111.718 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.8 -16.99 37.65 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.646 2.897 . . . . 0.0 111.821 -173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.504 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.7 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.7 ' N ' HD22 ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.573 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.573 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.601 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.457 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.601 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.494 ' HG2' HD23 ' A' ' 24' ' ' LEU . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.523 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.559 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 53' ' ' THR . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 52' ' ' PRO 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.493 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.783 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 10.5 m-85 -144.21 54.54 2.85 Favored Pre-proline 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.783 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 72.0 Cg_endo -68.73 -5.4 15.33 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 124.87 3.714 . . . . 0.0 112.884 -178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -149.4 17.96 0.93 Allowed 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.79 -0.569 . . . . 0.0 110.895 -177.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.78 172.2 15.02 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.915 -0.49 . . . . 0.0 110.876 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 88.9 p -155.94 6.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.16 -2.61 19.32 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.8 -0.563 . . . . 0.0 111.777 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.9 174.92 13.01 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.62 0.768 . . . . 0.0 109.672 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -157.1 177.06 11.92 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.899 0.48 . . . . 0.0 111.642 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.8 tp -152.43 166.14 32.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.892 1.277 . . . . 0.0 107.878 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.07 157.64 44.34 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.314 0.578 . . . . 0.0 110.735 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 84.2 mtp -146.52 24.6 1.24 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.063 0.945 . . . . 0.0 110.229 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.23 174.55 23.76 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 111.339 -0.704 . . . . 0.0 111.339 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -154.4 -175.9 5.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.113 0.565 . . . . 0.0 111.226 -175.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.0 m -53.79 155.51 3.24 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 124.573 1.149 . . . . 0.0 110.913 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 97.0 mt -134.11 178.52 6.9 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.869 0.868 . . . . 0.0 110.174 -177.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.7 t -149.92 -170.72 3.72 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.456 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -57.38 168.41 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.239 0.616 . . . . 0.0 111.781 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -145.41 174.49 11.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.435 0.694 . . . . 0.0 109.614 -175.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.1 t -145.16 166.64 24.83 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 123.034 0.534 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -153.17 -175.67 5.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.532 0.733 . . . . 0.0 109.392 -175.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -134.26 169.41 17.24 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.16 0.505 . . . . 0.0 110.848 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 t -149.79 -176.0 5.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.756 0.822 . . . . 0.0 109.035 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.0 m -140.44 177.55 7.93 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.376 0.608 . . . . 0.0 111.823 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.79 179.15 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.502 0.721 . . . . 0.0 110.046 -177.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.58 165.63 26.74 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.2 0.6 . . . . 0.0 111.141 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.22 169.82 11.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.956 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -153.94 165.11 37.13 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.407 0.683 . . . . 0.0 109.776 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -145.61 154.62 52.55 Favored Pre-proline 0 N--CA 1.456 -0.148 0 C-N-CA 122.905 0.482 . . . . 0.0 109.903 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.51 171.86 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.919 3.08 . . . . 0.0 111.256 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -151.59 163.8 38.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.725 0.81 . . . . 0.0 109.775 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.6 p -146.47 171.72 14.62 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.375 0.67 . . . . 0.0 110.198 -177.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.7 mt -141.56 168.31 20.08 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.118 0.967 . . . . 0.0 109.614 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -146.48 176.36 9.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 122.561 0.344 . . . . 0.0 110.329 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -62.91 169.1 3.46 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.244 0.618 . . . . 0.0 112.0 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.51 -176.53 38.88 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.77 149.28 40.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 111.267 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -157.27 168.06 28.51 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.423 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 10.2 t -149.46 144.41 17.85 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.56 173.99 12.39 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 C-N-CA 123.639 2.893 . . . . 0.0 110.764 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -151.43 168.87 23.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.927 0.491 . . . . 0.0 110.196 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -144.78 174.48 10.95 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.535 0.734 . . . . 0.0 110.042 -177.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.2 m -144.0 159.05 43.26 Favored 'General case' 0 C--N 1.337 0.065 0 C-N-CA 122.907 0.483 . . . . 0.0 110.806 -178.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -73.32 155.88 89.49 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.03 165.45 32.34 Favored 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 123.416 2.744 . . . . 0.0 110.163 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -70.74 174.12 10.83 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.922 3.081 . . . . 0.0 111.405 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.29 170.44 15.98 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.585 0.754 . . . . 0.0 110.05 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -143.29 -176.46 4.94 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.488 0.715 . . . . 0.0 111.216 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.76 12.61 2.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 122.742 0.417 . . . . 0.0 110.628 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.95 170.42 34.82 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 51.0 m -148.38 13.06 0.95 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.777 0.431 . . . . 0.0 111.513 -175.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -146.78 163.52 35.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.127 0.489 . . . . 0.0 110.575 -176.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 179.29 28.22 0.05 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -144.3 45.33 1.42 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.225 0.61 . . . . 0.0 110.288 -175.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -133.9 32.14 3.54 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.157 0.583 . . . . 0.0 110.753 -176.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.3 p -137.95 168.67 19.23 Favored 'General case' 0 N--CA 1.461 0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.967 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -82.07 8.28 11.17 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.901 0.48 . . . . 0.0 111.997 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 42.0 m 54.97 31.19 15.48 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.989 0.915 . . . . 0.0 112.133 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.7 m -135.43 11.04 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.227 0.611 . . . . 0.0 111.195 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 37.4 m -69.57 -2.7 12.19 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.329 0.252 . . . . 0.0 111.673 178.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -174.07 171.02 44.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -155.02 13.43 0.39 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 121.059 0.457 . . . . 0.0 111.117 -179.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.86 28.23 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.172 0.511 . . . . 0.0 110.585 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.2 t -133.77 13.73 4.02 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.072 0.549 . . . . 0.0 110.955 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -133.69 5.88 3.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.155 0.582 . . . . 0.0 110.669 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.6 p -151.92 14.29 0.63 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -144.95 12.44 1.42 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.492 0.717 . . . . 0.0 111.918 -174.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 65.4 m -144.76 156.79 55.8 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 122.326 0.251 . . . . 0.0 110.56 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -74.06 -173.88 1.57 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 124.104 3.203 . . . . 0.0 111.029 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.9 m -136.49 154.89 77.16 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.58 170.36 17.75 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.71 2.94 . . . . 0.0 111.656 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.32 178.18 9.79 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.46 0.704 . . . . 0.0 110.329 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 82.4 p -142.8 7.5 1.66 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.487 0.315 . . . . 0.0 111.716 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.408 ' C ' HD12 ' A' ' 144' ' ' LEU . 1.7 pp -155.71 177.79 10.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.676 0.39 . . . . 0.0 110.865 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.8 t -153.89 166.44 32.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.925 0.49 . . . . 0.0 110.319 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -63.07 123.07 78.87 Favored Pre-proline 0 CA--C 1.531 0.237 0 C-N-CA 122.807 0.443 . . . . 0.0 110.296 -179.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.36 161.93 25.44 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 123.268 2.645 . . . . 0.0 110.069 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -61.31 147.11 96.42 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.302 2.668 . . . . 0.0 111.704 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.592 ' H ' ' CD ' ' A' ' 150' ' ' PRO . 3.6 mm? -131.28 -9.01 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 117.524 -1.227 . . . . 0.0 113.888 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.592 ' CD ' ' H ' ' A' ' 149' ' ' LEU . 50.6 Cg_endo -79.91 2.52 8.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 CA-C-N 122.369 1.882 . . . . 0.0 112.708 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 38.9 pt -57.9 149.1 56.28 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-O 121.072 0.463 . . . . 0.0 111.871 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -76.69 166.34 27.3 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.316 3.344 . . . . 0.0 110.239 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.37 168.17 21.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.533 2.822 . . . . 0.0 109.578 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.05 -14.02 26.26 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.951 3.101 . . . . 0.0 114.123 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -146.38 67.09 11.55 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.087 0.555 . . . . 0.0 111.127 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.92 152.14 21.79 Favored 'Trans proline' 0 N--CA 1.447 -1.226 0 C-N-CA 123.352 2.701 . . . . 0.0 110.727 -174.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.93 164.52 27.41 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 124.043 3.162 . . . . 0.0 109.108 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -70.2 161.61 45.35 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.672 2.248 . . . . 0.0 109.974 175.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.2 t -157.92 -22.93 0.08 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 179.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 151.38 -170.42 30.98 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -140.89 158.58 43.74 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -64.57 112.42 7.8 Favored Pre-proline 0 C--O 1.227 -0.083 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.9 -10.69 9.24 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 123.371 2.714 . . . . 0.0 111.851 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.3 164.58 28.91 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.6 p -160.62 158.61 29.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.493 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 121.54 173.04 14.46 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -83.08 166.76 18.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 50.2 m -65.4 4.92 0.46 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -132.87 12.56 4.35 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.359 0.264 . . . . 0.0 110.903 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -156.04 13.77 0.32 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 110.09 -178.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -63.41 162.39 12.56 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.476 0.71 . . . . 0.0 112.556 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 194' ' ' VAL . . . . . 0.514 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.4 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 8.6 m120 56.46 34.64 24.62 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.9 mt -139.28 -162.44 1.33 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.628 1.171 . . . . 0.0 109.729 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -146.64 156.62 43.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.03 139.75 58.8 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 111.032 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.0 168.41 11.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.213 0.605 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -144.69 12.9 1.5 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.83 0.852 . . . . 0.0 111.346 178.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 59.7 m80 -72.68 2.94 5.62 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.334 0.654 . . . . 0.0 112.542 -179.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 232' ' ' HIS . . . . . 0.592 ' CG ' ' H ' ' A' ' 233' ' ' HIS . 14.6 t60 -152.66 -170.07 3.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 120.902 0.382 . . . . 0.0 110.323 -176.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 233' ' ' HIS . . . . . 0.592 ' H ' ' CG ' ' A' ' 232' ' ' HIS . 21.9 t60 -132.27 173.78 10.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.854 0.862 . . . . 0.0 110.511 -178.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -146.93 -168.51 3.06 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.002 0.521 . . . . 0.0 111.808 -177.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -56.62 -18.45 12.06 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -170.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.361 -179.839 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.045 -3.655 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.798 3.598 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.27 -3.43 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.226 -3.474 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.721 3.521 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C4'-C3'-C2' 99.271 -3.429 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 1 C4'-C3'-C2' 98.555 -4.145 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.103 0 C4'-C3'-C2' 99.059 -3.641 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.188 -3.512 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.404 3.204 . 0.508 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 O4'-C1'-N19 111.884 3.684 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 C4'-C3'-C2' 98.823 -3.877 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C4'-C3'-C2' 99.332 -3.368 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 C4'-C3'-C2' 100.083 -2.617 . 0.86 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.919 -3.781 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.051 -3.649 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.346 -3.354 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C5'-C4'-O4' 113.067 2.762 . 0.718 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 C4'-C3'-C2' 99.492 -3.208 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C4'-C3'-C2' 99.389 -3.311 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 257' ' ' ' A' . . . . . 0.453 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C4'-C3'-C2' 99.223 -3.477 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 258' ' ' ' G' . . . . . 0.453 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.97 -3.73 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.315 1 C4'-C3'-C2' 98.572 -4.128 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.31 3.11 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.452 -3.248 . 0.891 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.324 0 C4'-C3'-C2' 99.587 -3.113 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.284 -3.416 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C4'-C3'-C2' 99.7 -3.0 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.078 0 C4'-C3'-C2' 99.514 -3.186 . 0.854 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 266' ' ' ' A' . . . . . 0.407 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.364 -3.336 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 267' ' ' ' U' . . . . . 0.407 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.633 -3.067 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.366 -3.334 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 N19-C1'-C2' 108.318 -3.176 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C5'-C4'-C3' 111.893 -2.405 . 0.654 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 271' ' ' ' C' . . . . . 0.446 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.478 1 C5'-C4'-C3' 108.909 -4.394 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 272' ' ' ' U' . . . . . 0.446 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.924 1 C5'-C4'-C3' 109.152 -4.232 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 019 nuclear build full ' B' B ' 273' ' ' ' A' . . . . . 0.62 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 274' ' ' ' A' . . . . . 0.62 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.494 2 N19-C1'-C2' 122.448 5.655 . 0.325 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.149 0 O4'-C1'-N19 110.947 2.747 . 0.305 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 276' ' ' ' U' . . . . . 0.452 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C4'-C3'-C2' 98.789 -3.911 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 277' ' ' ' G' . . . . . 0.53 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.359 0 O4'-C1'-N19 111.426 3.226 . 0.587 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 278' ' ' ' U' . . . . . 0.53 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.871 -3.829 . 0.894 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C4'-C3'-C2' 98.603 -4.097 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.357 -3.343 . 0.801 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.11 0 C4'-C3'-C2' 99.163 -3.537 . 0.93 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 99.189 -3.511 . 0.862 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C4'-C3'-C2' 99.359 -3.341 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.293 -3.407 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.889 0 C4'-C3'-C2' 100.354 -2.346 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.143 0 O4'-C1'-N19 112.148 3.948 . 0.573 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 287' ' ' ' U' . . . . . 0.415 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.144 -3.556 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 288' ' ' ' A' . . . . . 0.415 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.55 0 C4'-C3'-C2' 99.955 -2.745 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.904 0 C5'-C4'-C3' 110.932 -3.045 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 O4'-C1'-N19 112.042 3.842 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 O4'-C1'-N19 111.656 3.456 . 0.539 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 292' ' ' ' C' . . . . . 0.414 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.122 0 C4'-C3'-C2' 99.349 -3.351 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 293' ' ' ' A' . . . . . 0.414 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.377 0 O4'-C1'-N19 111.838 3.638 . 0.625 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.534 0 C4'-C3'-C2' 98.83 -3.87 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.085 0 O4'-C1'-N19 111.656 3.456 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.181 -3.519 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C4'-C3'-C2' 99.699 -3.001 . 0.589 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 98.863 -3.837 . 0.684 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.043 2.843 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.52 -3.18 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C4'-C3'-C2' 99.057 -3.643 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 C4'-C3'-C2' 98.48 -4.22 . 0.634 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C4'-C3'-C2' 98.611 -4.089 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 112.024 3.824 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 O4'-C1'-N19 111.076 2.876 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 306' ' ' ' C' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.354 1 C4'-C3'-C2' 98.112 -4.588 . 0.776 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 O4'-C1'-N19 111.854 3.654 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo . . . . . 0 N--CA 1.453 -0.9 0 CA-C-O 120.094 -0.044 . . . . 0.0 112.019 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.599 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.69 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.69 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.587 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.558 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.587 ' HG2' HD23 ' A' ' 24' ' ' LEU . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.475 HG11 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' O ' HG22 ' A' ' 53' ' ' THR . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 52' ' ' PRO 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.515 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.475 ' CE2' HG11 ' A' ' 42' ' ' VAL . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 119.853 -0.145 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.423 ' H ' HG13 ' A' ' 166' ' ' ILE . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.456 HD22 HD21 ' A' ' 174' ' ' LEU . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . 0.456 HD21 HD22 ' A' ' 167' ' ' LEU . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 175' ' ' LYS . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.491 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.796 0.331 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.491 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 119.858 -0.143 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.64 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.547 ' CB ' HG22 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.485 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.547 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.601 ' HG2' HD23 ' A' ' 24' ' ' LEU . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.643 HG11 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.488 ' HB2' HD21 ' A' ' 35' ' ' LEU . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.643 ' CE2' HG11 ' A' ' 42' ' ' VAL . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.411 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 91.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 N-CA-C 110.678 -0.547 . . . . 0.0 110.678 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.411 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . 0.523 ' CE1' ' HE2' ' A' ' 208' ' ' LYS . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.483 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.411 HG21 ' HB1' ' A' ' 219' ' ' ALA . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.523 ' HE2' ' CE1' ' A' ' 178' ' ' PHE . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.411 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.438 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.462 -0.348 0 N-CA-C 114.225 0.817 . . . . 0.0 114.225 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.432 HD13 HD13 ' A' ' 66' ' ' LEU . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.572 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.681 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CD1' HD21 ' A' ' 20' ' ' LEU . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.608 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.608 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.587 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.424 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.5 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.587 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.408 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 20' ' ' LEU . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.431 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.431 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 16' ' ' ILE . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.572 ' CD2' ' HE2' ' A' ' 17' ' ' LYS . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.7 Cg_endo . . . . . 0 N--CA 1.449 -1.122 0 CA-C-O 119.994 -0.086 . . . . 0.0 111.935 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.421 HG13 ' HE3' ' A' ' 212' ' ' LYS . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.483 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . 0.421 ' HE3' HG13 ' A' ' 164' ' ' VAL . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 . . . . . 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo . . . . . 0 N--CA 1.46 -0.479 0 N-CA-C 114.899 1.076 . . . . 0.0 114.899 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.686 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.621 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.621 ' H ' HD22 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.551 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.509 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.509 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.551 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.613 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.481 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.622 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 39' ' ' SER . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.535 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.535 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.622 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo . . . . . 0 N--CA 1.455 -0.789 0 N-CA-C 111.89 -0.081 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . 0.418 ' C ' ' HD3' ' A' ' 175' ' ' LYS . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 174' ' ' LEU . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 . . . . . 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt . . . . . 0 CA--C 1.526 0.033 0 CA-C-O 120.677 0.275 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 . . . . . 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo . . . . . 0 CA--C 1.537 0.645 0 CA-C-O 121.078 0.366 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 11' ' ' MET . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 16' ' ' ILE . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.542 HD13 HD13 ' A' ' 66' ' ' LEU . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.483 ' HG3' HD12 ' A' ' 20' ' ' LEU . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.687 ' N ' HD22 ' A' ' 20' ' ' LEU . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.65 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.577 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.577 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.65 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.556 ' CG2' HD23 ' A' ' 20' ' ' LEU . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' A' ' 20' ' ' LEU . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.417 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' HG22 ' A' ' 53' ' ' THR . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' O ' ' A' ' 52' ' ' PRO 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.449 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.549 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.549 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 16' ' ' ILE . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo . . . . . 0 N--CA 1.448 -1.174 0 CA-C-O 120.61 0.171 . . . . 0.0 111.77 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.481 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 167' ' ' LEU . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.492 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.492 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.479 HD22 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.62 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 115.376 1.26 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.486 HD13 HD13 ' A' ' 66' ' ' LEU . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.589 ' N ' HD22 ' A' ' 20' ' ' LEU . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.556 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' H ' HD22 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.561 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.426 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.2 tp-100 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.426 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.561 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.556 ' HG2' HD23 ' A' ' 24' ' ' LEU . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.565 HG23 HD23 ' A' ' 20' ' ' LEU . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.462 ' HB2' HD21 ' A' ' 35' ' ' LEU . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.486 HD13 HD13 ' A' ' 16' ' ' ILE . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo . . . . . 0 N--CA 1.449 -1.13 0 N-CA-C 110.483 -0.622 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.429 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.498 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 111.487 0.18 . . . . 0.0 111.487 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.498 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.436 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.429 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 113.756 0.637 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.525 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.665 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.52 ' CD1' HD21 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.578 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.5 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' VAL . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.5 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.578 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 24' ' ' LEU . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.537 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.442 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.572 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 9.8 t-160 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.572 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.525 ' CD2' ' HE2' ' A' ' 17' ' ' LYS . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.464 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo . . . . . 0 N--CA 1.454 -0.814 0 N-CA-C 109.831 -0.873 . . . . 0.0 109.831 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.485 ' CG ' HG13 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.291 0.091 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.485 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 113.956 0.714 . . . . 0.0 113.956 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HB2' ' A' ' 66' ' ' LEU . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.619 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.619 ' N ' HD22 ' A' ' 20' ' ' LEU . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.606 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.614 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 31' ' ' VAL . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.614 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.448 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.409 HG21 ' CE2' ' A' ' 69' ' ' PHE . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 39' ' ' SER . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.446 ' O ' HG22 ' A' ' 53' ' ' THR . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 52' ' ' PRO 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.407 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.57 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 5.3 t-160 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.57 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HB2' HD11 ' A' ' 16' ' ' ILE . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.454 ' HA ' HD12 ' A' ' 166' ' ' ILE . 89.4 Cg_endo . . . . . 0 N--CA 1.443 -1.451 0 CA-C-O 119.194 -0.419 . . . . 0.0 111.81 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' A' ' 163' ' ' PRO . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG13 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.384 0.135 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.452 0.52 . . . . 0.0 113.452 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 66' ' ' LEU . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.682 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.672 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.603 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.542 ' CB ' HG22 ' A' ' 37' ' ' VAL . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.454 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.454 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.672 ' HG2' HD23 ' A' ' 24' ' ' LEU . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.518 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.602 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.456 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.507 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 12.4 t-160 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.507 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 16' ' ' ILE . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CE2' HG11 ' A' ' 42' ' ' VAL . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.421 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 81.0 Cg_endo . . . . . 0 N--CA 1.453 -0.862 0 N-CA-C 110.806 -0.498 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? . . . . . 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.406 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.434 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 113.145 0.402 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.462 HD13 HD13 ' A' ' 66' ' ' LEU . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HD2' ' CD1' ' A' ' 20' ' ' LEU . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.683 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.526 ' H ' HD22 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.554 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.461 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.554 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.683 ' HG2' HD23 ' A' ' 24' ' ' LEU . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.519 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.511 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 6.2 t-160 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 16' ' ' ILE . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 47' ' ' PHE . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.497 ' CE2' HG11 ' A' ' 42' ' ' VAL . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 . . . . . 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.429 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 88.8 Cg_endo . . . . . 0 N--CA 1.457 -0.666 0 N-CA-C 110.455 -0.633 . . . . 0.0 110.455 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.429 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.407 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.448 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.858 0.361 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.448 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.463 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 . . . . . 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.46 -0.492 0 CA-C-O 119.813 -0.161 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 20' ' ' LEU . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.689 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.689 ' N ' HD22 ' A' ' 20' ' ' LEU . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.632 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.565 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HB2' HE22 ' A' ' 27' ' ' GLN . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.466 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.565 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.632 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.501 ' CG2' HD23 ' A' ' 20' ' ' LEU . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 20' ' ' LEU . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.479 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.48 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.419 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 111.913 -0.072 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.507 ' CG ' HG13 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 210' ' ' LEU . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . 0.438 HD12 ' HA3' ' A' ' 205' ' ' GLY . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 114.338 0.861 . . . . 0.0 114.338 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 16' ' ' ILE . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 HD13 ' A' ' 66' ' ' LEU . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.677 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.677 ' N ' HD22 ' A' ' 20' ' ' LEU . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.537 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.537 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.64 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.415 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.64 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.468 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.467 HG23 HD23 ' A' ' 20' ' ' LEU . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.434 ' HB2' HD11 ' A' ' 35' ' ' LEU . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.424 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 16' ' ' ILE . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 66' ' ' LEU . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.466 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 72.8 Cg_endo . . . . . 0 N--CA 1.454 -0.81 0 N-CA-C 111.061 -0.4 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.466 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.816 0.341 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.453 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo . . . . . 0 N--CA 1.451 -0.987 0 N-CA-C 112.329 0.088 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CD1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.546 HD13 ' HG2' ' A' ' 38' ' ' MET . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.56 ' C ' HG23 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.512 ' CB ' HG22 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.439 ' NE2' ' HA ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.56 HG23 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.546 ' HG2' HD13 ' A' ' 24' ' ' LEU . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.508 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.425 ' HB3' HG12 ' A' ' 37' ' ' VAL . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.419 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 N-CA-C 111.454 -0.248 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.449 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 121.262 0.554 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . 0.406 ' CA ' HD12 ' A' ' 210' ' ' LEU . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . 0.406 HD12 ' CA ' ' A' ' 205' ' ' GLY . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.449 ' CD2' HD13 ' A' ' 170' ' ' LEU . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 111.509 -0.227 . . . . 0.0 111.509 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.672 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.728 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.599 ' H ' HD22 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.469 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 31' ' ' VAL . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.469 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.728 ' HG2' HD23 ' A' ' 24' ' ' LEU . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.6 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.53 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 6.7 t-80 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.6 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 166' ' ' ILE . 73.9 Cg_endo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.287 -0.313 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 163' ' ' PRO . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.415 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CD1' HG13 ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . 0.58 ' C ' HD22 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.58 HD22 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.313 0.101 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.413 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo . . . . . 0 N--CA 1.459 -0.516 0 N-CA-C 114.17 0.796 . . . . 0.0 114.17 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.493 HD12 HD11 ' A' ' 16' ' ' ILE . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 13' ' ' LEU . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.456 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.621 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.646 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.535 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.409 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.409 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.535 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.646 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.558 HG23 HD23 ' A' ' 20' ' ' LEU . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 55' ' ' LYS . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 53' ' ' THR . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.414 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 61.7 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.414 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.482 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.482 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.431 HG13 HG21 ' A' ' 223' ' ' VAL . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.428 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.431 HG21 HG13 ' A' ' 196' ' ' VAL . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.5 ' O ' HD22 ' A' ' 10' ' ' LEU . 56.0 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' MET . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 6' ' ' PRO . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 16' ' ' ILE . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.502 HD11 ' HD2' ' A' ' 17' ' ' LYS . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 12' ' ' GLN . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HD2' HD11 ' A' ' 13' ' ' LEU . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.705 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.617 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.617 ' H ' HD22 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.597 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.523 HG23 HD23 ' A' ' 20' ' ' LEU . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.449 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' HD21 ' A' ' 35' ' ' LEU . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.425 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.464 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.449 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.452 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo . . . . . 0 N--CA 1.444 -1.427 0 N-CA-C 110.597 -0.578 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.452 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.47 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 121.217 0.532 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.47 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 111.706 -0.152 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.694 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.609 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.574 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.48 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.48 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.574 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.609 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG23 HD23 ' A' ' 20' ' ' LEU . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . 0.407 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 56.3 Cg_endo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.542 -0.215 . . . . 0.0 111.542 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.488 ' OE1' ' HE2' ' A' ' 188' ' ' LYS . 11.0 pt-20 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . 0.488 ' HE2' ' OE1' ' A' ' 181' ' ' GLU . 31.8 tptt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.278 0.085 . . . . 0.0 110.884 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 219' ' ' ALA . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . 0.418 ' HA3' ' HB2' ' A' ' 210' ' ' LEU . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . 0.418 ' HB2' ' HA3' ' A' ' 205' ' ' GLY . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.407 ' HA ' ' CE2' ' A' ' 201' ' ' PHE . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 108.986 -1.198 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HD2' HD12 ' A' ' 20' ' ' LEU . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.6 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.586 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.586 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.628 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.473 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.628 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG2' HD23 ' A' ' 24' ' ' LEU . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.447 ' CG2' HD23 ' A' ' 20' ' ' LEU . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.433 HG21 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.433 ' CE2' HG21 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 110.767 -0.513 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.424 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.411 ' HB2' ' HE2' ' A' ' 188' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 181' ' ' GLU . 63.6 tttt . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 167' ' ' LEU . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo . . . . . 0 N--CA 1.453 -0.857 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.504 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.7 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.7 ' N ' HD22 ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.573 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.573 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.601 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.457 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.601 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.494 ' HG2' HD23 ' A' ' 24' ' ' LEU . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.523 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.559 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 53' ' ' THR . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 52' ' ' PRO 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HB2' ' CE1' ' A' ' 22' ' ' TYR . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.559 ' CE2' HG11 ' A' ' 42' ' ' VAL . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo . . . . . 0 N--CA 1.447 -1.245 0 N-CA-C 111.851 -0.096 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.413 0.625 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' VAL . . . . . 0.514 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.487 HE21 HG22 ' A' ' 223' ' ' VAL . 3.4 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.4 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.487 HG22 HE21 ' A' ' 199' ' ' GLN . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo . . . . . 0 CA--C 1.528 0.224 0 N-CA-C 112.778 0.261 . . . . 0.0 112.778 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.76 178.08 48.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.42 -179.0 4.03 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.467 3.445 . . . . 0.0 110.829 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.9 m -139.97 173.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 C-N-CA 124.092 0.957 . . . . 0.0 109.327 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 5' ' ' LEU . 2.0 pt? -146.93 151.79 42.54 Favored Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 122.974 0.51 . . . . 0.0 110.382 -176.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -76.98 -10.71 18.08 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.452 3.435 . . . . 0.0 112.019 -178.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -52.68 -31.08 35.5 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 119.285 -0.388 . . . . 0.0 111.328 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -55.94 -65.71 0.55 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.558 173.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.79 63.44 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 122.692 0.397 . . . . 0.0 111.539 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.08 -54.2 11.95 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -49.56 77.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 178.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -56.89 -47.25 80.94 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 122.898 0.479 . . . . 0.0 110.357 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.65 -43.57 97.45 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.033 0.379 . . . . 0.0 110.525 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.599 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 28.8 t-20 -56.67 -37.99 71.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 122.323 -0.236 . . . . 0.0 110.687 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -67.29 -58.31 5.05 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.78 0.432 . . . . 0.0 111.868 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.2 pt -64.31 -28.39 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 14' ' ' ASN . 18.4 ttpp -45.55 102.07 0.28 Allowed Pre-proline 0 C--N 1.347 0.481 0 C-N-CA 126.797 2.039 . . . . 0.0 113.639 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -81.97 -14.93 9.57 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.569 2.18 . . . . 0.0 109.659 173.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.09 36.35 0.07 OUTLIER Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.69 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.73 172.55 0.7 Allowed 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -172.241 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.69 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.7 mt-30 -131.96 136.11 47.08 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.44 141.42 36.39 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 109.872 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.6 mmt -124.33 153.75 41.33 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.587 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.8 tm? -126.75 107.82 10.49 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.43 0.633 . . . . 0.0 109.934 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.5 mt -103.77 -177.37 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.221 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.4 t 46.52 -118.5 0.83 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.896 0.878 . . . . 0.0 110.629 -167.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 63.0 78.24 0.3 Allowed 'General case' 0 N--CA 1.424 -1.744 0 C-N-CA 126.449 1.9 . . . . 0.0 109.983 -169.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -163.48 162.69 24.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.791 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 139.29 -168.59 24.83 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.45 169.56 19.51 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 123.037 2.491 . . . . 0.0 110.526 174.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.2 p -67.64 -10.27 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -135.03 0.93 2.93 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.56 60.67 14.23 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 117.901 0.319 . . . . 0.0 110.636 171.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.27 144.99 33.88 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 124.292 3.328 . . . . 0.0 111.425 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -115.32 125.47 53.29 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.93 0.395 . . . . 0.0 110.814 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 14.9 m-85 -116.09 136.08 53.35 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.558 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -122.42 104.66 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.903 174.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.587 ' HG2' HD23 ' A' ' 24' ' ' LEU . 38.9 mtp -93.52 135.43 34.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 -176.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.2 p -120.45 130.99 54.56 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.5 p -115.65 136.09 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.198 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -121.64 126.99 50.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.701 0.626 . . . . 0.0 112.221 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.475 HG11 ' CE2' ' A' ' 69' ' ' PHE . 13.5 t -135.53 131.56 51.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 O-C-N 124.629 1.206 . . . . 0.0 108.416 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 50.88 9.67 0.05 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 178.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.26 3.74 31.08 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-N 118.506 0.594 . . . . 0.0 112.691 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -104.61 133.74 48.96 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.7 134.35 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -132.37 135.48 46.18 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -112.15 137.55 50.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.395 -167.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -133.39 134.8 7.69 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.8 p -109.55 105.02 14.17 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 124.038 0.935 . . . . 0.0 111.249 -172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.75 157.17 23.56 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.544 -0.298 . . . . 0.0 113.374 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' O ' HG22 ' A' ' 53' ' ' THR . 65.2 Cg_endo -70.59 136.2 30.25 Favored 'Trans proline' 0 N--CA 1.445 -1.335 0 C-N-CA 123.243 2.629 . . . . 0.0 106.875 168.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 52' ' ' PRO 0.284 8.9 t 57.85 154.14 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 O-C-N 124.581 1.176 . . . . 0.0 113.127 -170.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.88 -22.19 66.51 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.52 -70.67 0.14 Allowed 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.027 0.376 . . . . 0.0 110.748 -173.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -55.94 -37.8 69.47 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.409 1.084 . . . . 0.0 112.887 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.15 -60.43 3.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.063 0.458 . . . . 0.0 111.759 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.601 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 0.0 OUTLIER -59.8 -34.17 72.69 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.472 -179.038 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.9 tm? -56.61 -62.39 1.76 Allowed 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.51 0.724 . . . . 0.0 110.315 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.515 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.114 0.566 . . . . 0.0 110.867 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.82 -50.56 70.2 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.348 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.53 78.71 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.524 0.73 . . . . 0.0 111.574 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -55.43 -55.18 34.72 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.659 0.784 . . . . 0.0 111.186 176.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 97.5 mttt -55.72 -58.77 6.45 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.389 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -35.1 71.17 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.056 -178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.92 -58.37 8.14 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 173.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -62.91 -33.84 76.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.1 m -72.46 -48.14 43.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.194 0.521 . . . . 0.0 111.172 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.659 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.3 t80 -59.52 -39.12 82.84 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 124.406 1.082 . . . . 0.0 112.772 -177.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 28.2 m -58.33 -14.6 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 118.47 0.577 . . . . 0.0 112.329 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -101.52 -10.34 20.22 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.058 0.39 . . . . 0.0 111.318 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -145.92 59.1 5.31 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 122.888 0.475 . . . . 0.0 111.17 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.659 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 98.3 Cg_endo -70.85 -9.13 25.12 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.621 3.547 . . . . 0.0 110.774 176.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -160.27 164.47 32.63 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.051 1.74 . . . . 0.0 107.269 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.64 155.81 35.36 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 118.188 0.449 . . . . 0.0 111.712 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.6 p -158.13 3.73 0.11 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.716 0.807 . . . . 0.0 111.126 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -154.88 157.16 37.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.849 0.459 . . . . 0.0 110.053 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.13 165.62 35.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.456 0.703 . . . . 0.0 109.857 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -157.03 -173.6 4.53 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.99 0.516 . . . . 0.0 111.649 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -142.06 16.21 2.09 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.419 0.688 . . . . 0.0 110.12 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.15 15.15 0.6 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.015 0.926 . . . . 0.0 112.699 -178.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.4 ptm -141.56 171.59 13.85 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.509 0.671 . . . . 0.0 110.839 -177.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.35 -168.31 35.0 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt-85 -144.04 163.81 32.44 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 t -146.42 -170.06 3.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.342 0.657 . . . . 0.0 109.685 -176.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.605 ' H ' HD13 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -131.98 174.49 10.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.508 0.723 . . . . 0.0 111.506 -177.614 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -149.72 176.4 10.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.051 0.453 . . . . 0.0 111.169 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.402 ' C ' ' H ' ' A' ' 90' ' ' THR . 8.8 p -145.77 0.22 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.751 0.82 . . . . 0.0 110.145 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.68 22.33 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.915 0.886 . . . . 0.0 112.239 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.402 ' H ' ' C ' ' A' ' 88' ' ' VAL . 60.2 p -131.11 9.16 4.81 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 123.313 0.645 . . . . 0.0 110.806 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -67.6 -2.44 6.73 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.101 0.56 . . . . 0.0 111.659 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -148.28 170.63 17.5 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.36 0.664 . . . . 0.0 109.731 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -150.19 173.34 14.04 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.818 0.447 . . . . 0.0 110.254 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.3 m -139.84 17.38 2.49 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.697 -176.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -146.19 163.74 34.45 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 122.763 0.425 . . . . 0.0 109.977 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -157.38 179.12 9.56 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.075 0.95 . . . . 0.0 110.763 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.09 18.77 1.76 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.71 0.404 . . . . 0.0 111.272 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.15 170.75 18.19 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.007 0.523 . . . . 0.0 109.835 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -145.05 155.95 55.0 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 123.79 0.836 . . . . 0.0 110.592 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.87 169.96 19.06 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.241 3.294 . . . . 0.0 111.166 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -153.48 11.23 0.44 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.261 0.625 . . . . 0.0 112.359 -177.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.6 p -62.06 161.11 11.35 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -64.98 165.42 10.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.777 0.431 . . . . 0.0 112.073 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -148.83 2.35 0.6 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.774 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -155.57 168.29 27.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.46 0.573 . . . . 0.0 110.102 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 178.36 162.48 28.15 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -150.85 175.39 12.06 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.054 0.427 . . . . 0.0 111.345 -173.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -148.28 141.27 24.85 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.828 0.851 . . . . 0.0 109.192 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.1 m -59.64 127.78 85.44 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.48 -7.64 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.345 2.696 . . . . 0.0 113.386 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -156.06 177.13 11.78 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.694 0.679 . . . . 0.0 110.515 -177.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.66 -17.82 17.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.479 1.112 . . . . 0.0 112.24 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.8 p -152.99 175.48 12.92 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.288 0.635 . . . . 0.0 110.06 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -58.14 145.14 74.57 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 122.177 -0.327 . . . . 0.0 110.542 178.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.66 166.2 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.995 3.13 . . . . 0.0 110.87 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.8 162.56 3.6 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.274 3.316 . . . . 0.0 112.855 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.51 16.42 2.01 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.844 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -138.88 16.41 2.67 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.906 0.482 . . . . 0.0 111.475 -176.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -144.08 177.01 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 C-N-CA 122.895 0.478 . . . . 0.0 110.065 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -158.25 26.85 0.43 Allowed Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 42.2 m -139.93 28.83 2.11 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.567 0.747 . . . . 0.0 110.514 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -129.95 13.2 5.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.921 0.488 . . . . 0.0 111.359 -175.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -178.96 178.21 48.72 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -154.48 12.06 0.4 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.015 0.526 . . . . 0.0 111.288 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -142.73 29.28 1.55 Allowed 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.05 0.54 . . . . 0.0 111.348 -174.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.3 m -135.34 15.11 3.47 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.969 -0.457 . . . . 0.0 111.847 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -147.28 20.69 1.21 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 123.425 0.69 . . . . 0.0 111.136 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.5 m -136.34 16.82 3.18 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.38 0.672 . . . . 0.0 111.278 -177.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 29.5 t -153.47 171.56 18.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.117 0.567 . . . . 0.0 110.435 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 79.7 p -149.09 5.08 0.64 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.967 0.507 . . . . 0.0 111.476 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.4 166.94 33.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -157.72 6.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.22 147.52 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 121.867 -0.521 . . . . 0.0 110.417 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.0 m -151.26 8.07 0.53 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.387 0.675 . . . . 0.0 111.528 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.6 mt -137.0 17.2 3.02 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.83 0.452 . . . . 0.0 111.432 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.0 t -147.88 172.31 14.36 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.87 0.468 . . . . 0.0 110.907 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.9 17.81 2.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.351 1.06 . . . . 0.0 110.208 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.516 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 50.6 m -68.26 -26.27 1.22 Allowed Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 117.25 -1.357 . . . . 0.0 114.48 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.516 ' CD ' ' N ' ' A' ' 138' ' ' SER . 91.2 Cg_exo -48.3 166.35 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.288 2.659 . . . . 0.0 115.116 175.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 25.5 m -137.53 52.89 5.79 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.568 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -68.05 -179.86 2.41 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.57 2.847 . . . . 0.0 110.847 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.6 -178.98 5.77 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.121 0.568 . . . . 0.0 110.46 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.7 t -140.3 13.1 2.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.667 0.387 . . . . 0.0 111.932 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 144' ' ' LEU . 3.0 mm? 50.96 26.91 2.91 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.495 1.118 . . . . 0.0 112.614 178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 24.4 m -134.26 -7.21 2.62 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.591 0.756 . . . . 0.0 110.017 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -157.33 144.94 13.84 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 125.053 1.341 . . . . 0.0 108.028 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.9 150.13 4.87 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.649 2.899 . . . . 0.0 111.922 176.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.87 0.47 8.79 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.287 3.325 . . . . 0.0 112.624 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.48 147.03 97.82 Favored Pre-proline 0 N--CA 1.451 -0.411 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -58.59 2.97 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.623 3.549 . . . . 0.0 114.464 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 6.6 tt -145.23 145.25 26.02 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 123.387 0.675 . . . . 0.0 110.041 -174.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -54.47 167.44 1.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.373 2.715 . . . . 0.0 111.496 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -67.54 160.84 46.13 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.1 1.866 . . . . 0.0 110.405 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.94 156.59 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.378 3.385 . . . . 0.0 113.735 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -145.66 153.0 50.33 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.298 1.039 . . . . 0.0 109.451 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.18 138.82 28.46 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 123.039 2.493 . . . . 0.0 110.475 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.18 165.78 25.42 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.39 2.727 . . . . 0.0 110.524 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.22 172.45 12.1 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.359 2.706 . . . . 0.0 110.559 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 78.8 p -143.8 10.99 1.6 Allowed 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 179.79 -28.77 0.05 OUTLIER Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.35 174.85 10.33 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 123.496 0.718 . . . . 0.0 109.811 175.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -145.0 102.04 4.48 Favored Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -82.85 -11.5 10.13 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 124.665 3.577 . . . . 0.0 112.021 -170.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.1 -38.75 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 118.065 0.393 . . . . 0.0 110.975 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 46.6 ttm -82.92 -40.57 19.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.423 ' H ' HG13 ' A' ' 166' ' ' ILE . 21.2 mt -55.86 -49.45 74.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.456 HD22 HD21 ' A' ' 174' ' ' LEU . 1.9 tt -63.79 -47.51 80.62 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.063 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -72.11 11.21 0.59 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.169 0.588 . . . . 0.0 111.969 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -134.41 -11.51 2.45 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 119.102 0.864 . . . . 0.0 110.834 175.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.93 -32.39 11.0 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.496 0.589 . . . . 0.0 110.79 172.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 18.8 tpp85 -160.66 68.09 2.61 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 122.703 0.401 . . . . 0.0 110.484 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.01 14.11 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.662 3.575 . . . . 0.0 113.088 -178.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -85.33 49.96 4.28 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 120.013 -0.326 . . . . 0.0 112.532 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . 0.456 HD21 HD22 ' A' ' 167' ' ' LEU . 0.4 OUTLIER -133.73 -170.69 2.55 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.426 0.632 . . . . 0.0 111.183 -175.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 175' ' ' LYS . 13.6 ptpt -147.64 155.0 41.35 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.491 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -131.17 154.98 47.79 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 121.331 0.586 . . . . 0.0 110.375 -178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -134.62 163.96 28.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.35 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -122.55 143.59 49.63 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -128.87 159.76 34.77 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.152 0.907 . . . . 0.0 110.013 -173.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.0 p -50.37 170.9 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 117.354 2.353 . . . . 0.0 117.354 -167.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -112.22 -175.18 2.62 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.861 -1.518 . . . . 0.0 110.268 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 31.2 m -140.25 23.81 2.34 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -174.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -164.63 177.89 40.04 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 118.967 0.803 . . . . 0.0 111.861 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -79.77 -62.67 1.62 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-N 117.881 0.84 . . . . 0.0 110.247 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.1 m -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.988 0.915 . . . . 0.0 110.447 178.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -131.27 165.18 23.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.928 0.491 . . . . 0.0 109.862 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . 44.61 26.21 0.17 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -175.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.92 154.66 29.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.042 0.537 . . . . 0.0 111.472 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 51.9 m -150.41 65.69 0.95 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.048 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -64.02 169.99 3.92 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.236 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.17 159.44 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 121.828 0.823 . . . . 0.0 111.086 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.4 mmm -126.99 153.04 46.41 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 81.7 p -126.48 172.7 9.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 168.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.491 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.52 161.83 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.5 t -134.56 128.39 51.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.2 t -143.2 122.64 8.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -171.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 55.97 3.25 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 117.6 -19.47 11.42 Favored Glycine 0 C--N 1.339 0.698 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -74.14 172.54 11.55 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 122.971 0.508 . . . . 0.0 109.973 177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -138.0 135.61 36.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.027 0.442 . . . . 0.0 109.891 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -134.14 164.16 27.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.885 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 35.2 tt0 -155.37 159.89 40.27 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.19 137.38 4.56 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.9 p -105.64 170.72 7.73 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.917 0.389 . . . . 0.0 111.755 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 179.43 165.64 33.89 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 121.453 0.474 . . . . 0.0 112.679 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -66.19 -14.95 62.71 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.978 0.911 . . . . 0.0 112.156 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -152.65 166.28 32.61 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -61.71 -27.68 68.88 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.417 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.5 tttt -72.46 -44.83 61.8 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.187 0.517 . . . . 0.0 110.645 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.23 -40.53 77.86 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.185 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.56 99.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.019 0.528 . . . . 0.0 111.842 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -70.41 -30.53 67.43 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.812 -0.555 . . . . 0.0 110.522 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.87 63.77 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 117.947 0.34 . . . . 0.0 110.799 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -88.18 -45.61 9.95 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.205 -0.31 . . . . 0.0 110.976 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.84 81.29 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 123.076 0.235 . . . . 0.0 111.456 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.52 9.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 12.0 tm0? -40.29 -44.02 1.83 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 170.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 60.0 m -70.03 -42.5 72.85 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.931 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.96 -43.04 93.97 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 122.682 0.393 . . . . 0.0 111.399 -178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.49 -61.31 2.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 123.271 0.357 . . . . 0.0 110.764 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.11 -45.03 71.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -71.65 -46.92 57.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.3 t -80.89 -28.71 11.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 118.829 0.74 . . . . 0.0 110.212 -173.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -89.22 1.82 55.13 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.195 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 54.43 28.38 9.48 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 119.111 0.868 . . . . 0.0 112.281 -178.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 83.7 mt -131.85 -166.22 1.69 Allowed 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.212 1.005 . . . . 0.0 110.209 -174.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -140.34 -170.18 2.93 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.884 -0.51 . . . . 0.0 110.477 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 19.4 tp -144.1 -0.63 1.0 Allowed 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.985 -0.447 . . . . 0.0 111.884 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.57 25.14 3.74 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.936 0.334 . . . . 0.0 111.126 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.57 7.49 9.5 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.934 0.494 . . . . 0.0 111.587 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -155.51 163.28 40.21 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.752 0.821 . . . . 0.0 109.921 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -157.93 8.52 0.15 Allowed 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -145.23 20.0 1.57 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.239 0.472 . . . . 0.0 111.59 -176.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -57.98 -16.61 13.02 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.95 0.5 . . . . 0.0 112.178 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -156.61 160.07 39.07 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.365 1.066 . . . . 0.0 108.818 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 81.4 t60 . . . . . 0 C--O 1.253 1.266 0 CA-C-O 117.752 -1.118 . . . . 0.0 110.358 -178.993 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 98.863 -3.837 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 O4'-C1'-N19 111.925 3.725 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C4'-C3'-C2' 99.475 -3.225 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 1 C4'-C3'-C2' 98.636 -4.064 . 0.793 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 O4'-C1'-N19 112.006 3.806 . 0.682 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 C4'-C3'-C2' 99.168 -3.532 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.365 0 C4'-C3'-C2' 98.99 -3.71 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.3 0 C4'-C3'-C2' 99.325 -3.375 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.237 0 C4'-C3'-C2' 99.367 -3.333 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.374 3.174 . 0.678 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 99.467 -3.233 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.123 -3.577 . 0.709 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.722 -2.978 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C4'-C3'-C2' 99.906 -2.794 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.417 -3.283 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 O4'-C1'-N19 111.36 3.16 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C4'-C3'-C2' 99.152 -3.548 . 0.783 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.289 -3.411 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 1 C4'-C3'-C2' 98.67 -4.03 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.265 0 C4'-C3'-C2' 99.316 -3.384 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.514 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C4'-C3'-C2' 99.472 -3.228 . 0.799 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.514 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.046 0 C4'-C3'-C2' 99.19 -3.51 . 0.75 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.08 -3.62 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C4'-C3'-C2' 99.464 -3.236 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.176 0 O4'-C1'-N19 111.099 2.899 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.178 -3.522 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 99.53 -3.17 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.096 -3.604 . 0.879 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.937 0 C4'-C3'-C2' 99.234 -3.466 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 99.243 -3.457 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.281 0 C4'-C3'-C2' 99.573 -3.127 . 0.693 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.81 0 C4'-C3'-C2' 99.268 -3.432 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.21 -3.49 . 0.754 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C5'-C4'-C3' 111.987 -2.342 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.568 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.457 1 C5'-C4'-C3' 108.667 -4.555 OUTLIER-DELTA 0.014 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.568 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.629 3 P-O3'-C3' 124.996 4.413 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.455 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.258 1 C4'-C3'-C2' 97.696 -5.004 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.455 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.124 2.924 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.4 0 C4'-C3'-C2' 99.637 -3.063 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 1 C4'-C3'-C2' 98.48 -4.22 . 0.759 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.601 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 O4'-C1'-N19 112.224 4.024 . 0.59 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 99.058 -3.642 . 0.891 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 1 C4'-C3'-C2' 98.613 -4.087 . 0.788 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 99.3 -3.4 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.026 0 C4'-C3'-C2' 99.012 -3.688 . 0.91 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.744 -3.956 . 0.847 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 C4'-C3'-C2' 99.677 -3.023 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.473 0 C4'-C3'-C2' 99.02 -3.68 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C5'-C4'-C3' 111.807 -2.462 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.28 1 O4'-C1'-N19 112.702 4.502 . 0.82 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.474 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.674 0 O4'-C1'-N19 111.803 3.603 . 0.496 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.474 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 C4'-C3'-C2' 99.581 -3.119 . 0.731 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.667 0 O4'-C1'-N19 111.218 3.018 . 0.895 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C4'-C3'-C2' 99.289 -3.411 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.387 1 O4'-C1'-N19 112.27 4.07 . 0.414 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.417 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.388 3.188 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.414 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.446 -3.254 . 0.628 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 O4'-C1'-N19 111.618 3.418 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.252 0 O4'-C1'-N19 111.167 2.967 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.319 0 C4'-C3'-C2' 99.322 -3.378 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 C4'-C3'-C2' 98.733 -3.967 . 0.601 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.291 -3.409 . 0.63 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C4'-C3'-C2' 99.908 -2.792 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.626 0 O4'-C1'-N19 111.511 3.311 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.352 0 C4'-C3'-C2' 99.371 -3.329 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C4'-C3'-C2' 99.45 -3.25 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.243 1 C4'-C3'-C2' 98.467 -4.233 . 0.739 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.202 0 O4'-C1'-N19 112.163 3.963 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.182 0 C4'-C3'-C2' 99.633 -3.067 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.442 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.26 1 C4'-C3'-C2' 98.084 -4.616 . 0.729 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.442 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.947 0 O4'-C1'-N19 111.879 3.679 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo . . . . . 0 CA--C 1.529 0.242 0 N-CA-C 112.356 0.098 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.01 -176.92 47.72 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.05 0.93 0.09 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.525 1 C-N-CA 125.6 4.2 . . . . 0.0 114.834 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.83 -12.23 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 118.489 0.586 . . . . 0.0 111.089 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.9 tp -159.02 63.02 2.26 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 123.916 0.886 . . . . 0.0 109.156 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.87 -26.05 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.408 2.072 . . . . 0.0 112.242 -171.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -55.31 -31.16 61.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.855 -0.528 . . . . 0.0 110.452 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.71 -60.57 3.27 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.855 0.462 . . . . 0.0 110.134 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.7 -34.86 69.9 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.1 OUTLIER -71.73 -59.35 2.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -172.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -48.78 79.44 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.466 0.306 . . . . 0.0 111.518 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -56.38 -45.96 80.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 122.186 -0.321 . . . . 0.0 110.99 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 tp -59.69 -47.99 83.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.316 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -55.48 -36.29 66.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 117.865 0.302 . . . . 0.0 111.163 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -70.12 -56.12 7.68 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.1 pt -62.39 -41.59 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 -174.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 151.97 87.9 Favored Pre-proline 0 CA--C 1.534 0.336 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -173.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -91.5 -21.32 0.63 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 124.257 3.305 . . . . 0.0 111.785 170.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.27 48.67 0.01 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -60.41 177.29 0.29 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -169.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.64 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.6 mt-30 -132.2 134.39 45.3 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.258 178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -104.91 136.19 44.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 171.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.7 ptp -135.01 151.35 50.73 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.462 0.305 . . . . 0.0 110.783 174.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -107.0 139.08 41.96 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.872 0.869 . . . . 0.0 110.195 -174.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.5 mt -141.14 -179.72 6.26 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -172.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.547 ' CB ' HG22 ' A' ' 37' ' ' VAL . 25.0 t 48.34 -120.28 1.25 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.532 0.733 . . . . 0.0 111.153 -166.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.485 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.66 80.73 0.15 Allowed 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 127.07 2.148 . . . . 0.0 110.355 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 t -163.89 164.2 23.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.076 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 153.53 -170.44 32.33 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.0 7.42 2.06 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 124.069 3.179 . . . . 0.0 112.919 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 t 75.3 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 124.901 1.281 . . . . 0.0 112.527 176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -130.29 -3.87 4.38 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 121.967 -0.458 . . . . 0.0 109.93 173.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.52 59.19 19.47 Favored Pre-proline 0 N--CA 1.455 -0.217 0 C-N-CA 124.592 1.157 . . . . 0.0 108.435 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.75 137.18 29.38 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 124.236 3.291 . . . . 0.0 110.129 -174.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -105.15 125.23 50.76 Favored 'General case' 0 C--N 1.338 0.096 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -120.54 136.48 54.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.547 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.24 117.23 48.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.692 177.098 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.601 ' HG2' HD23 ' A' ' 24' ' ' LEU . 20.8 mtp -99.19 135.0 41.24 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.9 p -121.86 135.19 54.89 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.9 p -114.87 140.12 37.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 -172.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -124.97 119.72 29.55 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.394 0.278 . . . . 0.0 110.68 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.643 HG11 ' CE2' ' A' ' 69' ' ' PHE . 11.4 t -135.02 134.76 53.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 55.82 6.19 0.2 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.135 0.974 . . . . 0.0 113.522 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.79 6.22 49.83 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -103.94 132.15 50.47 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.7 t -120.54 134.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 65.2 m-85 -132.97 132.69 42.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.506 -177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.27 136.11 52.12 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -169.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.07 142.34 13.69 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.569 -1.012 . . . . 0.0 110.569 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.488 ' HB2' HD21 ' A' ' 35' ' ' LEU . 94.9 p -114.34 123.89 50.63 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.551 0.691 . . . . 0.0 112.157 -170.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.39 158.38 23.64 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.263 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.96 0.93 6.44 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.379 2.719 . . . . 0.0 110.269 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.23 157.3 38.55 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.95 -22.23 65.45 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -59.41 -71.63 0.12 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.159 0.583 . . . . 0.0 111.612 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -56.39 -35.09 67.34 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.892 0.877 . . . . 0.0 111.458 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.5 -58.82 6.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 122.089 -0.382 . . . . 0.0 111.108 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.8 pttm -61.7 -36.15 80.06 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.973 0.109 . . . . 0.0 110.731 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.2 -61.91 2.07 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.621 0.768 . . . . 0.0 110.613 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -56.86 -39.25 73.97 Favored 'General case' 0 CA--C 1.521 -0.159 0 C-N-CA 123.147 0.579 . . . . 0.0 111.415 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.02 -51.54 69.64 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 122.187 -0.321 . . . . 0.0 110.342 176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.62 -42.76 75.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.495 0.318 . . . . 0.0 111.44 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.87 -59.48 4.83 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.381 0.673 . . . . 0.0 110.338 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -54.7 -50.42 68.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.232 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.53 -38.2 71.53 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.778 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.4 -57.26 13.72 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 173.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -54.74 -38.77 67.56 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 123.295 0.372 . . . . 0.0 110.572 -172.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.1 m -78.67 -55.28 5.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.653 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 12.1 t80 -58.08 -32.6 68.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.201 1.185 . . . . 0.0 114.201 -175.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 27.5 m -56.41 -14.16 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 119.781 1.173 . . . . 0.0 112.291 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -91.2 -8.67 47.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.489 0.715 . . . . 0.0 110.999 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.46 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 25.1 m-85 -149.98 46.84 0.43 Allowed Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.653 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 97.6 Cg_endo -71.09 -20.37 28.77 Favored 'Trans proline' 0 N--CA 1.448 -1.147 0 C-N-CA 124.438 3.425 . . . . 0.0 112.093 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -163.75 -33.01 0.04 OUTLIER 'General case' 0 C--O 1.234 0.268 0 CA-C-N 117.811 0.278 . . . . 0.0 110.808 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.57 -172.38 4.12 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.202 0.601 . . . . 0.0 110.152 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.4 t -139.71 170.56 15.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.246 0.618 . . . . 0.0 109.576 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -143.68 20.79 1.83 Allowed 'General case' 0 C--N 1.339 0.127 0 C-N-CA 123.37 0.668 . . . . 0.0 111.3 -175.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.04 168.26 19.69 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-O 120.912 0.387 . . . . 0.0 111.655 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -147.22 172.61 13.57 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 123.839 0.856 . . . . 0.0 110.412 -176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 80' ' ' LEU . 7.7 mp -67.48 -11.58 58.25 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.522 0.329 . . . . 0.0 111.489 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -82.35 -7.4 59.63 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.08 -179.97 4.66 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.049 0.54 . . . . 0.0 111.301 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.17 -174.75 29.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -139.86 171.9 13.54 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.525 0.73 . . . . 0.0 110.262 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.8 t -149.21 18.76 0.96 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.767 0.427 . . . . 0.0 110.933 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 96.4 mt -134.6 169.27 17.56 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.446 0.699 . . . . 0.0 110.262 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.7 t -156.72 175.77 13.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.356 0.662 . . . . 0.0 110.618 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -143.85 7.17 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 C-N-CA 123.917 0.887 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -144.7 24.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.935 0.494 . . . . 0.0 111.867 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.2 p -134.94 25.22 3.62 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.196 0.998 . . . . 0.0 109.762 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.03 174.49 10.47 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.294 0.568 . . . . 0.0 110.516 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.16 174.17 14.57 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.529 0.681 . . . . 0.0 110.075 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.7 p -144.08 175.96 9.66 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.879 0.872 . . . . 0.0 110.016 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 83.2 p -152.34 169.62 22.09 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.627 0.771 . . . . 0.0 110.468 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -151.67 171.2 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.011 0.524 . . . . 0.0 110.622 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -142.71 11.2 1.84 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.389 0.675 . . . . 0.0 111.637 -177.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -75.21 6.53 4.25 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.559 0.344 . . . . 0.0 111.871 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -151.24 177.78 9.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.454 0.702 . . . . 0.0 109.841 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.459 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 62.8 t80 -144.55 146.93 34.26 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 99' ' ' PHE . 52.0 Cg_exo -56.03 6.81 0.04 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 125.415 4.077 . . . . 0.0 116.265 178.626 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -138.29 15.27 2.8 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.078 0.853 . . . . 0.0 110.377 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.6 p -134.21 4.72 3.48 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.858 0.463 . . . . 0.0 111.294 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.17 -14.13 62.81 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.899 0.48 . . . . 0.0 111.632 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -68.94 -179.22 1.41 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.301 0.572 . . . . 0.0 112.08 178.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.0 p-10 -139.49 11.16 2.52 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.136 0.575 . . . . 0.0 111.587 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.77 169.81 42.34 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -154.44 -8.55 0.14 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.58 178.35 10.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.726 0.41 . . . . 0.0 111.182 -178.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 28.8 p -142.76 159.2 57.83 Favored Pre-proline 0 C--O 1.232 0.173 0 C-N-CA 123.886 0.875 . . . . 0.0 108.858 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 158.46 56.9 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 123.367 2.711 . . . . 0.0 111.372 -178.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.38 172.27 6.22 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.396 0.679 . . . . 0.0 111.032 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -129.24 20.04 5.81 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.277 0.631 . . . . 0.0 111.225 -178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.0 t -142.21 12.08 1.97 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.542 0.737 . . . . 0.0 109.475 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.459 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 39.3 tt0 -65.56 -36.2 13.97 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 71.1 Cg_exo -48.91 149.17 8.19 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.984 2.456 . . . . 0.0 112.595 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.61 164.06 36.7 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.324 2.683 . . . . 0.0 110.838 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -153.52 166.86 31.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.154 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -69.23 167.9 15.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.848 0.459 . . . . 0.0 111.015 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.8 m -144.64 168.81 9.41 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 C-N-CA 123.954 0.901 . . . . 0.0 110.195 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.11 177.35 46.38 Favored Glycine 0 CA--C 1.53 1.005 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 67.9 p -153.28 19.38 0.56 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.182 0.593 . . . . 0.0 111.242 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -140.37 11.16 2.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.771 0.429 . . . . 0.0 110.969 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.23 18.4 0.07 OUTLIER Glycine 0 CA--C 1.522 0.507 0 N-CA-C 112.236 -0.345 . . . . 0.0 112.236 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -137.91 6.65 2.67 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.668 0.734 . . . . 0.0 111.518 -174.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -151.19 -5.65 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.263 0.625 . . . . 0.0 112.041 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.5 p -159.27 161.17 35.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.708 0.403 . . . . 0.0 111.027 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.4 t80 44.11 27.11 0.18 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.69 1.196 . . . . 0.0 113.193 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 75.7 p -104.52 8.7 35.57 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.769 0.827 . . . . 0.0 111.372 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 43.6 m -144.72 17.46 1.64 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.245 0.618 . . . . 0.0 110.536 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.6 t -146.65 26.12 1.16 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.676 0.391 . . . . 0.0 111.261 -175.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -153.29 174.65 31.94 Favored Glycine 0 CA--C 1.527 0.785 0 O-C-N 122.092 -0.38 . . . . 0.0 112.157 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -72.46 -6.46 43.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.998 0.919 . . . . 0.0 112.327 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.83 -13.21 11.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 123.059 0.544 . . . . 0.0 112.429 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 50.9 m -70.42 -13.89 62.32 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.668 0.387 . . . . 0.0 111.609 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.4 pp 44.4 18.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.785 1.634 . . . . 0.0 114.519 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 96.4 p -140.02 5.86 2.15 Favored 'General case' 0 CA--C 1.528 0.097 0 O-C-N 121.949 -0.47 . . . . 0.0 111.984 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -149.66 167.24 26.97 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.7 m -146.75 156.98 48.12 Favored Pre-proline 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.41 173.04 11.24 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 123.311 2.674 . . . . 0.0 110.271 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 6.3 t 41.69 60.73 8.59 Favored Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 124.593 1.157 . . . . 0.0 111.993 -177.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -74.3 7.72 2.46 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.368 3.379 . . . . 0.0 111.66 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.42 14.75 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.504 1.122 . . . . 0.0 113.194 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 74.4 p -128.38 1.61 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.572 0.749 . . . . 0.0 111.053 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 144' ' ' LEU . 7.2 mp 50.56 28.93 3.71 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 124.829 1.252 . . . . 0.0 113.101 177.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.3 t -145.1 178.88 7.74 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 122.559 0.343 . . . . 0.0 111.246 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -147.41 157.77 44.71 Favored Pre-proline 0 C--O 1.234 0.239 0 C-N-CA 123.698 0.799 . . . . 0.0 110.357 -176.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.32 162.6 41.77 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.525 2.15 . . . . 0.0 110.574 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.61 166.63 28.83 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 123.37 2.714 . . . . 0.0 110.976 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -152.9 163.02 24.84 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 122.934 0.494 . . . . 0.0 109.96 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -54.17 163.5 3.31 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 123.856 3.038 . . . . 0.0 112.923 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 31.7 pt -61.42 156.58 51.31 Favored Pre-proline 0 CA--C 1.53 0.204 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.47 163.29 3.78 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.791 2.994 . . . . 0.0 112.377 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.24 162.6 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.287 3.325 . . . . 0.0 111.429 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.34 144.8 69.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.741 2.294 . . . . 0.0 110.466 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -69.0 153.28 96.28 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.738 -177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -72.91 161.52 43.44 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.67 2.913 . . . . 0.0 110.878 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.45 164.93 34.07 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.297 2.665 . . . . 0.0 111.233 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.61 176.88 9.17 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.619 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 15.9 t -148.95 176.16 10.66 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 123.081 0.552 . . . . 0.0 110.54 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -164.91 18.75 0.11 Allowed Glycine 0 CA--C 1.527 0.838 0 CA-C-O 119.299 -0.723 . . . . 0.0 112.035 -177.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -142.68 169.5 17.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.846 0.823 . . . . 0.0 109.826 -177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -149.83 162.57 27.79 Favored Pre-proline 0 C--O 1.237 0.408 0 C-N-CA 122.432 0.293 . . . . 0.0 110.578 -176.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.411 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 91.1 Cg_endo -76.88 -11.12 18.22 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.715 2.943 . . . . 0.0 110.678 174.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.8 t -65.52 -44.92 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 O-C-N 121.978 -0.451 . . . . 0.0 111.105 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 63.5 tpp -70.33 -47.88 59.07 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 123.111 0.257 . . . . 0.0 110.893 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.411 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 7.9 pt -57.54 -40.01 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.89 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.6 tt -64.16 -50.1 69.49 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -69.58 10.57 0.34 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.216 1.406 . . . . 0.0 112.907 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -141.16 0.66 1.56 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.738 -0.601 . . . . 0.0 111.396 177.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -35.55 5.83 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.725 -0.609 . . . . 0.0 110.169 174.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -159.12 73.73 3.45 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 122.282 -0.261 . . . . 0.0 111.401 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -66.6 -178.68 1.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.995 3.13 . . . . 0.0 109.436 174.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.66 35.73 2.56 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 121.782 -0.574 . . . . 0.0 112.396 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.59 -177.97 4.58 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 117.584 0.692 . . . . 0.0 111.527 -175.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.59 154.93 46.67 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.483 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.7 m-85 -130.36 154.54 47.57 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -137.02 165.94 24.84 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.445 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . 0.523 ' CE1' ' HE2' ' A' ' 208' ' ' LYS . 14.4 t80 -121.78 141.77 50.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -177.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -126.2 153.05 45.21 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.393 -174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.2 m -50.37 173.82 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.402 2.281 . . . . 0.0 116.257 -167.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -127.28 166.37 17.91 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.21 -1.813 . . . . 0.0 109.966 -177.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.8 m -152.82 31.55 0.5 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -143.28 168.97 25.99 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.277 -0.963 . . . . 0.0 114.17 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.86 157.67 34.71 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.723 0.809 . . . . 0.0 110.859 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 28.5 m -58.64 -9.66 1.83 Allowed 'General case' 0 C--N 1.339 0.118 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -172.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -113.18 2.42 15.61 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.891 0.768 . . . . 0.0 111.456 -176.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -150.56 19.83 0.82 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 40.1 tttt -60.48 158.19 12.63 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.498 1.119 . . . . 0.0 112.704 -173.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 68.4 p -143.24 156.29 44.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -146.51 173.7 12.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 -176.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.81 162.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 CA-C-O 121.708 0.766 . . . . 0.0 111.169 177.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.7 mmm -131.8 157.3 44.25 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 80.7 p -128.17 172.25 11.18 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.483 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.18 165.77 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.705 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.95 122.6 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.411 HG21 ' HB1' ' A' ' 219' ' ' ALA . 21.4 t -140.81 124.67 17.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -172.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.8 t70 56.67 8.23 0.45 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 110.47 -16.17 29.36 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.85 175.94 6.82 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.128 0.571 . . . . 0.0 109.468 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -140.41 137.4 33.97 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -133.09 167.78 19.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.75 157.59 41.06 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.46 134.38 3.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 177.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 87.7 p -105.45 170.0 8.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.094 0.474 . . . . 0.0 111.54 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.59 168.7 39.91 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.285 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -68.75 -15.54 63.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.765 0.826 . . . . 0.0 112.225 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -151.52 162.85 40.25 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.523 ' HE2' ' CE1' ' A' ' 178' ' ' PHE . 99.0 mttt -60.56 -28.31 68.36 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 35.4 tttp -70.12 -40.05 75.09 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.111 -0.368 . . . . 0.0 111.284 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.95 -39.38 56.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.3 89.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.819 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 23.1 tttp -70.58 -33.21 70.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 177.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.55 -25.66 68.08 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.375 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -89.44 -46.41 8.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.892 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.03 76.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.437 0.295 . . . . 0.0 110.592 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.07 -56.39 4.78 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 11.8 tm0? -40.17 -39.31 0.89 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 171.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.3 m -72.34 -44.32 62.81 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.545 0.611 . . . . 0.0 111.346 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.411 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.03 -41.28 97.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.438 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.5 tt -60.24 -56.17 24.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.483 0.489 . . . . 0.0 109.891 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.99 -55.54 22.76 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -174.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.3 m -68.43 -42.11 79.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 -27.18 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 119.651 1.114 . . . . 0.0 111.186 -173.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -95.15 0.5 54.24 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.659 0.384 . . . . 0.0 110.834 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 59.9 33.74 21.58 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.849 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.0 mt -136.87 -166.66 1.94 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.473 1.109 . . . . 0.0 109.393 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.494 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 29.2 t-80 -150.47 -167.23 2.76 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.524 0.73 . . . . 0.0 109.078 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.494 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 8.6 tp -137.33 11.9 3.02 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.232 0.469 . . . . 0.0 111.466 -176.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 45.7 tp -59.95 154.96 17.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.935 -0.478 . . . . 0.0 110.47 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -146.35 18.28 1.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.79 0.436 . . . . 0.0 110.202 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . 0.415 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 68.2 m80 -138.56 174.53 10.44 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.858 0.463 . . . . 0.0 110.835 -177.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.0 3.07 2.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.266 0.626 . . . . 0.0 111.06 -178.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 41.31 40.47 1.22 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.76 1.224 . . . . 0.0 113.424 178.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.04 173.55 0.61 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.735 0.779 . . . . 0.0 112.063 177.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -141.15 7.69 2.02 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.533 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 116.952 -1.499 . . . . 0.0 109.927 -178.139 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C4'-C3'-C2' 98.718 -3.982 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.058 -3.642 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.243 -3.457 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.255 -3.445 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 1 O4'-C1'-N19 112.514 4.314 . 0.717 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.266 0 C4'-C3'-C2' 98.788 -3.912 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.043 0 O4'-C1'-N19 111.959 3.759 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.871 0 C4'-C3'-C2' 99.337 -3.363 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.988 -2.712 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 O4'-C1'-N19 111.778 3.578 . 0.552 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.913 -3.787 . 0.854 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C4'-C3'-C2' 98.906 -3.794 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.87 0 C4'-C3'-C2' 99.474 -3.226 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.974 0 C4'-C3'-C2' 99.674 -3.026 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 98.881 -3.819 . 0.766 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 98.716 -3.984 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.528 -3.172 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 O4'-C1'-N19 111.241 3.041 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.068 0 C4'-C3'-C2' 98.964 -3.736 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.05 -3.65 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.465 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.344 -3.356 . 0.823 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.465 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.395 -3.305 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.16 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.043 -3.657 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.05 0 O4'-C1'-N19 110.907 2.707 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.146 -3.554 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C4'-C3'-C2' 98.876 -3.824 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 98.787 -3.913 . 0.925 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.18 -3.52 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.948 0 O4'-C1'-N19 111.51 3.31 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 C4'-C3'-C2' 98.866 -3.834 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 1 C4'-C3'-C2' 98.283 -4.417 . 0.745 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C4'-C3'-C2' 99.625 -3.075 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C5'-C4'-C3' 111.981 -2.346 . 0.703 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.519 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.621 2.833 1 C5'-C4'-C3' 108.67 -4.553 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.519 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.645 2 C5'-C4'-C3' 108.606 -4.596 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.405 -3.963 0 C4'-C3'-C2' 99.596 -3.104 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.278 0 O4'-C1'-N19 110.818 2.618 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.242 0 C4'-C3'-C2' 98.717 -3.983 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.263 1 C4'-C3'-C2' 98.568 -4.132 . 0.801 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.597 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 112.002 3.802 . 0.604 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 C4'-C3'-C2' 98.911 -3.789 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 1 C4'-C3'-C2' 98.686 -4.014 . 0.779 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 99.735 -2.965 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.053 -3.647 . 0.937 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 C4'-C3'-C2' 98.939 -3.761 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.437 -3.263 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.093 -3.607 . 0.883 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 100.136 -2.564 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.011 1 O4'-C1'-N19 113.185 4.985 . 0.564 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C5'-C4'-O4' 113.21 2.865 . 0.484 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 C4'-C3'-C2' 99.963 -2.737 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.053 0 C4'-C3'-C2' 99.634 -3.066 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 98.916 -3.784 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.806 3.606 . 0.507 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 O4'-C1'-N19 111.14 2.94 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 C4'-C3'-C2' 99.611 -3.089 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 98.978 -3.722 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.638 3.438 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.119 0 C4'-C3'-C2' 99.009 -3.691 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.738 0 C4'-C3'-C2' 99.333 -3.367 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 C4'-C3'-C2' 99.291 -3.409 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.776 -2.924 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.423 -3.277 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 98.856 -3.844 . 0.661 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 O4'-C1'-N19 111.677 3.477 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . 0.409 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 1 C4'-C3'-C2' 98.611 -4.089 . 0.805 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . 0.409 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 1 O4'-C1'-N19 112.508 4.308 . 0.818 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C4'-C3'-C2' 98.844 -3.856 . 0.866 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.439 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.822 1 C4'-C3'-C2' 97.5 -5.2 . 0.784 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.439 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 O4'-C1'-N19 111.644 3.444 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo . . . . . 0 N--CA 1.482 0.838 0 N-CA-C 112.897 0.307 . . . . 0.0 112.897 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.8 -179.85 48.72 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.57 171.41 0.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.295 3.33 . . . . 0.0 113.06 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.0 m -136.24 167.82 23.65 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 C-N-CA 123.919 0.888 . . . . 0.0 109.224 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.7 tt 45.46 59.95 14.06 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 111.186 -174.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.27 -29.6 23.63 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.884 3.056 . . . . 0.0 114.225 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -53.41 -28.47 29.83 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 119.769 -0.158 . . . . 0.0 111.056 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -57.92 -67.04 0.38 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.469 0.308 . . . . 0.0 110.336 174.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -30.02 65.07 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.978 0.511 . . . . 0.0 111.258 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.08 -52.04 18.74 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.452 -0.574 . . . . 0.0 109.452 -175.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.1 mtt -68.83 -43.19 76.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 122.71 0.404 . . . . 0.0 111.436 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -57.72 -44.54 86.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.83 -53.17 60.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -55.91 -38.35 70.13 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 120.616 0.246 . . . . 0.0 110.614 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -63.12 -54.38 38.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.743 0.817 . . . . 0.0 112.276 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.432 HD13 HD13 ' A' ' 66' ' ' LEU . 12.7 pt -78.09 -18.94 13.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -174.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.572 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.0 tppp? -114.83 75.68 3.89 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -165.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.68 5.44 1.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.879 3.053 . . . . 0.0 113.971 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.6 125.18 0.75 Allowed Glycine 0 N--CA 1.465 0.604 0 CA-C-N 119.49 1.041 . . . . 0.0 110.963 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.681 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -168.56 -174.78 2.28 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 122.948 0.499 . . . . 0.0 111.365 -177.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.681 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.6 mt-30 -129.78 134.97 47.9 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 177.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CD1' HD21 ' A' ' 20' ' ' LEU . 7.3 m-85 -106.34 135.59 47.56 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 171.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.5 ptp -135.49 142.59 45.52 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.895 0.378 . . . . 0.0 110.41 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.608 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -104.25 143.76 32.51 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.98 1.312 . . . . 0.0 109.421 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.608 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.5 mt -140.44 162.41 35.4 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -168.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.587 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 24.5 m 66.06 -108.18 0.14 Allowed 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 125.392 1.683 . . . . 0.0 108.509 171.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.424 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.27 70.7 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.005 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 t -163.75 155.31 16.72 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.95 -170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.55 -167.5 27.53 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.03 164.87 33.2 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.064 1.843 . . . . 0.0 108.339 173.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.468 HG21 " H1'" ' B' ' 287' ' ' ' U' . 1.4 p -74.43 2.83 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -172.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -132.24 -0.97 3.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.723 0.296 . . . . 0.0 111.71 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 59.67 7.69 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.155 0.582 . . . . 0.0 109.713 168.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.95 135.87 26.29 Favored 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 124.207 3.272 . . . . 0.0 110.377 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.5 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -104.67 111.96 24.86 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.073 0.939 . . . . 0.0 113.01 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.424 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 18.9 m-85 -104.53 139.63 39.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.832 -175.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.587 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.6 t -124.3 104.31 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 118.676 -1.21 . . . . 0.0 112.57 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.408 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.0 mtp -99.3 130.77 45.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 86.9 p -129.45 135.77 49.08 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG23 HD23 ' A' ' 20' ' ' LEU . 13.5 p -115.7 137.34 49.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.869 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -118.48 123.15 44.45 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 123.759 0.662 . . . . 0.0 110.86 -173.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.86 133.85 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 126.362 1.865 . . . . 0.0 109.129 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 53.17 9.95 0.16 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.07 5.06 56.44 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.625 -0.672 . . . . 0.0 112.207 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -104.15 133.48 49.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.8 t -123.85 134.4 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.3 m-85 -127.56 134.8 49.72 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.78 135.55 53.91 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.713 0.633 . . . . 0.0 112.186 -167.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 136.14 8.53 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.9 p -124.02 116.13 22.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.037 0.446 . . . . 0.0 111.155 -173.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.17 167.05 28.98 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.003 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.41 136.02 32.84 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.841 3.027 . . . . 0.0 107.094 170.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.269 10.1 t 56.12 157.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 O-C-N 124.45 1.094 . . . . 0.0 113.303 -172.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -56.73 -69.7 0.14 Allowed 'General case' 0 C--O 1.234 0.253 0 C-N-CA 122.994 0.518 . . . . 0.0 111.529 -174.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -55.39 -40.28 71.17 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 124.081 0.952 . . . . 0.0 111.883 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.49 -61.58 2.25 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -56.19 -39.65 72.76 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.708 0.403 . . . . 0.0 111.848 176.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -58.06 9.78 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 111.038 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.431 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 1.8 t-80 -56.61 -43.78 80.48 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.502 0.721 . . . . 0.0 111.358 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.25 82.24 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.32 69.42 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 124.061 0.945 . . . . 0.0 110.501 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -55.55 -54.58 42.26 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 124.817 1.247 . . . . 0.0 112.385 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.431 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.6 mttm -55.91 -56.95 14.51 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.92 -33.54 73.31 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.929 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 16' ' ' ILE . 1.7 tp -55.02 -61.81 2.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.1 mtt85 -59.09 -38.86 80.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -174.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 41.8 m -71.55 -51.92 20.93 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.33 0.586 . . . . 0.0 112.561 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.664 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -56.8 -35.55 68.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.479 1.512 . . . . 0.0 111.963 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.97 -15.17 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 118.303 0.501 . . . . 0.0 111.623 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -102.72 -7.72 21.46 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.636 -0.665 . . . . 0.0 111.037 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -148.43 55.23 2.04 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.937 0.495 . . . . 0.0 111.043 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.664 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 85.6 Cg_endo -71.89 -23.41 22.2 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.881 3.054 . . . . 0.0 113.355 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -159.2 17.25 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.215 -0.303 . . . . 0.0 111.648 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.07 177.83 8.67 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.812 -0.555 . . . . 0.0 111.158 -175.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 71.2 p -153.66 19.55 0.53 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.832 0.853 . . . . 0.0 111.14 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -144.71 162.04 37.7 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -176.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.58 -174.12 4.52 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.267 0.627 . . . . 0.0 110.369 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -142.45 -178.04 5.56 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.283 0.633 . . . . 0.0 111.37 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.4 tp -140.31 145.4 37.17 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.685 0.794 . . . . 0.0 109.895 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -160.9 -172.04 3.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.331 0.652 . . . . 0.0 110.249 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -141.41 165.82 26.45 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.073 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 170.86 -171.49 43.84 Favored Glycine 0 C--N 1.338 0.669 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.4 ptt-85 -147.65 159.58 43.63 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 122.308 0.243 . . . . 0.0 110.749 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 87' ' ' SER . 10.7 t -158.0 177.6 11.15 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.085 0.554 . . . . 0.0 110.081 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.02 8.79 0.84 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 124.824 1.25 . . . . 0.0 112.93 -176.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 85' ' ' THR . 88.8 p -59.57 164.95 3.18 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.94 177.04 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.105 0 C-N-CA 124.268 1.027 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -145.92 175.05 10.73 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.043 0.537 . . . . 0.0 109.656 -177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -140.22 12.85 2.4 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -174.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.6 8.97 0.94 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.736 -0.602 . . . . 0.0 111.66 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -145.14 177.94 8.42 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.234 0.614 . . . . 0.0 109.971 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.8 t -144.47 177.33 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.022 0.529 . . . . 0.0 111.578 -175.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 50.0 m -144.53 -170.55 3.41 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.633 0.773 . . . . 0.0 110.019 -175.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -141.44 169.41 17.65 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.987 0.515 . . . . 0.0 109.953 -177.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -143.22 -176.81 5.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.289 0.636 . . . . 0.0 110.158 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.58 170.18 16.95 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.2 0.6 . . . . 0.0 109.668 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -154.35 173.46 16.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.972 0.509 . . . . 0.0 110.403 -177.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -142.66 154.31 62.73 Favored Pre-proline 0 C--O 1.233 0.187 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.98 170.37 16.99 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.02 2.48 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -144.58 13.95 1.56 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.314 0.646 . . . . 0.0 110.556 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.8 p -139.63 6.6 2.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.279 0.632 . . . . 0.0 110.803 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 20.6 tp -72.54 173.46 8.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.601 . . . . 0.0 110.456 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -128.49 16.99 6.48 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.935 0.894 . . . . 0.0 111.149 -178.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 67.0 t30 48.06 26.5 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.608 1.163 . . . . 0.0 113.142 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.8 174.89 47.38 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -145.66 8.26 1.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.245 0.618 . . . . 0.0 110.922 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.11 -4.16 1.53 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.895 0.878 . . . . 0.0 110.663 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.7 t -166.25 146.52 5.31 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.82 172.53 15.15 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.046 2.497 . . . . 0.0 109.907 173.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -150.73 -31.91 0.18 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -157.76 -4.43 0.09 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 t -157.45 166.12 33.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.863 0.363 . . . . 0.0 110.136 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -151.75 157.71 34.38 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.567 0.747 . . . . 0.0 109.111 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.9 154.78 72.01 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.938 2.425 . . . . 0.0 109.929 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.88 173.61 13.24 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.179 3.252 . . . . 0.0 111.749 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -147.08 -6.95 0.48 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.399 0.68 . . . . 0.0 111.088 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -155.84 147.62 23.1 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.2 p -160.56 164.69 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.171 0.189 . . . . 0.0 110.733 -177.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -177.59 -26.48 0.04 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 9.3 t 57.15 171.69 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.014 1.325 . . . . 0.0 113.203 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 43.86 25.09 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 17.14 0.07 OUTLIER Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.581 -0.7 . . . . 0.0 112.218 -176.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.14 117.32 7.32 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -154.37 -6.43 0.15 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.706 0.402 . . . . 0.0 110.898 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 36.0 t -158.99 160.66 36.22 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.095 0.958 . . . . 0.0 109.353 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -159.73 173.2 16.39 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.783 0.325 . . . . 0.0 111.22 -176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 61.5 m -140.27 11.3 2.35 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.544 1.138 . . . . 0.0 110.566 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.6 p -155.34 170.01 22.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.065 0.946 . . . . 0.0 109.402 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.1 m -142.61 4.58 1.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.026 0.53 . . . . 0.0 112.12 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 163.67 -8.76 0.08 OUTLIER Glycine 0 CA--C 1.529 0.968 0 CA-C-N 118.303 0.501 . . . . 0.0 113.247 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -153.26 173.15 15.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.516 0.727 . . . . 0.0 110.883 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.66 158.09 12.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.069 0.547 . . . . 0.0 109.584 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 84.3 p -149.05 15.61 0.93 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 54.0 tp -148.74 157.31 43.35 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.395 0.678 . . . . 0.0 109.516 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.9 m -61.89 164.71 6.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.948 0.404 . . . . 0.0 111.553 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.69 4.15 1.0 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.743 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.4 p -156.46 158.5 31.47 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -72.44 165.15 33.52 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.433 2.755 . . . . 0.0 110.461 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.9 p -152.49 137.91 11.3 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.92 7.7 2.32 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.91 3.073 . . . . 0.0 112.877 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 50.31 25.07 1.7 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.065 0.946 . . . . 0.0 112.089 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.8 m 54.96 16.51 1.51 Allowed 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 124.757 1.223 . . . . 0.0 113.558 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.36 170.53 14.86 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.1 p -138.81 4.4 2.31 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 123.851 0.86 . . . . 0.0 110.614 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -67.5 157.35 86.13 Favored Pre-proline 0 N--CA 1.452 -0.329 0 C-N-CA 123.44 0.696 . . . . 0.0 110.59 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.36 165.69 29.64 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.051 2.501 . . . . 0.0 110.276 175.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.49 164.41 35.71 Favored 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.716 2.944 . . . . 0.0 110.629 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.75 132.18 91.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.07 140.35 34.35 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 122.298 1.998 . . . . 0.0 110.526 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 9.3 tp -162.08 140.95 7.14 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.99 149.65 72.01 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.4 2.067 . . . . 0.0 109.981 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.99 148.79 28.73 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.612 2.875 . . . . 0.0 112.58 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -78.46 169.26 20.22 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.975 3.117 . . . . 0.0 109.918 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -149.24 152.32 35.73 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.24 163.85 36.87 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.486 2.791 . . . . 0.0 110.249 177.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.92 142.1 34.56 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.503 2.802 . . . . 0.0 111.884 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -78.73 1.1 9.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 124.267 3.311 . . . . 0.0 111.98 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.0 p -144.6 24.15 1.56 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.974 0.51 . . . . 0.0 110.375 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -138.33 -160.52 8.48 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 123.724 0.678 . . . . 0.0 111.836 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -135.74 178.87 6.71 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 122.709 0.404 . . . . 0.0 110.076 -176.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -52.99 146.11 20.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 123.029 0.532 . . . . 0.0 111.662 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.42 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.7 Cg_endo -70.51 -17.85 33.9 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 123.883 3.055 . . . . 0.0 111.935 -175.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.421 HG13 ' HE3' ' A' ' 212' ' ' LYS . 85.4 t -63.53 -37.82 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 120.975 0.416 . . . . 0.0 111.226 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . 0.436 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 58.1 tpp -81.44 -48.46 11.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 122.091 -0.381 . . . . 0.0 111.122 -175.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.1 pt -56.54 -39.26 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.277 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -62.78 -51.58 66.54 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -72.07 12.96 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.331 0.652 . . . . 0.0 112.121 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -136.24 1.57 2.69 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.694 -0.629 . . . . 0.0 110.02 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -119.14 -29.14 5.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.347 0.521 . . . . 0.0 110.896 174.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -158.85 69.4 3.5 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.91 -175.51 1.22 Allowed 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.12 2.547 . . . . 0.0 108.904 174.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.34 42.71 3.91 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 121.306 -0.871 . . . . 0.0 111.203 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.9 -176.54 3.96 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.82 0.848 . . . . 0.0 109.688 -177.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 48.8 mtmt -139.49 155.52 47.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 33.5 m-85 -133.57 151.74 51.77 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -139.91 121.68 15.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.868 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -78.08 147.01 34.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.463 -0.773 . . . . 0.0 110.389 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.2 159.58 35.61 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.74 0.781 . . . . 0.0 110.531 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -47.63 173.46 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.196 2.199 . . . . 0.0 116.239 -168.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.61 170.7 12.93 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.19 -173.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 46.5 m -153.38 161.72 42.03 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.102 0.961 . . . . 0.0 110.205 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.47 174.81 25.06 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 123.502 0.572 . . . . 0.0 111.813 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -78.17 -97.76 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.824 -0.221 . . . . 0.0 111.138 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 48.3 m -149.81 -1.4 0.43 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.219 0.608 . . . . 0.0 110.984 176.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -124.01 4.8 8.64 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.38 0.272 . . . . 0.0 110.845 -176.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 22.57 1.11 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 36.2 tptt -58.57 154.78 13.52 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 124.175 0.99 . . . . 0.0 112.482 -172.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.1 m -144.87 153.99 42.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.092 0.557 . . . . 0.0 110.362 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -141.39 171.94 13.37 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -145.14 160.02 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 121.458 -0.776 . . . . 0.0 110.996 175.098 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 3.7 tpt -146.03 142.94 29.09 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -173.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 72.8 p -130.55 174.61 9.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.098 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.483 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -148.96 164.3 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.143 -173.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 97.7 t -140.57 127.85 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 170.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -148.63 134.15 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -177.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.1 t70 55.43 3.47 0.08 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.25 -15.95 25.03 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 111.315 -0.714 . . . . 0.0 111.315 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -76.23 172.22 13.22 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 109.772 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -138.72 134.52 33.67 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 122.199 -0.313 . . . . 0.0 110.32 -178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -133.39 163.13 30.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.264 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.4 tt0 -151.75 159.4 43.96 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.33 130.86 2.2 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 91.5 p -95.97 171.75 8.43 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.765 0.282 . . . . 0.0 111.475 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.46 175.62 47.68 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.209 -0.357 . . . . 0.0 112.209 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -75.87 -15.62 60.18 Favored 'General case' 0 C--O 1.226 -0.147 0 O-C-N 122.204 -0.586 . . . . 0.0 112.513 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -154.46 164.48 38.58 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -61.5 -31.11 71.09 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -175.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.445 ' HE3' ' P ' ' B' ' 292' ' ' ' C' . 52.4 mtpt -73.33 -33.52 65.17 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.646 0.657 . . . . 0.0 110.456 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -36.13 55.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.603 0.761 . . . . 0.0 109.214 -177.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.46 81.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.109 174.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . 0.421 ' HE3' HG13 ' A' ' 164' ' ' VAL . 38.6 tttp -66.08 -34.42 78.02 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.115 -0.366 . . . . 0.0 110.974 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.97 -29.25 69.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -82.07 -53.1 6.38 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.36 73.06 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.478 0.487 . . . . 0.0 111.959 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.21 -52.66 15.48 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 121.904 -0.498 . . . . 0.0 110.079 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -42.75 -39.21 2.37 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 170.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.7 m -73.32 -40.82 64.19 Favored 'General case' 0 C--N 1.341 0.216 0 O-C-N 121.814 -0.554 . . . . 0.0 111.933 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.65 -43.16 94.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 123.411 0.445 . . . . 0.0 110.399 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -57.94 -57.89 10.79 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.43 0.456 . . . . 0.0 110.131 177.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.6 56.39 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.578 0.228 . . . . 0.0 111.473 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 88.6 m -70.43 -44.91 66.9 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 73.7 t -80.0 -20.77 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 119.489 1.04 . . . . 0.0 110.559 -173.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 1.8 m-30 -98.97 -0.89 41.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.022 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.45 34.64 22.69 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 123.232 0.613 . . . . 0.0 111.369 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -137.31 -165.68 1.8 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.07 0.948 . . . . 0.0 110.254 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -147.47 -177.52 5.75 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 123.485 0.714 . . . . 0.0 109.468 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 9.6 tp -145.21 6.33 1.13 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 118.389 0.54 . . . . 0.0 112.099 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.8 mt -136.23 164.9 27.01 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.704 -0.622 . . . . 0.0 111.291 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -143.45 170.84 15.04 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.12 0.968 . . . . 0.0 110.115 -176.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 65.7 t60 -157.77 171.94 19.39 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.866 0.866 . . . . 0.0 108.912 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -60.14 160.57 8.02 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.394 0.278 . . . . 0.0 110.582 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.13 -176.69 5.66 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.86 0.464 . . . . 0.0 110.112 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -146.35 -177.84 5.83 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.684 0.794 . . . . 0.0 110.523 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -144.76 168.83 19.27 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.821 0.448 . . . . 0.0 110.548 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 116.786 -1.578 . . . . 0.0 110.441 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.364 -3.336 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.327 0 O4'-C1'-N19 111.678 3.478 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 O4'-C1'-N19 111.75 3.55 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.035 0 C4'-C3'-C2' 99.567 -3.133 . 0.801 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 O4'-C1'-N19 112.541 4.341 . 0.675 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.242 1 C4'-C3'-C2' 98.635 -4.065 . 0.708 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 98.758 -3.942 . 0.632 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.969 0 C4'-C3'-C2' 99.556 -3.144 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 99.77 -2.93 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 98.947 -3.753 . 0.54 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 O4'-C1'-N19 110.997 2.797 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 C4'-C3'-C2' 98.855 -3.845 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 1 C4'-C3'-C2' 98.659 -4.041 . 0.767 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.173 0 C4'-C3'-C2' 99.634 -3.066 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.22 0 O4'-C1'-N19 111.11 2.91 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 C4'-C3'-C2' 99.457 -3.243 . 0.637 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.602 1 C4'-C3'-C2' 98.698 -4.002 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.674 1 C4'-C3'-C2' 98.671 -4.029 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 98.953 -3.747 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.253 -3.447 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.504 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.416 -3.093 0 C4'-C3'-C2' 98.965 -3.735 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.504 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.089 0 C4'-C3'-C2' 99.376 -3.324 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 O4'-C1'-N19 111.664 3.464 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C5'-C4'-C3' 110.846 -3.102 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.764 -2.936 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.168 -3.532 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.212 1 C4'-C3'-C2' 98.64 -4.06 . 0.729 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.481 -3.219 . 0.907 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.073 0 C4'-C3'-C2' 100.116 -2.584 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.448 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 O4'-C1'-N19 111.758 3.558 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.448 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.88 -3.82 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.358 -3.342 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C3'-C2'-C1' 104.125 2.916 . 0.715 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.879 1 C5'-C4'-C3' 108.043 -4.972 . 0.166 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.515 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.257 1 C5'-C4'-C3' 108.654 -4.564 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.515 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.111 3 P-O3'-C3' 124.729 4.191 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.433 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.392 0 C4'-C3'-C2' 98.927 -3.773 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.433 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 O4'-C1'-N19 112.397 4.197 . 0.706 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.053 -3.647 . 0.58 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 98.911 -3.789 . 0.705 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.455 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C5'-C4'-O4' 113.093 2.781 . 0.704 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.455 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.949 0 C4'-C3'-C2' 99.496 -3.204 . 0.918 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.481 1 C4'-C3'-C2' 98.147 -4.553 . 0.897 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 0 C4'-C3'-C2' 99.329 -3.371 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C4'-C3'-C2' 99.106 -3.594 . 0.936 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 C4'-C3'-C2' 98.78 -3.92 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.964 0 C4'-C3'-C2' 99.794 -2.906 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.066 0 C4'-C3'-C2' 98.98 -3.72 . 0.903 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.56 0 C4'-C3'-C2' 100.316 -2.384 . 0.876 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.33 1 O4'-C1'-N19 112.813 4.613 . 0.851 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.468 " H1'" HG21 ' A' ' 31' ' ' VAL . . . . . . . . 0 P--O5' 1.617 2.424 0 C4'-C3'-C2' 99.283 -3.417 . 0.438 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.663 -3.037 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 98.921 -3.779 . 0.881 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C4'-C3'-C2' 99.383 -3.317 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.436 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 O4'-C1'-N19 111.519 3.319 . 0.595 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.445 ' P ' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.715 -2.985 . 0.68 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.441 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.387 3.187 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 O4'-C1'-N19 111.55 3.35 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.841 -2.859 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 O4'-C1'-N19 111.486 3.286 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 1 C4'-C3'-C2' 98.59 -4.11 . 0.659 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.988 0 C4'-C3'-C2' 99.68 -3.02 . 0.561 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.853 0 O4'-C1'-N19 111.332 3.132 . 0.862 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . 0.427 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 100.178 -2.522 . 0.77 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . 0.427 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.095 0 C4'-C3'-C2' 98.893 -3.807 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 112.055 3.855 . 0.717 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.46 1 C4'-C3'-C2' 98.195 -4.505 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.557 1 O4'-C1'-N19 112.473 4.273 . 0.819 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.129 0 C4'-C3'-C2' 99.385 -3.315 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.433 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 1 C4'-C3'-C2' 98.409 -4.291 . 0.764 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.433 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.135 1 O4'-C1'-N19 112.502 4.302 . 0.783 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 C--O 1.234 0.288 0 N-CA-C 112.742 0.247 . . . . 0.0 112.742 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.33 179.27 48.63 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.886 -0.886 . . . . 0.0 110.886 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.01 -26.2 18.07 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 123.856 3.037 . . . . 0.0 113.149 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.5 p -161.78 153.27 3.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 122.996 0.519 . . . . 0.0 110.133 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.77 158.27 26.9 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -53.35 -33.76 67.65 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 123.904 3.07 . . . . 0.0 114.899 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -55.46 -29.99 59.73 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 122.351 -0.218 . . . . 0.0 110.529 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.67 -60.75 3.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -39.44 72.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 122.594 0.358 . . . . 0.0 111.857 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -60.47 3.15 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -62.39 -45.94 90.86 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 123.564 0.746 . . . . 0.0 110.927 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -57.85 -47.74 81.82 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.013 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.2 tp -57.95 -48.08 81.02 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 118.183 0.447 . . . . 0.0 110.447 174.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -55.92 -38.5 70.37 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.778 -0.576 . . . . 0.0 111.704 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -69.14 -53.73 18.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 pt -63.88 -42.43 95.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -175.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 150.89 84.19 Favored Pre-proline 0 CA--C 1.527 0.092 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -173.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -90.15 -19.06 1.26 Allowed 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.336 3.357 . . . . 0.0 112.352 169.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.54 46.71 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.14 176.88 0.19 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -171.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.686 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.4 mt-30 -132.67 135.76 46.02 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.938 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 15.4 m-85 -106.17 135.36 47.77 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.8 ptp -135.33 147.54 49.17 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 123.536 0.522 . . . . 0.0 110.025 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.621 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -107.81 142.99 37.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.132 0.573 . . . . 0.0 109.559 -172.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.621 ' H ' HD22 ' A' ' 24' ' ' LEU . 78.8 mt -142.41 178.17 7.77 Favored 'General case' 0 C--O 1.245 0.818 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -172.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.551 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.74 -120.92 1.41 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.962 0.505 . . . . 0.0 111.202 -167.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.509 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 71.3 86.39 0.12 Allowed 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.422 2.289 . . . . 0.0 109.828 -173.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -163.84 166.1 22.22 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.078 1.751 . . . . 0.0 106.964 176.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 152.74 -172.91 31.8 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.04 5.54 2.99 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 124.375 3.383 . . . . 0.0 112.08 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 t 75.17 6.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.873 1.269 . . . . 0.0 111.968 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -137.7 -3.41 1.87 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.943 -0.473 . . . . 0.0 110.954 172.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.98 58.66 11.58 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 168.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.57 141.24 27.75 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.373 3.382 . . . . 0.0 111.692 -173.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.78 120.99 43.11 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.482 0.658 . . . . 0.0 110.906 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.509 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 54.7 m-85 -114.71 135.58 54.0 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.551 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.44 111.06 31.5 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.145 174.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.613 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.2 mtp -97.82 135.35 39.71 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 27.0 p -125.95 135.5 51.93 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.481 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -113.9 143.86 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -129.18 121.98 28.82 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 123.443 0.464 . . . . 0.0 110.944 -170.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.622 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.9 t -135.37 133.21 52.5 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 C-N-CA 124.186 0.995 . . . . 0.0 108.991 177.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.9 t30 54.51 -0.1 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.231 1.412 . . . . 0.0 114.711 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.01 4.05 19.06 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 121.209 -0.932 . . . . 0.0 111.378 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -104.51 132.81 50.32 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 29.2 t -123.75 135.29 63.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 O-C-N 124.197 0.935 . . . . 0.0 108.707 -176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 39' ' ' SER . 68.4 m-85 -134.35 134.99 42.39 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -116.43 136.26 53.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.293 -167.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.72 135.75 8.56 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.066 -1.213 . . . . 0.0 110.066 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 78.2 p -112.72 106.02 14.3 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.275 1.03 . . . . 0.0 111.9 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.08 161.75 26.8 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 116.369 -0.378 . . . . 0.0 113.326 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.44 135.82 27.34 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.857 3.038 . . . . 0.0 106.778 168.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.274 9.7 t 57.39 150.48 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 122.246 1.022 . . . . 0.0 113.568 -172.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -66.56 -17.95 65.1 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -171.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.23 -75.08 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.704 0.402 . . . . 0.0 111.419 -174.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -57.96 -35.29 70.96 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 124.178 0.991 . . . . 0.0 112.713 -178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.12 -58.82 6.31 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.749 -0.594 . . . . 0.0 111.254 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.599 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.6 pttm -61.45 -32.28 72.26 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.354 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.74 -59.64 5.09 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.696 0.798 . . . . 0.0 110.313 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.535 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 6.6 t-160 -56.57 -42.31 78.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.579 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.07 79.04 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 176.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.8 -47.35 80.44 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.192 0.597 . . . . 0.0 111.382 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -55.71 -53.28 58.53 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.745 0.418 . . . . 0.0 111.116 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.535 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.1 mttt -56.21 -57.79 10.7 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.083 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.93 -34.69 73.57 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.402 0.438 . . . . 0.0 111.893 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.4 tp -55.94 -64.45 0.85 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 172.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.3 mtt85 -63.83 -22.08 66.74 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -172.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.0 m -81.79 -50.21 9.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.869 0.366 . . . . 0.0 111.832 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.0 t80 -63.51 -27.75 69.48 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.829 1.252 . . . . 0.0 113.298 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 m -55.68 -15.23 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 119.539 1.063 . . . . 0.0 111.727 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -90.22 -14.87 32.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 119.422 -0.323 . . . . 0.0 111.413 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -146.94 53.51 1.69 Allowed Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.744 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 74.3 Cg_endo -69.36 -17.35 39.41 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 124.413 3.408 . . . . 0.0 112.608 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -159.33 -14.94 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 O-C-N 122.054 -0.404 . . . . 0.0 110.836 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.66 29.01 0.6 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.85 1.26 . . . . 0.0 113.071 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.6 m -143.52 21.53 1.85 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.781 0.433 . . . . 0.0 111.563 -175.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -134.38 14.3 3.8 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.02 0.528 . . . . 0.0 111.996 -175.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.47 161.18 43.14 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.826 0.85 . . . . 0.0 110.069 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 p80 -148.88 10.58 0.81 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.542 0.337 . . . . 0.0 111.745 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -149.61 165.64 31.69 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.48 0.312 . . . . 0.0 110.337 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.99 168.49 25.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.272 0.629 . . . . 0.0 110.029 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 ptm -67.73 170.05 8.55 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.162 -0.336 . . . . 0.0 110.786 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -173.69 31.08 0.1 OUTLIER Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.588 -0.339 . . . . 0.0 112.54 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -134.85 165.93 24.15 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 122.292 -0.534 . . . . 0.0 110.362 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.8 m -144.56 160.78 40.58 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 mp -62.36 159.71 14.77 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.181 0.592 . . . . 0.0 110.912 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -75.71 1.41 14.75 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.492 0.717 . . . . 0.0 112.291 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.2 m -142.93 174.89 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.398 0.679 . . . . 0.0 110.397 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -149.84 172.56 14.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.168 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 50.4 p -140.12 177.53 7.92 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.096 0.559 . . . . 0.0 110.376 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -146.6 176.13 10.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.01 0.524 . . . . 0.0 110.117 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -145.61 166.45 25.72 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.004 0.522 . . . . 0.0 110.979 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -153.42 -179.61 7.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.402 0.681 . . . . 0.0 109.558 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 93.2 p -146.57 169.36 19.13 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 123.736 0.814 . . . . 0.0 110.512 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.9 167.25 29.75 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 120.875 0.369 . . . . 0.0 110.715 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -146.69 176.25 10.0 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.14 161.48 41.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.856 0.462 . . . . 0.0 110.044 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -153.59 1.54 0.25 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 122.914 0.485 . . . . 0.0 111.774 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 77.8 t80 -150.73 144.27 17.13 Favored Pre-proline 0 N--CA 1.452 -0.356 0 O-C-N 122.085 -0.384 . . . . 0.0 110.033 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 99' ' ' PHE . 51.1 Cg_exo -55.53 167.54 1.98 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.533 2.822 . . . . 0.0 113.642 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.12 10.85 0.8 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.655 176.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 t -156.02 -175.52 5.47 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.074 0.95 . . . . 0.0 109.215 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.4 mt -135.98 -177.27 4.62 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.575 1.15 . . . . 0.0 109.924 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -135.83 171.2 14.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.395 0.678 . . . . 0.0 110.054 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -140.66 18.67 2.35 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.926 0.49 . . . . 0.0 112.007 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.13 174.6 42.38 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -147.28 -173.45 4.26 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.468 1.107 . . . . 0.0 109.713 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -131.66 7.28 4.44 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.829 0.452 . . . . 0.0 110.97 -177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.3 p -142.87 146.59 38.25 Favored Pre-proline 0 C--O 1.231 0.128 0 C-N-CA 123.656 0.782 . . . . 0.0 109.417 178.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.55 154.95 27.73 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.449 2.766 . . . . 0.0 111.591 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -160.43 114.97 2.2 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.896 0.878 . . . . 0.0 108.839 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm 45.86 39.1 5.03 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.621 0.768 . . . . 0.0 111.567 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -130.65 11.34 5.24 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.534 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 13.3 pt-20 -144.29 28.4 0.07 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 123.561 0.744 . . . . 0.0 112.834 177.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 74.3 Cg_endo -70.35 158.32 56.55 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.066 1.844 . . . . 0.0 111.238 -177.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -74.12 178.45 6.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.815 3.01 . . . . 0.0 111.574 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -136.85 14.39 3.11 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.971 0.908 . . . . 0.0 110.089 177.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -153.57 176.24 12.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.801 1.24 . . . . 0.0 108.691 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.9 t -50.97 137.19 9.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 123.328 0.651 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.41 -19.56 0.09 OUTLIER Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 99.6 p -68.2 163.27 23.11 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 117.889 0.845 . . . . 0.0 111.478 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -153.41 25.35 0.53 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.865 0.466 . . . . 0.0 110.673 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -122.87 20.88 7.6 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -140.28 18.74 2.41 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.601 0.361 . . . . 0.0 111.109 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -144.96 164.38 31.31 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.834 0.853 . . . . 0.0 109.514 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.8 m -154.09 160.92 42.17 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.557 0.743 . . . . 0.0 110.117 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -153.7 8.3 0.37 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.628 0.771 . . . . 0.0 111.457 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 87.9 p -151.28 8.56 0.54 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 95.4 p -155.62 169.9 23.24 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.054 0.454 . . . . 0.0 110.928 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 88.9 p -77.69 13.35 1.33 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.864 0.865 . . . . 0.0 112.993 179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -61.04 -14.55 39.42 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 123.476 0.56 . . . . 0.0 113.313 -178.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -154.35 162.47 41.15 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.697 0.799 . . . . 0.0 109.56 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.21 0.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 123.253 0.621 . . . . 0.0 110.898 -178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.6 t -76.3 -25.41 54.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.036 0.38 . . . . 0.0 110.715 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.56 HD13 ' H ' ' A' ' 136' ' ' SER . 0.1 OUTLIER -157.72 167.69 29.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.614 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.56 ' H ' HD13 ' A' ' 135' ' ' LEU . 23.3 t -158.87 163.85 36.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.885 0.474 . . . . 0.0 109.782 177.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.0 166.35 33.28 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.389 0.676 . . . . 0.0 110.598 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.1 m -150.96 151.81 30.46 Favored Pre-proline 0 C--N 1.339 0.143 0 C-N-CA 123.137 0.575 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.63 5.32 5.29 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 124.462 3.441 . . . . 0.0 111.048 173.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.4 m -140.46 166.28 24.32 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 124.799 1.239 . . . . 0.0 109.306 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -49.95 168.89 0.15 Allowed 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.908 3.072 . . . . 0.0 113.209 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 17.79 3.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.384 0.674 . . . . 0.0 110.958 -175.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 71.5 p -132.61 5.74 4.01 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.731 0.813 . . . . 0.0 110.878 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 40.2 tp -148.87 -4.31 0.43 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.343 1.057 . . . . 0.0 110.256 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . 0.548 HG22 ' H ' ' A' ' 146' ' ' GLN . 12.2 m -148.35 175.54 11.02 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.653 1.181 . . . . 0.0 108.126 -176.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.548 ' H ' HG22 ' A' ' 145' ' ' THR . 22.4 pt20 -136.92 161.59 60.68 Favored Pre-proline 0 N--CA 1.456 -0.15 0 O-C-N 121.843 -0.536 . . . . 0.0 110.484 -178.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -49.06 153.88 3.79 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 124.014 3.142 . . . . 0.0 113.112 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -71.78 166.17 30.3 Favored 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 123.959 3.106 . . . . 0.0 109.893 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.436 ' N ' HD23 ' A' ' 149' ' ' LEU . 1.9 pt? -154.91 156.18 31.05 Favored Pre-proline 0 C--O 1.235 0.334 0 C-N-CA 122.882 0.473 . . . . 0.0 110.03 -177.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.4 176.05 8.53 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.986 2.457 . . . . 0.0 110.708 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.06 144.32 23.36 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 123.121 0.569 . . . . 0.0 109.69 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.41 154.34 4.19 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.249 2.633 . . . . 0.0 113.3 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.03 167.63 25.51 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.845 3.03 . . . . 0.0 110.985 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.31 177.49 5.91 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.687 2.925 . . . . 0.0 111.613 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . 0.751 ' H ' ' CD ' ' A' ' 156' ' ' PRO . 84.3 m-85 -139.01 -27.41 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -176.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . 0.751 ' CD ' ' H ' ' A' ' 155' ' ' PHE . 77.0 Cg_exo -51.86 153.96 10.75 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.411 2.074 . . . . 0.0 113.41 177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.23 169.5 21.38 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 124.158 3.239 . . . . 0.0 110.662 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -54.57 -16.05 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.639 2.893 . . . . 0.0 113.757 177.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 57.0 m 45.28 32.48 1.0 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 124.692 1.197 . . . . 0.0 111.928 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -179.03 -157.27 19.2 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -51.3 147.82 5.38 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.014 0.526 . . . . 0.0 110.417 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -83.39 147.75 53.86 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.531 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.25 -10.63 11.15 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.013 3.142 . . . . 0.0 111.89 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 83.4 t -67.69 -45.72 84.14 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.086 0 C-N-CA 122.547 0.339 . . . . 0.0 110.49 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . 0.441 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 53.1 ttm -76.36 -44.35 36.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 10.2 pt -58.62 -39.44 76.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.824 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.8 tt -64.63 -49.8 69.62 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -66.34 3.08 1.0 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -132.68 -3.16 3.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.777 1.171 . . . . 0.0 111.156 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.2 -27.46 9.11 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.394 -0.816 . . . . 0.0 110.45 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.08 57.47 1.21 Allowed Pre-proline 0 N--CA 1.449 -0.491 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.49 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.51 178.88 2.36 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.758 2.306 . . . . 0.0 109.575 177.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.61 38.17 3.77 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 -173.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . 0.418 ' C ' ' HD3' ' A' ' 175' ' ' LYS . 0.5 OUTLIER -124.74 -175.86 3.39 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.538 0.735 . . . . 0.0 110.108 -176.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 174' ' ' LEU . 2.4 mppt? -139.5 150.0 44.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.48 ' CG ' HG13 ' A' ' 194' ' ' VAL . 27.0 m-85 -124.86 152.74 43.59 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 177.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.24 162.87 31.33 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.799 174.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -120.92 140.58 51.64 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.81 160.8 29.83 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.675 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 89.9 p -46.83 167.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 127.05 2.14 . . . . 0.0 116.404 -166.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -119.99 172.74 7.53 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.142 -1.39 . . . . 0.0 111.148 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 23.1 t -145.25 165.82 27.27 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 82.46 -174.4 53.27 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 -174.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -131.14 -53.56 1.04 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 117.382 0.591 . . . . 0.0 111.702 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.1 p -167.24 -33.01 0.02 OUTLIER 'General case' 0 C--N 1.339 0.109 0 C-N-CA 122.787 0.435 . . . . 0.0 111.167 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -64.12 -23.32 67.28 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.157 0.503 . . . . 0.0 109.774 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.33 155.04 26.11 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.228 -1.768 . . . . 0.0 106.228 173.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -155.82 158.28 37.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.316 0.507 . . . . 0.0 111.122 -176.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.4 p -153.12 160.14 42.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.796 0.438 . . . . 0.0 110.124 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -149.11 171.52 16.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.49 159.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 122.154 0.978 . . . . 0.0 111.47 173.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 95.5 mmm -129.74 155.44 45.92 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.128 -1.397 . . . . 0.0 108.003 177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 84.2 p -129.56 172.3 11.72 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 167.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.48 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -149.2 162.38 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.7 t -133.77 126.6 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.886 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 171.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.7 t -143.49 125.36 11.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -172.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.3 t70 55.18 -0.58 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -175.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 123.77 -19.18 7.48 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -73.43 173.74 9.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.387 0.675 . . . . 0.0 110.241 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -138.8 134.39 33.35 Favored 'General case' 0 CA--C 1.523 -0.087 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -130.03 170.09 14.43 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -157.66 153.15 26.27 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.82 136.35 4.13 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 89.1 p -111.09 164.07 13.21 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.023 0.439 . . . . 0.0 111.32 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -172.44 167.4 40.31 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 27.5 ptt-85 -72.29 -10.99 60.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 O-C-N 122.252 -0.558 . . . . 0.0 112.484 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -149.58 166.02 30.5 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.19 -30.79 69.97 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -173.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -70.59 -38.0 73.98 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 119.116 0.871 . . . . 0.0 110.319 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.47 -40.36 64.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 110.071 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.24 -40.96 96.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -73.58 -38.27 65.21 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.45 0.568 . . . . 0.0 110.311 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -61.79 -26.17 67.93 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.96 0.346 . . . . 0.0 110.337 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -83.6 -51.96 6.86 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 110.542 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.87 -31.96 72.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.71 0.232 . . . . 0.0 111.043 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -73.0 -56.93 4.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -42.35 -38.84 1.96 Allowed 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 169.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.1 m -70.98 -43.15 68.62 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.941 177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.55 -39.51 93.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.558 0.218 . . . . 0.0 111.434 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -65.01 -57.83 7.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.28 -44.66 68.43 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -175.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 74.3 m -76.11 -41.52 49.96 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 80.6 t -82.82 -25.38 8.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 118.24 0.473 . . . . 0.0 110.621 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -95.91 -4.61 43.19 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 56.59 35.75 26.55 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 118.752 0.705 . . . . 0.0 111.609 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.3 mt -137.11 -165.3 1.73 Allowed 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 124.147 0.979 . . . . 0.0 111.06 -176.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.565 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 11.1 t-80 -140.58 -169.15 2.72 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.747 0.819 . . . . 0.0 110.107 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.565 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.2 tp -127.97 170.57 12.71 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.054 0.541 . . . . 0.0 109.7 -176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 228' ' ' LEU . 88.0 mt -54.52 130.92 41.55 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.252 0.621 . . . . 0.0 110.907 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -154.92 13.08 0.39 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.384 0.674 . . . . 0.0 109.985 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -141.62 4.57 1.75 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 122.097 -0.377 . . . . 0.0 111.673 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -77.37 4.07 11.69 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.075 -0.39 . . . . 0.0 110.916 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -61.16 159.07 12.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.653 0.781 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 26.7 p80 -157.63 175.36 14.02 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.952 0.501 . . . . 0.0 110.204 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -151.64 162.78 40.41 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.143 0.577 . . . . 0.0 109.596 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.252 1.204 0 CA-C-O 117.674 -1.155 . . . . 0.0 110.731 179.616 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.334 -3.366 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 98.996 -3.704 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.349 -3.351 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.516 -3.184 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 O4'-C1'-N19 112.399 4.199 . 0.689 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.05 -3.65 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.019 -3.681 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.954 0 C4'-C3'-C2' 99.274 -3.426 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 N19-C1'-C2' 108.745 -2.909 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 99.803 -2.897 . 0.568 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 C4'-C3'-C2' 99.36 -3.34 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.098 0 C4'-C3'-C2' 99.11 -3.59 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.513 -3.187 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.788 0 C4'-C3'-C2' 99.58 -3.12 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 O4'-C1'-N19 111.858 3.658 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 C4'-C3'-C2' 99.194 -3.506 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 N19-C1'-C2' 108.926 -2.796 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.994 0 C4'-C3'-C2' 99.038 -3.662 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C4'-C3'-C2' 99.306 -3.394 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C4'-C3'-C2' 98.797 -3.903 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.966 0 C4'-C3'-C2' 99.477 -3.223 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 C4'-C3'-C2' 99.507 -3.193 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.945 3.745 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.304 -3.396 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.193 0 C4'-C3'-C2' 99.332 -3.368 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.811 1 C4'-C3'-C2' 98.697 -4.003 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.778 -2.922 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.926 -3.774 . 0.902 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.105 -3.595 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 1 O4'-C1'-N19 112.457 4.257 . 0.545 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 2.074 0 C5'-C4'-O4' 113.604 3.146 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C4'-C3'-C2' 99.534 -3.166 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 N19-C1'-C2' 109.374 -2.516 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C5'-C4'-C3' 109.979 -3.681 . 0.088 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.47 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.121 1 C4'-C3'-C2' 98.364 -4.336 . 0.404 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.47 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.08 1 C5'-C4'-C3' 108.43 -4.713 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.355 0 C4'-C3'-C2' 99.413 -3.287 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 111.655 3.455 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.794 0 C4'-C3'-C2' 98.703 -3.997 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 98.84 -3.86 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.599 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 112.046 3.846 . 0.54 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.843 0 O4'-C1'-N19 110.807 2.607 . 0.946 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.128 1 C4'-C3'-C2' 98.695 -4.005 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C4'-C3'-C2' 99.456 -3.244 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.844 0 C4'-C3'-C2' 99.013 -3.687 . 0.926 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C4'-C3'-C2' 99.288 -3.412 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.954 -2.746 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.007 0 C4'-C3'-C2' 99.301 -3.399 . 0.904 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.884 0 C4'-C3'-C2' 100.249 -2.451 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.408 -3.71 1 O4'-C1'-N19 113.014 4.814 . 0.612 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C4'-C3'-C2' 99.196 -3.504 . 0.624 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C4'-C3'-C2' 99.613 -3.087 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.909 0 C4'-C3'-C2' 99.388 -3.312 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 98.867 -3.833 . 0.853 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.441 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C4'-C3'-C2' 99.101 -3.599 . 0.523 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C4'-C3'-C2' 99.854 -2.846 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.431 -3.269 . 0.609 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.228 0 O4'-C1'-N19 111.91 3.71 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 O4'-C1'-N19 112.108 3.908 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.621 2.788 0 C4'-C3'-C2' 99.36 -3.34 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.05 -3.65 . 0.675 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 O4'-C1'-N19 112.223 4.023 . 0.644 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.958 -2.742 . 0.888 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 100.572 -2.128 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C4'-C3'-C2' 99.167 -3.533 . 0.614 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.229 -3.471 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.497 1 C4'-C3'-C2' 98.205 -4.495 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.11 2 O4'-C1'-N19 112.483 4.283 . 0.836 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.248 -3.452 . 0.831 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.419 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 C4'-C3'-C2' 97.84 -4.86 . 0.691 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.419 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 O4'-C1'-N19 112.167 3.967 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo . . . . . 0 N--CA 1.471 0.162 0 N-CA-C 112.533 0.166 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.89 176.09 47.89 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 120.174 -0.237 . . . . 0.0 112.541 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.8 171.4 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 1 C-N-CA 125.426 4.084 . . . . 0.0 113.853 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.5 m -63.47 177.68 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.602 0.761 . . . . 0.0 110.37 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 5' ' ' LEU . 1.2 pt? -139.18 78.66 27.98 Favored Pre-proline 0 N--CA 1.454 -0.243 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -51.46 -23.81 15.12 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 124.284 3.323 . . . . 0.0 111.705 175.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 11' ' ' MET . 40.5 ttmt -49.01 -35.72 16.08 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 122.926 0.491 . . . . 0.0 110.213 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -56.6 -64.3 0.91 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 176.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.85 -34.55 65.54 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-O 121.491 0.662 . . . . 0.0 110.494 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.39 -45.7 45.1 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.375 -172.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 19.5 mmt -64.58 -41.33 96.34 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 121.657 -0.652 . . . . 0.0 110.059 176.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -57.33 -50.39 73.09 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 16' ' ' ILE . 57.6 tp -57.72 -45.23 86.05 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.385 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -57.9 -35.45 71.06 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.831 -0.543 . . . . 0.0 111.649 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.37 -55.18 9.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.815 0.446 . . . . 0.0 111.266 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.542 HD13 HD13 ' A' ' 66' ' ' LEU . 9.6 pt -67.51 -19.79 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.483 ' HG3' HD12 ' A' ' 20' ' ' LEU . 32.4 ttmt -44.83 102.63 0.3 Allowed Pre-proline 0 N--CA 1.468 0.434 0 C-N-CA 126.908 2.083 . . . . 0.0 113.224 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -82.3 -7.56 11.88 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 121.983 1.789 . . . . 0.0 109.74 171.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 132.78 38.26 0.24 Allowed Glycine 0 C--N 1.341 0.839 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.93 171.84 1.55 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.687 ' N ' HD22 ' A' ' 20' ' ' LEU . 16.3 mt-30 -133.24 134.33 43.85 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.143 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.0 m-85 -104.22 135.62 45.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 172.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.9 ptp -135.8 143.9 45.44 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.518 0.511 . . . . 0.0 109.933 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.65 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -104.81 136.35 44.48 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.717 0.807 . . . . 0.0 110.467 -173.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 24' ' ' LEU . 67.8 mt -135.24 179.79 6.1 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.41 -174.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.577 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.65 -117.33 0.83 Allowed 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.102 0.561 . . . . 0.0 109.964 -166.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.45 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 65.34 81.46 0.21 Allowed 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 126.6 1.96 . . . . 0.0 110.172 -173.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.7 t -165.72 167.89 16.65 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.933 -1.485 . . . . 0.0 107.504 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.59 -169.91 29.79 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -73.61 6.86 2.55 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 124.755 3.637 . . . . 0.0 112.416 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t 75.78 2.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 124.818 1.247 . . . . 0.0 111.698 176.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -133.46 -1.81 3.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.131 -0.356 . . . . 0.0 110.562 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.95 59.59 11.22 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.52 135.92 20.74 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 124.543 3.495 . . . . 0.0 110.578 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -105.3 125.19 50.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.308 0.575 . . . . 0.0 111.003 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 42.8 m-85 -115.26 137.06 52.44 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.577 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.88 114.03 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.064 173.223 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.65 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.5 mtp -100.82 130.4 46.83 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.4 p -118.17 135.79 54.02 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.556 ' CG2' HD23 ' A' ' 20' ' ' LEU . 12.1 p -112.99 147.63 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -134.16 128.14 33.46 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -171.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' A' ' 20' ' ' LEU . 38.5 t -135.98 133.27 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 O-C-N 124.485 1.116 . . . . 0.0 108.054 177.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 46.8 t30 56.31 -3.12 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.01 1.324 . . . . 0.0 114.337 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 4.81 15.35 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -104.34 133.18 49.67 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.99 135.79 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -173.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 39' ' ' SER . 66.2 m-85 -134.21 135.32 42.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -116.31 138.05 51.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.422 0.452 . . . . 0.0 111.582 -168.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -127.59 135.96 9.0 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.417 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 94.8 p -112.74 119.6 38.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 123.995 0.918 . . . . 0.0 111.712 -173.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -154.96 164.12 31.66 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 122.084 -0.385 . . . . 0.0 112.299 174.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' O ' HG22 ' A' ' 53' ' ' THR . 60.2 Cg_endo -69.45 140.05 42.85 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 123.184 2.589 . . . . 0.0 106.62 165.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' O ' ' A' ' 52' ' ' PRO 0.288 10.2 t 59.98 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -174.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -68.16 -17.75 64.43 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -171.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -56.85 -75.84 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.291 0.567 . . . . 0.0 112.328 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -57.95 -35.01 70.53 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 125.234 1.414 . . . . 0.0 112.475 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -62.25 1.82 Allowed 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.744 0.418 . . . . 0.0 110.792 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.579 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.9 pttm -58.32 -37.11 74.45 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.199 -178.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -61.29 2.51 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.005 0.907 . . . . 0.0 110.851 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.549 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 3.5 t-80 -54.88 -42.76 72.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.52 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.14 -48.51 76.11 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.55 -49.42 72.72 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 123.272 0.629 . . . . 0.0 111.078 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.23 -52.79 62.25 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.403 0.62 . . . . 0.0 110.442 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.549 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 67.0 mttm -55.69 -60.16 3.83 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.409 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.45 -37.93 70.95 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.497 -0.763 . . . . 0.0 111.899 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 16' ' ' ILE . 8.1 tp -55.23 -60.24 3.67 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 175.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -55.31 -43.25 74.69 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.401 -0.519 . . . . 0.0 109.662 -175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.2 m -64.23 -70.61 0.21 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -14.68 62.6 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -174.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.86 -19.13 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 120.327 1.421 . . . . 0.0 111.293 169.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -88.43 -8.39 55.04 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.68 -0.638 . . . . 0.0 111.502 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -147.89 64.2 8.15 Favored Pre-proline 0 C--N 1.341 0.206 0 C-N-CA 123.235 0.614 . . . . 0.0 111.598 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -74.87 -5.07 16.34 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.128 3.219 . . . . 0.0 111.405 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -155.34 164.0 39.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.43 0.692 . . . . 0.0 109.506 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -154.91 16.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.511 0.324 . . . . 0.0 111.815 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -138.84 -3.45 1.63 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -153.78 2.95 0.27 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.272 0.487 . . . . 0.0 111.366 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.66 -11.43 60.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 121.894 -0.504 . . . . 0.0 111.568 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 47.49 25.23 0.59 Allowed 'General case' 0 C--O 1.227 -0.118 0 C-N-CA 124.887 1.275 . . . . 0.0 113.372 -176.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.1 mt -145.34 172.42 13.19 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.821 1.248 . . . . 0.0 109.814 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.48 23.25 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.339 0.656 . . . . 0.0 110.391 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.9 ptm -147.83 -179.86 7.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.451 0.701 . . . . 0.0 110.518 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -158.15 -174.21 27.56 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -74.61 19.84 0.13 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.605 1.162 . . . . 0.0 112.589 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.4 p -57.3 166.01 1.29 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.113 0.565 . . . . 0.0 111.853 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 pp -152.06 -174.1 4.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.521 0.729 . . . . 0.0 110.505 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.8 p -144.86 171.72 14.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.657 0.741 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.508 HG22 ' H ' ' A' ' 90' ' ' THR . 10.8 p -153.18 168.07 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.471 0.709 . . . . 0.0 109.295 -177.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -144.88 15.29 1.55 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.75 0.42 . . . . 0.0 111.266 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.508 ' H ' HG22 ' A' ' 88' ' ' VAL . 70.2 p -78.14 21.32 0.34 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.205 1.002 . . . . 0.0 112.817 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -139.88 159.76 41.45 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.706 0.402 . . . . 0.0 110.553 -176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -152.25 170.53 19.8 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.1 t -154.74 171.18 19.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.0 m -145.24 174.74 10.82 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.314 0.578 . . . . 0.0 111.363 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -150.11 167.94 25.37 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -56.86 144.65 32.48 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.33 0.652 . . . . 0.0 111.358 -177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.62 15.37 0.77 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.933 0.493 . . . . 0.0 111.88 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.4 t70 62.63 2.56 0.95 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.527 1.531 . . . . 0.0 113.032 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 34.9 t80 31.02 64.11 1.0 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.539 1.536 . . . . 0.0 113.084 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -71.67 1.24 5.9 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 124.096 3.197 . . . . 0.0 112.42 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.7 -1.25 3.57 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 122.093 -0.379 . . . . 0.0 111.389 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -146.68 175.73 10.39 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.873 0.869 . . . . 0.0 110.016 177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -134.86 -1.25 2.73 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.603 0.361 . . . . 0.0 111.952 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 41.5 t80 49.16 23.36 0.76 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.43 1.092 . . . . 0.0 113.359 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -148.4 13.81 0.97 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.565 0.346 . . . . 0.0 111.024 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.86 172.47 43.77 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -156.75 -172.02 3.89 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.269 0.628 . . . . 0.0 109.766 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.84 -9.8 10.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.242 1.017 . . . . 0.0 112.021 178.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -59.83 156.12 37.32 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.07 0.548 . . . . 0.0 111.223 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -73.91 177.36 8.24 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.497 2.798 . . . . 0.0 111.619 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -147.61 170.1 18.22 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.337 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -141.7 162.5 35.32 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-O 121.435 0.636 . . . . 0.0 111.645 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -154.73 -1.63 0.17 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.841 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.474 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.0 mp0 -68.57 -41.8 24.12 Favored Pre-proline 0 N--CA 1.448 -0.527 0 C-N-CA 124.219 1.007 . . . . 0.0 112.754 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 114' ' ' GLU . 94.2 Cg_endo -76.72 162.23 32.89 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.263 1.975 . . . . 0.0 111.109 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.12 174.17 11.78 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.288 3.325 . . . . 0.0 111.423 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -143.51 12.63 1.73 Allowed 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.155 0.582 . . . . 0.0 110.911 178.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -149.99 151.68 33.71 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.407 0.683 . . . . 0.0 109.248 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.2 m -148.48 174.09 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 C-N-CA 123.015 0.526 . . . . 0.0 110.62 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -169.5 12.3 0.05 OUTLIER Glycine 0 CA--C 1.531 1.043 0 CA-C-O 119.588 -0.562 . . . . 0.0 112.207 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.3 t 55.66 -178.59 0.04 OUTLIER 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.446 1.099 . . . . 0.0 112.161 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 54.0 p30 -150.7 13.45 0.72 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.411 0.684 . . . . 0.0 110.941 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -172.9 7.71 0.03 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.935 -0.369 . . . . 0.0 112.951 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -151.86 178.62 9.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.097 0.948 . . . . 0.0 109.008 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.74 -1.73 0.87 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.19 0.596 . . . . 0.0 111.599 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 75.3 m -147.58 167.17 25.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.496 0.718 . . . . 0.0 110.211 178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -159.98 162.88 34.44 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.349 0.66 . . . . 0.0 110.37 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 81.6 p -159.7 171.31 19.79 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.532 0.733 . . . . 0.0 110.403 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 81.3 p -155.02 173.28 16.8 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.023 0.529 . . . . 0.0 110.304 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 40.3 m 46.84 28.57 0.85 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.037 0.935 . . . . 0.0 112.884 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.95 178.92 39.85 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.708 -0.957 . . . . 0.0 110.708 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -147.94 166.79 26.61 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.077 0.551 . . . . 0.0 110.482 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.76 145.18 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.192 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.7 m 46.71 26.58 0.56 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.486 1.114 . . . . 0.0 113.721 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -142.79 4.71 1.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 117.989 0.359 . . . . 0.0 111.245 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 44.9 m -142.47 15.46 2.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.89 0.476 . . . . 0.0 111.018 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.96 13.99 1.03 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.888 0.475 . . . . 0.0 110.901 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -58.8 146.86 74.05 Favored Pre-proline 0 CA--C 1.531 0.246 0 O-C-N 122.055 -0.403 . . . . 0.0 110.75 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.59 -26.67 56.22 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.005 3.137 . . . . 0.0 113.811 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -149.62 153.88 37.23 Favored Pre-proline 0 C--O 1.232 0.164 0 C-N-CA 123.158 0.583 . . . . 0.0 110.022 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -78.64 1.0 9.47 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.94 3.093 . . . . 0.0 111.56 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.09 -172.29 0.06 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.483 1.113 . . . . 0.0 112.558 -176.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.1 t -152.95 176.04 12.28 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.182 0.593 . . . . 0.0 110.002 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.88 6.57 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.947 0.899 . . . . 0.0 110.531 -178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.5 t -154.79 151.32 28.52 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 13.9 pt20 -159.65 35.55 0.05 OUTLIER Pre-proline 0 CA--C 1.545 0.759 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 61.5 Cg_endo -67.24 162.7 37.38 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.203 1.935 . . . . 0.0 110.847 -177.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.28 153.77 4.36 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.472 3.448 . . . . 0.0 113.7 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.62 68.08 5.6 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.71 166.79 27.61 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 123.827 3.018 . . . . 0.0 110.615 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.1 pt -144.19 158.48 54.95 Favored Pre-proline 0 C--O 1.233 0.191 0 C-N-CA 123.292 0.637 . . . . 0.0 110.177 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.78 162.2 3.9 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.832 3.021 . . . . 0.0 113.222 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.44 158.88 3.52 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 124.267 3.311 . . . . 0.0 112.353 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.38 170.8 18.37 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.534 2.822 . . . . 0.0 110.3 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 42.41 50.53 5.36 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.951 0.9 . . . . 0.0 113.168 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.02 161.57 45.46 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.474 2.783 . . . . 0.0 111.068 -177.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.79 161.08 46.17 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.972 2.448 . . . . 0.0 109.939 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.3 154.89 56.38 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.991 3.127 . . . . 0.0 110.609 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 56.4 m -147.24 9.01 0.94 Allowed 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.426 0.69 . . . . 0.0 110.433 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.48 -168.26 40.22 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -139.96 168.82 18.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.935 0.894 . . . . 0.0 109.592 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -59.2 142.39 86.09 Favored Pre-proline 0 CA--C 1.531 0.23 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 86.1 Cg_endo -75.86 -10.45 19.84 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 124.077 3.185 . . . . 0.0 111.77 -178.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.56 -45.49 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 C-N-CA 122.914 0.485 . . . . 0.0 111.54 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.5 -49.53 26.18 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.351 0.523 . . . . 0.0 111.369 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.481 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 14.8 pt -58.17 -35.62 53.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.023 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 167' ' ' LEU . 6.2 tt -70.57 -48.31 55.95 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 119.231 0.923 . . . . 0.0 108.894 173.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -65.84 10.21 0.11 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.5 0.72 . . . . 0.0 112.727 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -136.83 -7.62 1.87 Allowed 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.71 -0.619 . . . . 0.0 109.936 174.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 6.1 mt -90.58 -36.26 14.54 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.784 0.834 . . . . 0.0 110.646 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -170.47 86.91 0.53 Allowed Pre-proline 0 CA--C 1.53 0.187 0 C-N-CA 123.671 0.788 . . . . 0.0 109.69 173.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.2 -169.36 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 124.034 3.156 . . . . 0.0 110.246 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.63 40.77 4.62 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 121.802 -0.562 . . . . 0.0 113.234 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 -178.1 4.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.775 0.83 . . . . 0.0 110.877 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -138.6 153.56 48.65 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.992 177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.492 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.9 m-85 -128.71 152.66 48.16 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -135.38 162.8 31.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.345 0.593 . . . . 0.0 110.195 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -118.42 141.48 48.5 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -126.76 156.74 40.72 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.752 -175.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 93.7 p -47.73 171.84 0.01 OUTLIER 'General case' 0 C--N 1.34 0.184 0 C-N-CA 127.174 2.19 . . . . 0.0 116.302 -167.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.41 171.91 10.07 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.03 -173.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -159.47 161.37 35.43 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.057 0.543 . . . . 0.0 109.998 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 98.5 171.78 32.0 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 178.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -79.89 170.31 16.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.867 0.467 . . . . 0.0 110.398 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.9 m -63.72 -0.77 1.09 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.708 0.803 . . . . 0.0 112.766 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 51.8 p-80 -128.67 11.05 6.16 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.298 0.499 . . . . 0.0 110.718 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.6 20.35 1.04 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -60.91 157.61 14.91 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.96 1.304 . . . . 0.0 113.373 -172.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 62.1 p -149.4 159.43 44.3 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.974 0.91 . . . . 0.0 109.423 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -146.39 172.42 13.54 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.98 156.95 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 121.73 0.776 . . . . 0.0 111.737 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.5 mmm -127.45 156.11 42.62 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 84.3 p -127.52 174.47 9.01 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 168.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.492 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.7 t -149.42 163.04 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 95.6 t -139.76 127.93 26.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 171.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.7 p -149.3 132.75 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.4 t70 53.85 7.06 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.96 -13.73 41.1 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 174.84 10.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -139.07 138.96 37.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 122.14 -0.35 . . . . 0.0 110.604 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -135.4 166.44 23.16 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -153.64 155.69 36.52 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 123.681 0.613 . . . . 0.0 110.776 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.16 3.17 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.3 p -107.42 169.91 8.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 121.041 0.448 . . . . 0.0 111.693 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.84 174.99 47.29 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.937 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 10.6 ptm85 -74.05 -13.81 60.91 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.59 0.756 . . . . 0.0 112.269 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -152.24 165.57 34.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.563 0.745 . . . . 0.0 109.526 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.53 -33.54 73.99 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -176.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.409 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.2 tttt -65.62 -44.19 87.26 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.365 0.602 . . . . 0.0 111.353 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.16 -40.72 74.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.387 0.675 . . . . 0.0 110.007 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.16 -41.52 96.92 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 122.879 0.472 . . . . 0.0 111.905 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -70.27 -37.45 74.87 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.326 -0.234 . . . . 0.0 111.29 177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.93 70.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -81.29 -48.2 12.32 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.035 -0.416 . . . . 0.0 111.101 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.96 -30.57 71.64 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 122.466 0.306 . . . . 0.0 110.988 178.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.57 -61.12 1.98 Allowed 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.122 0.569 . . . . 0.0 109.483 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.9 tm0? -43.72 -35.24 1.76 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 171.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.7 m -69.6 -38.81 77.43 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 120.231 1.378 . . . . 0.0 110.56 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.77 94.45 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.479 HD22 ' CD1' ' A' ' 224' ' ' PHE . 2.0 tm? -60.3 -56.06 26.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.147 0.498 . . . . 0.0 109.671 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.85 -38.93 73.37 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -173.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 58.2 m -86.53 -36.58 18.86 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 38.3 t -86.78 -11.41 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.626 1.103 . . . . 0.0 110.312 -172.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.62 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 6.0 m-85 -115.37 1.96 13.84 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 118.087 -0.958 . . . . 0.0 111.453 -177.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 55.99 25.35 8.66 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.152 0.981 . . . . 0.0 112.498 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.0 mt -123.06 -167.07 1.54 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.51 1.124 . . . . 0.0 111.01 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.493 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 25.1 t-80 -143.18 -175.61 4.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.493 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 3.3 tp -136.88 17.3 3.04 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 229' ' ' LEU . 2.9 mm? 52.52 -155.32 0.18 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.326 1.05 . . . . 0.0 111.033 178.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.99 15.97 7.35 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.698 0.799 . . . . 0.0 110.869 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 52.23 21.08 1.52 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.93 1.292 . . . . 0.0 113.132 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 54.6 t60 -59.89 153.68 20.41 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.798 -0.564 . . . . 0.0 110.185 176.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -73.58 166.51 23.12 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.974 0.416 . . . . 0.0 111.659 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -74.32 16.67 0.23 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.701 0.8 . . . . 0.0 111.897 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -65.25 -5.93 8.33 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.872 0.869 . . . . 0.0 112.55 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 54.9 t60 . . . . . 0 C--O 1.25 1.122 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.201 -179.596 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.771 0 C4'-C3'-C2' 99.308 -3.392 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.394 0 C4'-C3'-C2' 99.24 -3.46 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.468 0 C4'-C3'-C2' 99.824 -2.876 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C4'-C3'-C2' 99.19 -3.51 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.764 1 O4'-C1'-N19 112.264 4.064 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 98.962 -3.738 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.172 -3.528 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C4'-C3'-C2' 99.44 -3.26 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 99.011 -3.689 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 O4'-C1'-N19 111.789 3.589 . 0.408 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.509 0 O4'-C1'-N19 111.644 3.444 . 0.789 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 C4'-C3'-C2' 99.717 -2.983 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.479 3.279 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.351 -3.349 . 0.74 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C4'-C3'-C2' 99.235 -3.465 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.332 -3.368 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.958 0 C4'-C3'-C2' 99.507 -3.193 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 99.04 -3.66 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 C4'-C3'-C2' 99.2 -3.5 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 99.103 -3.597 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 98.879 -3.821 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.315 -3.385 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.493 1 C4'-C3'-C2' 98.494 -4.206 . 0.713 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C5'-C4'-C3' 109.968 -3.688 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.506 0 O4'-C1'-N19 111.802 3.602 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.013 -3.687 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 99.092 -3.608 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 0 C4'-C3'-C2' 99.035 -3.665 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 C4'-C3'-C2' 99.19 -3.51 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.478 -3.222 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.361 0 C4'-C3'-C2' 99.462 -3.238 . 0.693 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.113 1 C4'-C3'-C2' 98.549 -4.151 . 0.735 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.421 1 C4'-C3'-C2' 98.607 -4.093 . 0.741 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.567 0 C5'-C4'-C3' 111.61 -2.594 . 0.6 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.458 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.54 2.304 1 C5'-C4'-C3' 108.067 -4.955 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.57 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.239 1 P-O3'-C3' 125.039 4.449 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.616 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.624 3.111 1 C4'-C3'-C2' 97.174 -5.526 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.616 ' C8 ' ' N3 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.41 -3.577 0 N19-C1'-C2' 119.673 3.921 . 0.377 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 99.163 -3.537 . 0.5 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 1 C4'-C3'-C2' 98.637 -4.063 . 0.866 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.579 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.945 0 N19-C1'-C2' 107.748 -3.532 . 0.603 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.414 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.501 0 O4'-C1'-N19 110.769 2.569 . 0.925 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 1 C4'-C3'-C2' 98.312 -4.388 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 C4'-C3'-C2' 99.376 -3.324 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 98.966 -3.734 . 0.886 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.716 0 C4'-C3'-C2' 99.402 -3.298 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.879 -2.821 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 99.167 -3.533 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 100.393 -2.307 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.846 1 O4'-C1'-N19 112.998 4.798 . 0.571 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C4'-C3'-C2' 98.932 -3.768 . 0.561 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 C4'-C3'-C2' 99.998 -2.702 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C4'-C3'-C2' 99.222 -3.478 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 O4'-C1'-N19 111.824 3.624 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 O4'-C1'-N19 111.102 2.902 . 0.346 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.409 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.623 -3.077 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.54 -3.16 . 0.576 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.659 3.459 . 0.642 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 O4'-C1'-N19 111.814 3.614 . 0.725 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 C4'-C3'-C2' 99.299 -3.401 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 C4'-C3'-C2' 99.148 -3.552 . 0.671 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.693 0 O4'-C1'-N19 111.282 3.082 . 0.502 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.245 0 C4'-C3'-C2' 99.757 -2.943 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.47 -3.23 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.014 -3.686 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 C4'-C3'-C2' 98.898 -3.802 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 1 C4'-C3'-C2' 98.315 -4.385 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 O4'-C1'-N19 112.106 3.906 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.259 -3.441 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.542 1 C4'-C3'-C2' 97.792 -4.908 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.425 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.273 0 O4'-C1'-N19 111.382 3.182 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo . . . . . 0 N--CA 1.476 0.484 0 CA-C-O 119.745 -0.189 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.31 -179.46 45.86 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 120.079 -0.29 . . . . 0.0 112.422 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.38 179.97 5.87 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 124.769 3.646 . . . . 0.0 110.993 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -141.77 11.03 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.344 0.657 . . . . 0.0 111.897 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -152.32 153.58 31.03 Favored Pre-proline 0 CA--C 1.535 0.389 0 O-C-N 121.96 -0.462 . . . . 0.0 111.412 -177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.67 -25.32 41.3 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 124.02 3.147 . . . . 0.0 115.376 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -54.88 -27.42 42.6 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.125 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -56.63 -64.94 0.7 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.694 0.398 . . . . 0.0 110.297 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.6 -30.28 68.56 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.09 0.156 . . . . 0.0 111.157 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.36 -55.23 7.44 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.56 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -48.89 74.67 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.09 0.405 . . . . 0.0 110.022 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -56.04 -46.33 78.91 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 122.961 0.504 . . . . 0.0 110.444 -179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 tp -58.24 -47.62 82.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.977 0.511 . . . . 0.0 110.981 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.62 -46.59 77.35 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.75 -53.39 56.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.486 HD13 HD13 ' A' ' 66' ' ' LEU . 15.0 pt -66.39 -31.5 53.88 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' CG ' ' HB3' ' A' ' 20' ' ' LEU . 10.2 tppt? -141.86 80.5 15.56 Favored Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -169.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 17' ' ' LYS . 55.3 Cg_endo -66.62 -11.56 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.663 2.242 . . . . 0.0 111.943 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.02 117.91 0.87 Allowed Glycine 0 C--N 1.34 0.794 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -161.66 -169.56 2.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.149 1.379 . . . . 0.0 108.856 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.589 ' N ' HD22 ' A' ' 20' ' ' LEU . 38.3 mt-30 -128.44 135.48 49.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 117.548 -1.661 . . . . 0.0 114.237 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -110.49 135.24 51.46 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 ptp -135.69 145.84 47.14 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 123.831 0.707 . . . . 0.0 110.159 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.556 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -104.56 135.18 46.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.592 0.757 . . . . 0.0 109.654 -176.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' H ' HD22 ' A' ' 24' ' ' LEU . 66.0 mt -133.01 -179.05 5.25 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.561 ' CB ' HG22 ' A' ' 37' ' ' VAL . 29.1 t 48.69 -119.6 1.2 Allowed 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 123.181 0.592 . . . . 0.0 110.315 -167.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.426 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.2 tp-100 68.57 80.9 0.19 Allowed 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 127.189 2.196 . . . . 0.0 109.925 -174.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 t -164.55 163.4 21.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.653 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 151.66 -169.7 31.14 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.85 5.73 3.27 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 124.71 3.607 . . . . 0.0 112.711 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t 75.16 0.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.554 1.142 . . . . 0.0 112.286 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -128.96 -2.6 5.2 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.47 58.62 10.53 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 167.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.91 135.4 21.26 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 124.567 3.511 . . . . 0.0 109.784 -174.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.3 tm? -106.14 123.51 48.13 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 110.55 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.426 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 43.1 m-85 -114.88 138.34 50.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.561 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -127.35 111.83 26.44 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 118.976 0.807 . . . . 0.0 109.32 174.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.556 ' HG2' HD23 ' A' ' 24' ' ' LEU . 16.6 mtp -97.82 135.34 39.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 53.1 p -128.69 136.14 50.21 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.565 HG23 HD23 ' A' ' 20' ' ' LEU . 8.7 p -111.24 136.0 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.812 -175.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -115.84 124.46 50.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.916 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 68.2 t -136.12 134.33 50.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 O-C-N 125.564 1.79 . . . . 0.0 109.326 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 54.77 1.3 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.093 1.357 . . . . 0.0 114.162 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 110.45 1.54 29.4 Favored Glycine 0 C--N 1.339 0.71 0 O-C-N 121.233 -0.917 . . . . 0.0 111.359 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -104.05 135.11 46.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 174.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.2 p -126.53 135.01 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.8 m-85 -130.16 134.86 47.6 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.414 -174.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -111.88 139.1 47.65 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 123.768 0.667 . . . . 0.0 111.062 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -132.96 139.0 10.56 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.462 ' HB2' HD21 ' A' ' 35' ' ' LEU . 92.1 p -112.3 135.39 53.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.759 0.423 . . . . 0.0 111.833 -172.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -149.86 157.29 27.16 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 111.148 -0.781 . . . . 0.0 111.148 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -72.76 -3.91 14.4 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.377 2.718 . . . . 0.0 110.613 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.05 158.17 43.75 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -31.95 69.47 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -172.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -58.77 -63.78 1.17 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 118.135 0.425 . . . . 0.0 111.12 -175.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -56.92 -39.61 74.79 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.826 0.851 . . . . 0.0 111.288 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.74 -60.08 3.95 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.012 -0.43 . . . . 0.0 110.007 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.6 tttm -57.21 -37.52 72.34 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.216 0.606 . . . . 0.0 112.617 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.0 tm? -57.11 -60.54 3.44 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.794 0.806 . . . . 0.0 110.92 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.474 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 13.4 t-160 -55.77 -42.6 75.74 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.201 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.82 -46.65 84.38 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.92 68.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-O 121.008 0.432 . . . . 0.0 110.569 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.12 -53.5 56.37 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.127 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.474 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 93.8 mttt -55.06 -58.48 7.48 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.9 -40.44 76.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.716 -178.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.486 HD13 HD13 ' A' ' 16' ' ' ILE . 6.8 tp -54.8 -68.74 0.16 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -58.78 -22.46 58.21 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 123.647 0.592 . . . . 0.0 111.984 -173.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.9 m -80.2 -68.51 0.67 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -14.63 61.03 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -174.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.96 -14.81 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 121.08 1.764 . . . . 0.0 112.692 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -86.19 -11.01 53.63 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.565 0.621 . . . . 0.0 111.659 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -150.01 63.18 6.08 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.124 0.969 . . . . 0.0 110.518 -178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.63 -22.67 17.81 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.569 2.846 . . . . 0.0 112.68 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -165.22 -15.42 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -156.22 177.94 10.87 Favored 'General case' 0 CA--C 1.527 0.061 0 CA-C-O 121.116 0.484 . . . . 0.0 111.36 -175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 46.4 m -140.36 3.51 1.94 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.457 1.103 . . . . 0.0 110.616 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -143.03 169.43 17.59 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.602 0.761 . . . . 0.0 110.403 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -153.6 14.88 0.5 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.585 0.354 . . . . 0.0 111.869 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.86 165.12 29.04 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 122.615 0.366 . . . . 0.0 110.74 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.7 tp -156.41 156.27 33.55 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.43 176.53 10.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.353 0.661 . . . . 0.0 109.806 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.5 mmt -131.7 11.15 4.78 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.691 0.796 . . . . 0.0 111.115 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -175.49 175.98 47.3 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -142.23 167.87 21.09 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 123.379 0.672 . . . . 0.0 109.906 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.2 p -144.31 11.38 1.51 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.013 0.925 . . . . 0.0 110.234 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.53 -179.1 7.1 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.452 0.701 . . . . 0.0 110.698 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 51.2 m -139.87 168.87 18.83 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.312 1.045 . . . . 0.0 109.935 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.4 m -143.22 170.01 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.646 0.778 . . . . 0.0 110.882 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -156.13 167.37 30.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.904 0.882 . . . . 0.0 109.773 -177.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.8 p -69.41 154.17 42.44 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.301 -0.249 . . . . 0.0 110.476 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -159.93 166.65 29.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.231 0.613 . . . . 0.0 109.867 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -152.44 176.84 11.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.173 0.589 . . . . 0.0 110.685 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.5 t -149.33 178.0 9.17 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.945 0.498 . . . . 0.0 110.734 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.7 m -138.61 10.63 2.7 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.945 0.898 . . . . 0.0 109.985 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.12 5.21 0.73 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.887 0.875 . . . . 0.0 112.206 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -136.24 18.99 3.17 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.763 0.825 . . . . 0.0 110.618 -176.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.64 171.77 14.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.159 0.584 . . . . 0.0 111.485 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -156.11 161.95 40.31 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.367 0.667 . . . . 0.0 110.353 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -153.8 110.33 2.53 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.69 160.54 37.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.776 2.318 . . . . 0.0 110.726 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.75 27.36 0.33 Allowed 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 110.249 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 48.6 p -130.74 24.05 5.03 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.304 0.641 . . . . 0.0 111.667 -173.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.518 ' H ' HD23 ' A' ' 103' ' ' LEU . 1.6 pt? -141.54 172.24 12.96 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.303 0.641 . . . . 0.0 111.657 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.62 175.26 11.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.376 0.67 . . . . 0.0 109.721 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -140.77 9.18 2.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.991 0.516 . . . . 0.0 111.554 -177.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.08 -0.93 55.07 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.32 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -71.92 4.53 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.916 0.858 . . . . 0.0 112.674 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -144.57 138.46 27.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.001 0.52 . . . . 0.0 109.964 -178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 75.2 p -151.35 163.63 22.97 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.164 0.585 . . . . 0.0 109.906 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -55.18 -12.9 5.96 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.786 2.991 . . . . 0.0 113.479 175.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -77.02 -5.5 49.0 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.198 0.599 . . . . 0.0 111.749 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -138.42 0.24 2.06 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.3 t -159.22 145.94 16.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.151 0.58 . . . . 0.0 109.757 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 35.18 59.35 2.54 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.789 1.236 . . . . 0.0 113.396 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.84 155.67 7.9 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.728 2.286 . . . . 0.0 112.65 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -74.15 172.11 16.65 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.592 2.861 . . . . 0.0 110.426 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -61.88 -17.64 57.29 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.825 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -70.54 -0.4 8.44 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 122.965 0.506 . . . . 0.0 111.414 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.6 t -138.92 19.31 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 124.409 1.083 . . . . 0.0 108.343 -177.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.72 10.58 6.73 Favored Glycine 0 CA--C 1.534 1.229 0 N-CA-C 111.792 -0.523 . . . . 0.0 111.792 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.9 t -153.2 169.01 24.06 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.516 0.727 . . . . 0.0 110.065 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -146.43 174.86 11.01 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.153 0.581 . . . . 0.0 110.27 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -176.8 38.78 0.1 OUTLIER Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -135.1 166.1 23.84 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 117.2 0.5 . . . . 0.0 110.953 -175.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -148.99 167.26 26.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.391 0.676 . . . . 0.0 109.998 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 88.9 p -151.46 -179.59 7.52 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.182 0.593 . . . . 0.0 111.113 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -147.49 169.47 19.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.877 0.871 . . . . 0.0 110.009 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 83.0 p -156.43 -178.75 7.56 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.006 0.432 . . . . 0.0 111.463 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -140.92 17.02 2.3 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.306 1.042 . . . . 0.0 110.598 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 65.9 m -146.39 175.26 10.68 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 124.492 1.117 . . . . 0.0 109.344 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -169.4 10.67 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 CA-C-O 119.599 -0.556 . . . . 0.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.47 158.77 28.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.106 0.953 . . . . 0.0 111.08 178.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.8 m -148.18 167.34 4.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 124.039 0.936 . . . . 0.0 109.724 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 85.1 p -152.01 6.56 0.45 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.76 0.424 . . . . 0.0 111.802 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.5 tp -154.2 152.6 30.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.164 0.586 . . . . 0.0 109.908 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.7 t -155.21 168.09 28.2 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -147.07 6.59 0.88 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.486 0.715 . . . . 0.0 111.008 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -67.94 166.7 21.37 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 124.166 0.986 . . . . 0.0 111.161 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.02 -177.66 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 125.075 3.85 . . . . 0.0 113.605 173.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.1 p -133.51 143.16 46.78 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.416 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.34 158.23 3.93 Favored 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 124.138 3.226 . . . . 0.0 113.572 177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.22 17.42 0.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.162 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.3 m -140.77 -178.26 5.45 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.419 0.687 . . . . 0.0 109.664 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 70.8 mt 55.79 14.61 1.37 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.063 0.945 . . . . 0.0 112.568 -176.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 32.3 p -142.1 0.26 1.35 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.31 1.044 . . . . 0.0 110.589 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -76.11 164.88 57.29 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 123.934 0.894 . . . . 0.0 109.911 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -51.82 162.47 1.73 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 124.002 3.135 . . . . 0.0 112.557 174.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.32 -8.06 22.04 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.405 2.736 . . . . 0.0 112.327 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 86.9 mt 33.63 64.48 1.49 Allowed Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 125.408 1.483 . . . . 0.0 112.439 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.02 -4.87 15.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.22 2.613 . . . . 0.0 112.291 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 26.3 pt -144.22 149.17 44.06 Favored Pre-proline 0 C--O 1.235 0.308 0 C-N-CA 123.108 0.563 . . . . 0.0 109.684 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -76.18 163.21 33.08 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 123.589 2.86 . . . . 0.0 110.9 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.75 167.73 26.42 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 123.538 2.826 . . . . 0.0 109.756 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.55 161.62 45.17 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.731 2.288 . . . . 0.0 110.538 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -153.86 160.99 30.32 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 110.124 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.89 152.54 9.81 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.469 3.446 . . . . 0.0 112.788 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.89 167.28 27.71 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.252 2.634 . . . . 0.0 111.006 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.87 176.31 7.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 123.428 2.752 . . . . 0.0 110.254 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 22.9 t -148.0 171.64 15.49 Favored 'General case' 0 C--O 1.232 0.14 0 O-C-N 122.077 -0.389 . . . . 0.0 111.081 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.12 29.05 0.19 Allowed Glycine 0 CA--C 1.532 1.148 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -136.77 -167.99 2.18 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 124.847 1.259 . . . . 0.0 108.962 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -130.22 82.12 66.64 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-O 121.667 0.746 . . . . 0.0 110.326 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -83.4 -12.32 9.14 Favored 'Trans proline' 0 N--CA 1.449 -1.13 1 C-N-CA 125.66 4.24 . . . . 0.0 110.483 -175.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.39 -40.48 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 61.4 tpp -71.6 -43.97 65.28 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.676 -0.12 . . . . 0.0 110.676 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 42.5 mt -55.46 -49.58 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 1.4 tt -66.7 -38.63 87.14 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.405 178.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -76.98 9.31 3.03 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.274 0.629 . . . . 0.0 112.165 177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -125.53 -27.03 3.47 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 121.773 -0.579 . . . . 0.0 110.204 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.429 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.96 -32.23 16.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 122.705 0.402 . . . . 0.0 111.153 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -160.84 62.65 1.67 Allowed Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.958 -0.464 . . . . 0.0 111.207 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.34 8.31 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.199 3.266 . . . . 0.0 111.987 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -83.37 53.87 4.9 Favored Glycine 0 C--N 1.334 0.441 0 N-CA-C 112.328 -0.309 . . . . 0.0 112.328 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.78 -174.64 3.52 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 121.762 0.792 . . . . 0.0 110.487 -175.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 38.9 mtmt -141.07 152.38 44.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.498 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.0 m-85 -131.91 151.99 51.35 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.467 0.651 . . . . 0.0 109.371 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -136.4 165.49 25.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.382 -0.827 . . . . 0.0 109.272 173.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -123.42 142.76 50.66 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -127.32 155.17 43.97 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.427 0.632 . . . . 0.0 109.902 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 82.4 p -56.19 176.48 0.08 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 125.588 1.555 . . . . 0.0 115.138 -168.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.54 169.35 17.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.287 -174.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 32.8 t -155.76 163.64 39.59 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.76 177.43 18.91 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 123.45 0.548 . . . . 0.0 112.383 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.98 164.22 26.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 122.871 0.469 . . . . 0.0 110.149 176.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 19.2 m -63.34 4.61 0.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.037 0.935 . . . . 0.0 113.41 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -138.8 16.97 2.68 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.82 1.21 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.935 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -57.74 166.57 1.35 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.158 0.583 . . . . 0.0 111.487 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 44.8 p -152.83 64.88 0.79 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.218 0.532 . . . . 0.0 110.756 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -65.26 168.02 7.52 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.165 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.17 157.05 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 O-C-N 121.342 -0.849 . . . . 0.0 111.923 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.8 mmm -125.4 155.4 40.44 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.0 p -127.71 171.03 12.07 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 166.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.498 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -148.24 165.54 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 98.9 t -137.43 126.24 34.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 171.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 20.3 t -144.77 128.07 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -174.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 34.1 t70 55.26 10.99 0.49 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 106.11 -17.81 40.5 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -75.25 173.48 10.79 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 117.609 0.704 . . . . 0.0 109.876 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -138.72 135.05 34.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -131.91 167.75 19.06 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 124.087 0.867 . . . . 0.0 112.095 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -154.0 156.11 36.79 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.92 126.92 1.47 Allowed Glycine 0 C--N 1.339 0.744 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 92.4 p -101.25 171.06 7.83 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 121.165 0.507 . . . . 0.0 111.305 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.88 164.22 32.44 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-O 121.221 0.345 . . . . 0.0 112.609 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.82 -11.46 60.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.931 0.492 . . . . 0.0 111.885 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -150.68 162.16 41.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -63.71 -30.39 71.5 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -175.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -69.63 -41.12 76.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.066 0.546 . . . . 0.0 110.824 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -71.8 -37.76 70.35 Favored 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -177.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.49 87.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.883 177.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -73.57 -34.58 65.2 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 117.663 0.21 . . . . 0.0 110.653 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.18 -21.38 66.32 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 122.089 -0.382 . . . . 0.0 111.357 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -91.52 -45.71 8.36 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.016 0.526 . . . . 0.0 109.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.64 76.53 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.132 0.424 . . . . 0.0 111.35 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.04 -52.22 11.6 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 110.1 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.0 tm0? -44.14 -37.83 3.34 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.893 170.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 50.6 m -73.93 -40.77 62.88 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 118.556 0.616 . . . . 0.0 111.443 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -43.27 83.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.917 0.389 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.436 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.3 tt -61.68 -56.21 22.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.27 -43.18 74.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -175.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 91.6 m -76.36 -49.24 17.36 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 60.5 t -77.96 -26.03 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 O-C-N 121.227 -0.921 . . . . 0.0 110.843 -172.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.429 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.3 m-30 -95.34 0.38 53.57 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 118.528 -0.749 . . . . 0.0 110.871 -178.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 50.79 24.47 1.75 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.565 1.146 . . . . 0.0 111.666 -174.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.9 mt -134.27 102.7 5.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.415 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 20.4 t-80 -65.07 -175.37 0.2 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.244 1.018 . . . . 0.0 111.5 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.415 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 14.3 tp -133.38 9.02 4.0 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 99.1 mt -132.24 9.16 4.4 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.796 -0.565 . . . . 0.0 111.865 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.26 173.82 5.33 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.149 0.431 . . . . 0.0 110.369 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -146.69 165.45 29.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.193 0.52 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -82.95 5.66 21.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.327 1.051 . . . . 0.0 112.065 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -140.19 155.07 47.08 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.576 -0.703 . . . . 0.0 109.553 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -146.28 21.39 1.37 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.945 0.498 . . . . 0.0 111.904 -174.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -132.78 25.69 4.34 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 123.207 0.603 . . . . 0.0 110.657 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.902 179.525 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.166 0 C5'-C4'-O4' 114.097 3.498 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 O4'-C1'-N19 111.693 3.493 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.143 2.943 . 0.857 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.157 0 C4'-C3'-C2' 99.567 -3.133 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.406 4.206 . 0.592 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 C4'-C3'-C2' 98.773 -3.927 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.057 0 O4'-C1'-N19 111.984 3.784 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.627 0 C4'-C3'-C2' 99.135 -3.565 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C4'-C3'-C2' 99.752 -2.948 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.398 0 C4'-C3'-C2' 99.176 -3.524 . 0.667 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C4'-C3'-C2' 99.517 -3.183 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.344 -3.356 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.661 -3.039 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 C4'-C3'-C2' 99.406 -3.294 . 0.728 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 C4'-C3'-C2' 99.033 -3.667 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 99.23 -3.47 . 0.654 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.657 0 C4'-C3'-C2' 99.463 -3.237 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 0 C4'-C3'-C2' 99.162 -3.538 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.019 0 C4'-C3'-C2' 99.595 -3.105 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.591 0 C4'-C3'-C2' 99.998 -2.702 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.457 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.991 0 C4'-C3'-C2' 99.392 -3.308 . 0.762 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.457 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.336 -3.364 . 0.844 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.217 0 C4'-C3'-C2' 98.957 -3.743 . 0.793 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.737 -2.963 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.48 0 O4'-C1'-N19 111.354 3.154 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-C2' 99.118 -3.582 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.81 1 C4'-C3'-C2' 98.138 -4.562 . 0.685 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.365 -3.335 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C4'-C3'-C2' 100.341 -2.359 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.435 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.478 0 C4'-C3'-C2' 99.545 -3.155 . 0.837 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.435 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 N19-C1'-C2' 108.824 -2.86 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.295 -3.405 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.965 1 O4'-C1'-N19 112.203 4.003 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.461 0 C5'-C4'-C3' 112.13 -2.247 . 0.417 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C5'-C4'-C3' 107.578 -5.281 . 0.394 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.498 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.415 -3.182 2 C5'-C4'-C3' 108.459 -4.694 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.574 ' N3 ' ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.747 -2.953 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.574 ' C8 ' ' N3 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.885 1 N19-C1'-C2' 121.254 4.908 . 0.417 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.544 2.622 0 O4'-C1'-N19 111.994 3.794 . 0.545 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . 0.414 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.475 -3.225 . 0.763 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.543 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.003 0 C4'-C3'-C2' 99.819 -2.881 . 0.572 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.543 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.413 -3.319 0 C4'-C3'-C2' 99.179 -3.521 . 0.858 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.741 1 C4'-C3'-C2' 98.51 -4.19 . 0.835 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.215 -3.485 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C4'-C3'-C2' 98.801 -3.899 . 0.851 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.795 -2.905 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 100.174 -2.526 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.404 -3.296 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C5'-C4'-C3' 111.797 -2.468 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 1 O4'-C1'-N19 113.072 4.872 . 0.553 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.404 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.173 -3.527 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.404 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 C5'-C4'-C3' 112.141 -2.24 . 0.764 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.388 0 O4'-C1'-N19 111.721 3.521 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 O4'-C1'-N19 111.741 3.541 . 0.845 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.764 0 O4'-C1'-N19 111.616 3.416 . 0.544 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 C4'-C3'-C2' 98.878 -3.822 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.8 0 C4'-C3'-C2' 99.635 -3.065 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.362 1 O4'-C1'-N19 112.329 4.129 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 C4'-C3'-C2' 99.092 -3.608 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.397 0 O4'-C1'-N19 111.681 3.481 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.849 -3.851 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.867 -3.833 . 0.542 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 111.163 2.963 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.808 -2.892 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C4'-C3'-C2' 98.839 -3.861 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.362 0 C4'-C3'-C2' 98.924 -3.776 . 0.705 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C4'-C3'-C2' 98.712 -3.988 . 0.758 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.888 3.688 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 99.379 -3.321 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.617 2.352 1 C4'-C3'-C2' 98.202 -4.498 . 0.813 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.535 0 O4'-C1'-N19 111.41 3.21 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo . . . . . 0 CA--C 1.53 0.303 0 N-CA-C 112.699 0.231 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.7 -64.49 0.07 OUTLIER Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.383 -178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.08 -7.17 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.693 3.595 . . . . 0.0 114.495 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.62 11.85 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.814 0.846 . . . . 0.0 110.811 -177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.9 tp -150.56 69.83 8.77 Favored Pre-proline 0 N--CA 1.454 -0.249 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.3 -25.37 9.82 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 124.514 3.476 . . . . 0.0 113.756 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -50.83 -34.67 28.76 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -55.33 -62.58 1.58 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.94 0.496 . . . . 0.0 110.787 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.66 -31.57 64.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.324 0.511 . . . . 0.0 110.896 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -57.2 4.27 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -173.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.3 mmt -59.92 -50.39 73.97 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.716 0.407 . . . . 0.0 110.782 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -55.19 -47.37 75.34 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 tp -55.56 -55.03 36.7 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.656 -0.211 . . . . 0.0 110.654 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -56.24 -42.36 77.2 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.707 -175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.3 -50.92 69.73 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 pp -80.46 -14.91 12.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -174.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.525 ' HE2' ' CD2' ' A' ' 69' ' ' PHE . 2.6 tppp? -119.15 61.67 5.71 Favored Pre-proline 0 CA--C 1.534 0.345 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -170.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -43.04 -34.11 3.74 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.014 2.476 . . . . 0.0 114.245 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.23 146.85 11.38 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 174.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -169.52 -169.94 0.99 Allowed 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.737 0.815 . . . . 0.0 110.152 -175.828 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.665 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -129.31 136.21 49.75 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.52 ' CD1' HD21 ' A' ' 20' ' ' LEU . 9.4 m-85 -109.47 136.44 48.87 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptp -135.13 140.22 45.27 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -105.3 121.69 44.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.727 0.775 . . . . 0.0 111.061 -172.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.19 -177.27 3.12 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.764 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.578 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.7 t 46.77 -119.58 0.96 Allowed 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 123.564 0.745 . . . . 0.0 110.901 -166.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.5 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 68.34 83.28 0.16 Allowed 'General case' 0 N--CA 1.426 -1.646 0 C-N-CA 127.017 2.127 . . . . 0.0 110.005 -172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.8 t -166.59 164.45 16.95 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.825 1.25 . . . . 0.0 107.756 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 158.17 -168.62 34.65 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.04 8.41 1.71 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 125.176 3.917 . . . . 0.0 112.768 177.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 31' ' ' VAL . 18.3 t 75.65 2.14 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 124.377 1.071 . . . . 0.0 112.132 177.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -135.41 -4.73 2.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.717 -0.614 . . . . 0.0 110.583 174.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.28 61.02 24.07 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.606 0.762 . . . . 0.0 109.318 169.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.77 136.72 25.94 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 124.35 3.367 . . . . 0.0 111.376 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.01 124.25 49.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 122.589 0.356 . . . . 0.0 110.662 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.5 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 41.7 m-85 -112.93 139.2 48.77 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.578 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.0 104.99 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.652 173.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 24' ' ' LEU . 8.5 mtt -93.53 130.76 39.28 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 43.0 p -121.47 135.66 55.02 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.537 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.9 p -116.3 133.33 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.193 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.922 -173.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -111.49 126.7 55.25 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 124.438 1.086 . . . . 0.0 111.153 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.442 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.1 t -140.88 134.09 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 C-N-CA 125.709 1.604 . . . . 0.0 108.657 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.5 t30 51.95 17.08 0.6 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.98 6.57 69.32 Favored Glycine 0 C--N 1.339 0.699 0 O-C-N 121.726 -0.609 . . . . 0.0 112.099 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -103.8 132.07 50.4 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 t -122.8 134.1 66.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.5 m-85 -128.79 133.64 48.12 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.372 0.42 . . . . 0.0 110.115 -178.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -110.54 137.12 48.64 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.666 0.604 . . . . 0.0 110.686 -169.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.66 135.42 7.83 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -107.46 136.49 47.16 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 122.925 0.49 . . . . 0.0 110.845 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.04 155.27 26.56 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.26 135.24 24.41 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.723 2.282 . . . . 0.0 107.054 169.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.5 m 62.28 153.58 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.833 0.825 . . . . 0.0 111.469 -172.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -65.88 -24.23 66.81 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -57.7 -67.94 0.29 Allowed 'General case' 0 C--O 1.228 -0.05 0 CA-C-N 118.703 0.683 . . . . 0.0 111.744 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -55.67 -36.72 67.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.715 0.806 . . . . 0.0 112.118 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.61 -61.35 2.57 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.887 0.312 . . . . 0.0 110.857 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -56.32 -37.03 69.37 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 119.274 -0.393 . . . . 0.0 111.652 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.62 -61.83 2.15 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.569 0.622 . . . . 0.0 111.228 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.572 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 9.8 t-160 -56.55 -44.11 80.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.165 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.28 -45.99 79.92 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 122.54 -0.1 . . . . 0.0 111.18 176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.54 75.42 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.789 0.836 . . . . 0.0 110.591 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.8 -55.41 30.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.145 0.578 . . . . 0.0 111.294 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.572 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.2 mttt -55.72 -58.91 5.85 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.272 0.558 . . . . 0.0 110.706 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.19 72.32 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.432 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tp -55.68 -61.56 2.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.768 0.713 . . . . 0.0 109.413 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -63.35 -27.54 69.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -172.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.6 t -73.96 -56.45 4.93 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.468 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.724 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.6 t80 -55.88 -32.73 63.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.548 1.939 . . . . 0.0 113.467 -173.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.7 m -57.04 -14.14 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -106.32 -4.95 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.928 -0.482 . . . . 0.0 111.487 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -146.87 57.83 3.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 123.751 0.82 . . . . 0.0 110.706 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.724 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -72.84 -15.23 26.66 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 124.103 3.202 . . . . 0.0 114.351 -175.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -155.55 -13.71 0.11 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.716 0.689 . . . . 0.0 112.389 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -153.68 171.42 18.85 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.5 t -157.99 161.89 38.16 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.15 14.22 0.7 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.48 1.112 . . . . 0.0 109.449 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.01 -178.32 6.22 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.443 1.097 . . . . 0.0 109.836 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -147.41 177.74 8.99 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.033 0.533 . . . . 0.0 110.564 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.97 157.46 43.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.322 0.649 . . . . 0.0 109.359 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.17 179.55 8.0 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.365 0.666 . . . . 0.0 110.751 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 76.0 mtm -142.75 177.97 7.96 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.338 0.655 . . . . 0.0 110.167 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.85 179.32 38.37 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.359 0.504 . . . . 0.0 112.404 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -138.38 169.24 18.13 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.475 0.71 . . . . 0.0 109.531 -177.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -156.29 179.17 9.49 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.622 0.769 . . . . 0.0 110.039 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 pp -143.41 177.85 8.16 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.987 0.515 . . . . 0.0 110.691 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.6 p -155.35 -176.95 6.2 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.594 0.358 . . . . 0.0 110.648 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.6 p -139.61 156.63 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -148.49 20.24 1.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.796 0.438 . . . . 0.0 110.814 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -145.87 175.3 10.52 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 122.927 0.491 . . . . 0.0 110.203 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.3 176.39 10.03 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.448 0.699 . . . . 0.0 110.678 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -150.13 -178.73 6.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.021 0.928 . . . . 0.0 110.324 -177.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.8 p -137.56 176.75 8.43 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.182 0.593 . . . . 0.0 110.364 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.7 m -143.39 -177.11 5.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.913 0.485 . . . . 0.0 110.695 -177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -53.5 157.52 2.09 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.296 1.038 . . . . 0.0 112.009 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -133.97 -176.18 4.09 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.931 0.892 . . . . 0.0 110.114 -173.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -146.32 172.15 13.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.088 0.47 . . . . 0.0 110.448 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -153.43 170.96 19.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.965 0.506 . . . . 0.0 110.376 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -142.8 152.72 59.91 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.32 173.69 14.08 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.788 2.992 . . . . 0.0 111.384 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -149.08 146.31 27.66 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.101 0.561 . . . . 0.0 109.716 177.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.3 t -163.49 178.07 8.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.954 0.502 . . . . 0.0 109.88 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.1 mp -64.2 -177.16 0.26 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.816 1.246 . . . . 0.0 110.639 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -135.2 164.15 28.34 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.298 0.639 . . . . 0.0 109.956 -177.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -146.43 -179.68 6.92 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.682 0.393 . . . . 0.0 110.618 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -163.55 -174.68 33.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -141.67 22.27 2.15 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.614 0.765 . . . . 0.0 110.595 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -135.01 172.28 13.23 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 123.294 0.637 . . . . 0.0 109.94 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 49.5 p -140.89 158.21 65.66 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 123.076 0.55 . . . . 0.0 109.803 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -74.23 165.63 31.44 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.591 2.861 . . . . 0.0 111.462 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -85.85 22.12 1.74 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.83 0.852 . . . . 0.0 111.025 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -110.58 6.49 21.9 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -69.09 171.53 8.13 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.141 0.577 . . . . 0.0 110.842 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -154.21 153.48 28.33 Favored Pre-proline 0 N--CA 1.456 -0.144 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.226 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.07 163.86 34.36 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 123.67 2.914 . . . . 0.0 111.419 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.35 174.63 12.51 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.333 3.355 . . . . 0.0 110.844 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.23 29.86 1.16 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.205 0.526 . . . . 0.0 111.298 -179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -129.23 161.84 29.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.156 0.582 . . . . 0.0 109.998 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.26 6.79 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.29 0.636 . . . . 0.0 110.584 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.27 -179.75 41.96 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 110.874 -0.891 . . . . 0.0 110.874 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.1 t -61.11 155.64 20.01 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.827 0.851 . . . . 0.0 111.096 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -157.04 175.78 13.63 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.246 0.618 . . . . 0.0 110.797 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.31 168.49 41.29 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -159.57 -179.71 8.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.016 0.526 . . . . 0.0 109.818 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -134.44 16.71 3.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.2 m -142.85 -179.23 6.22 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.111 0.964 . . . . 0.0 109.643 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -149.97 171.02 17.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.745 0.307 . . . . 0.0 111.178 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.7 p -152.57 178.56 9.46 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.008 0.923 . . . . 0.0 110.235 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 45.6 m -55.66 140.44 41.37 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.664 0.269 . . . . 0.0 111.166 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 13.2 t -158.85 178.35 10.18 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.769 0.828 . . . . 0.0 109.56 -178.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -172.65 178.94 44.47 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -144.21 11.84 1.55 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.217 0.607 . . . . 0.0 111.084 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 49.4 t -59.26 156.93 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 123.701 0.8 . . . . 0.0 109.898 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.6 p -139.63 4.49 2.15 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.019 0.528 . . . . 0.0 112.036 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.96 126.3 26.88 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.0 p -162.51 178.5 8.54 Favored 'General case' 0 C--O 1.23 0.039 0 O-C-N 121.95 -0.469 . . . . 0.0 110.96 -177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.62 175.54 12.68 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.418 0.687 . . . . 0.0 109.719 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.6 m -60.9 156.31 47.79 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 122.803 0.441 . . . . 0.0 110.517 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -51.62 158.26 4.41 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 123.858 3.039 . . . . 0.0 113.061 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.2 m -61.44 158.58 37.76 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.506 0.722 . . . . 0.0 110.82 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.89 171.42 16.63 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.083 2.522 . . . . 0.0 110.933 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.19 168.72 23.81 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.223 0.609 . . . . 0.0 110.233 -178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.5 m -75.5 6.47 4.64 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.179 0.591 . . . . 0.0 112.045 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 97.6 mt -138.06 152.64 49.01 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.931 0.492 . . . . 0.0 109.75 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 10.4 m 59.06 0.02 0.16 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.272 1.029 . . . . 0.0 112.871 -176.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -148.56 160.47 36.14 Favored Pre-proline 0 C--O 1.237 0.398 0 C-N-CA 124.137 0.975 . . . . 0.0 109.013 -178.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.32 135.4 46.29 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.469 2.779 . . . . 0.0 111.824 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -78.68 -10.37 15.73 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.499 2.799 . . . . 0.0 111.05 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 34.9 tp -155.4 71.45 5.55 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 123.923 0.889 . . . . 0.0 109.204 -176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.14 -31.78 29.7 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.921 3.08 . . . . 0.0 113.04 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 50.5 mt -148.82 128.19 6.33 Favored Pre-proline 0 C--N 1.343 0.31 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.21 151.39 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.494 2.796 . . . . 0.0 112.001 176.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.86 159.19 31.2 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 122.996 2.464 . . . . 0.0 110.706 177.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.27 168.91 1.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.879 3.053 . . . . 0.0 112.745 172.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -151.75 162.9 25.35 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.98 155.48 5.91 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.381 3.387 . . . . 0.0 113.406 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.77 164.04 35.68 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.774 2.983 . . . . 0.0 111.041 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -73.04 177.95 7.12 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.88 3.053 . . . . 0.0 111.262 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 18.6 m -134.06 16.55 3.83 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.709 0.803 . . . . 0.0 110.847 -178.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.95 -175.9 39.82 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -54.6 144.08 22.72 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 117.452 0.626 . . . . 0.0 110.853 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.446 ' HB3' ' HD2' ' A' ' 163' ' ' PRO . 8.0 m120 -67.7 162.85 54.18 Favored Pre-proline 0 N--CA 1.453 -0.322 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.464 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 63.3 Cg_endo -71.12 -12.42 30.23 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.584 2.189 . . . . 0.0 109.831 -174.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 65.5 t -65.53 -33.41 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 123.05 0.54 . . . . 0.0 109.792 176.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 97.9 mmm -88.89 -47.15 8.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.994 -0.283 . . . . 0.0 110.71 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -58.03 -36.73 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.34 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -64.57 -55.32 21.23 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 173.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -70.02 13.99 0.13 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.265 1.026 . . . . 0.0 112.233 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -137.2 -3.41 1.97 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.636 -0.665 . . . . 0.0 111.483 175.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -110.45 -37.1 5.59 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.534 -0.729 . . . . 0.0 110.606 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.53 72.59 3.33 Favored Pre-proline 0 C--N 1.344 0.344 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 -177.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.29 -174.08 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.016 3.144 . . . . 0.0 111.559 173.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 105.76 35.86 2.93 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.145 -0.972 . . . . 0.0 113.209 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.75 -179.53 5.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.621 0.724 . . . . 0.0 110.924 -175.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -141.62 151.94 43.55 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.485 ' CG ' HG13 ' A' ' 194' ' ' VAL . 34.5 m-85 -130.21 152.33 49.76 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -133.98 166.71 22.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.549 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -124.49 135.16 52.99 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -118.95 158.72 25.19 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 111.775 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.1 p -41.96 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.454 2.302 . . . . 0.0 117.112 -166.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -133.09 151.14 52.04 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 113.061 -1.881 . . . . 0.0 110.332 -176.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 30.9 t -166.05 163.27 18.23 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.619 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 122.48 175.62 14.77 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 123.835 0.731 . . . . 0.0 111.725 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -72.77 162.99 28.8 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 14.8 m -60.94 -13.81 18.44 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -119.74 13.99 12.5 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 122.561 0.344 . . . . 0.0 111.188 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -146.7 17.12 1.28 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -57.88 153.89 13.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.526 1.131 . . . . 0.0 110.904 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -142.5 153.99 44.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.48 0.712 . . . . 0.0 110.672 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.81 168.0 20.96 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.373 1.046 . . . . 0.0 109.03 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.57 161.42 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 118.518 0.599 . . . . 0.0 110.803 176.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 87.1 mmm -131.72 153.42 50.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 79.2 p -126.57 171.54 11.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 169.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.485 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -150.72 163.71 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 90.8 t -136.3 126.27 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 169.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 19.1 t -141.24 123.71 14.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -174.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.7 t70 55.99 9.72 0.5 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.25 -19.95 24.06 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -74.83 174.96 8.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -138.39 140.25 39.3 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.326 0.584 . . . . 0.0 110.447 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -137.91 165.71 25.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.628 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.6 tt0 -154.14 161.05 42.14 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.87 132.37 2.57 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 93.2 p -111.98 148.69 33.25 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -160.28 170.79 36.39 Favored Glycine 0 CA--C 1.52 0.346 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -68.01 -11.1 58.27 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -152.9 172.83 16.18 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.237 0.615 . . . . 0.0 109.372 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -67.9 -31.57 71.45 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -69.94 -43.8 70.86 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 117.973 0.352 . . . . 0.0 110.248 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.08 -38.81 79.22 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.586 0.754 . . . . 0.0 109.806 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.64 -48.17 82.1 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.572 177.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 26.7 tttp -71.21 -32.88 69.36 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 121.769 -0.582 . . . . 0.0 110.825 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.77 68.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.791 -0.568 . . . . 0.0 110.64 176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -87.53 -44.27 11.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.821 0.343 . . . . 0.0 110.896 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.59 76.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -84.51 -34.55 23.3 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.041 0.536 . . . . 0.0 110.72 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.1 tm0? -57.25 -39.99 76.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.435 173.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.4 m -74.28 -36.89 63.82 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 119.645 -0.217 . . . . 0.0 110.923 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.04 -46.92 72.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.637 0.256 . . . . 0.0 110.777 -178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.04 -56.39 22.81 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.582 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.07 -56.53 15.45 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.595 -175.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 87.0 m -60.23 -58.02 10.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.08 -28.54 41.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 119.077 0.853 . . . . 0.0 112.157 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -92.39 1.35 57.28 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.013 0.824 . . . . 0.0 111.033 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 58.09 34.61 24.38 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 122.845 0.458 . . . . 0.0 111.651 -177.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.8 mt -138.05 -164.93 1.7 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.927 0.891 . . . . 0.0 109.813 -175.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.471 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 22.7 t-80 -146.08 -167.3 2.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.471 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 15.3 tp -139.95 7.78 2.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 117.827 0.285 . . . . 0.0 111.175 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 20.1 tp -151.62 16.11 0.69 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.92 0.488 . . . . 0.0 110.646 -178.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -139.46 25.69 2.4 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.359 0.664 . . . . 0.0 111.388 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -64.31 -2.56 2.25 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.018 0.748 . . . . 0.0 113.018 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -149.96 155.19 39.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.571 0.623 . . . . 0.0 109.858 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 -155.99 -9.58 0.11 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -70.69 150.6 45.8 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.74 -0.6 . . . . 0.0 110.726 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -157.55 -13.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.109 -177.575 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.034 -3.666 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 112.049 3.849 . 0.719 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.992 0 C4'-C3'-C2' 99.482 -3.218 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C4'-C3'-C2' 99.075 -3.625 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.639 3.439 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C4'-C3'-C2' 99.152 -3.548 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 98.798 -3.902 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C4'-C3'-C2' 98.976 -3.724 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.38 0 C4'-C3'-C2' 99.187 -3.513 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C4'-C3'-C2' 99.565 -3.135 . 0.659 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C4'-C3'-C2' 98.738 -3.962 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 1 C4'-C3'-C2' 98.596 -4.104 . 0.686 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 C4'-C3'-C2' 99.374 -3.326 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.572 0 C4'-C3'-C2' 99.761 -2.939 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 99.17 -3.53 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.15 -3.55 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.561 -3.139 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C4'-C3'-C2' 99.493 -3.207 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 O4'-C1'-N19 111.406 3.206 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 C4'-C3'-C2' 99.162 -3.538 . 0.676 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.457 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.182 -3.518 . 0.824 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.457 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.109 -3.591 . 0.775 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.922 1 O4'-C1'-N19 112.553 4.353 . 0.811 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 99.677 -3.023 . 0.759 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 110.924 2.724 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.941 0 C4'-C3'-C2' 98.717 -3.983 . 0.871 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.194 -3.506 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.069 0 C4'-C3'-C2' 99.556 -3.144 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.505 0 C4'-C3'-C2' 98.956 -3.744 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.722 0 C4'-C3'-C2' 99.719 -2.981 . 0.617 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.396 -3.304 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . 0.446 " H2'" ' C6 ' ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.852 0 C4'-C3'-C2' 99.136 -3.564 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . 0.446 ' C6 ' " H2'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.211 -3.489 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.424 0 C5'-C4'-C3' 111.444 -2.704 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.538 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.857 1 C5'-C4'-C3' 108.024 -4.984 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.538 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.667 3 P-O3'-C3' 125.004 4.42 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.407 -3.825 0 C4'-C3'-C2' 98.956 -3.744 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C4'-C3'-C2' 100.115 -2.585 . 0.67 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.596 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.531 1 C4'-C3'-C2' 98.198 -4.502 . 0.706 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.441 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 111.675 3.475 . 0.622 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.441 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C5'-C4'-O4' 113.168 2.834 . 0.891 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 O4'-C1'-N19 111.729 3.529 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.316 -3.384 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.691 0 C4'-C3'-C2' 98.998 -3.702 . 0.913 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.063 1 C4'-C3'-C2' 98.544 -4.156 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.712 -2.988 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.185 0 C4'-C3'-C2' 99.155 -3.545 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 99.239 -3.461 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.096 1 O4'-C1'-N19 113.651 5.451 . 0.826 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C5'-C4'-O4' 113.465 3.046 . 0.369 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.354 0 O4'-C1'-N19 110.62 2.42 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.112 0 C4'-C3'-C2' 99.795 -2.905 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.289 1 C4'-C3'-C2' 98.079 -4.621 . 0.786 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.407 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C4'-C3'-C2' 99.45 -3.25 . 0.461 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.407 ' C6 ' " H2'" ' B' ' 291' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 110.959 2.759 . 0.777 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.891 0 O4'-C1'-N19 111.875 3.675 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.895 3.695 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.152 0 O4'-C1'-N19 110.929 2.729 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 O4'-C1'-N19 111.362 3.162 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.656 0 C4'-C3'-C2' 98.704 -3.996 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C4'-C3'-C2' 99.152 -3.548 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 O4'-C1'-N19 110.871 2.671 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 110.976 2.776 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.26 0 C4'-C3'-C2' 99.2 -3.5 . 0.566 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C4'-C3'-C2' 98.984 -3.716 . 0.694 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C4'-C3'-C2' 98.953 -3.747 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.832 0 O4'-C1'-N19 112.009 3.809 . 0.836 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.718 -2.982 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.784 1 C4'-C3'-C2' 97.653 -5.047 . 0.74 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.973 1 O4'-C1'-N19 112.209 4.009 . 0.76 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.529 0.273 0 N-CA-C 113.042 0.362 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.48 176.44 44.71 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -52.49 -31.84 50.4 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 124.507 3.471 . . . . 0.0 114.991 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.3 p -154.32 -8.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.4 tp 44.45 70.42 1.95 Allowed Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.207 1.003 . . . . 0.0 111.589 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.62 -26.1 12.27 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 124.664 3.576 . . . . 0.0 113.956 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.27 -39.96 46.69 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 122.961 0.505 . . . . 0.0 110.812 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -55.99 -65.71 0.55 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.472 0.709 . . . . 0.0 111.604 176.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.95 -34.25 65.5 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.042 -0.412 . . . . 0.0 111.843 -177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mp -70.61 -54.93 10.1 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -174.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -44.65 96.75 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.251 0.22 . . . . 0.0 111.364 177.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.8 tp60 -55.9 -52.47 64.0 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 37.7 tp -56.09 -48.72 75.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.123 0.264 . . . . 0.0 111.013 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -55.63 -40.32 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 122.363 0.265 . . . . 0.0 111.435 -177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -65.79 -54.98 19.73 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.182 0.593 . . . . 0.0 111.962 176.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HB2' ' A' ' 66' ' ' LEU . 31.5 pt -69.59 -35.74 67.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.132 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.8 pttt -65.41 144.57 99.0 Favored Pre-proline 0 C--N 1.342 0.28 0 CA-C-N 119.751 1.159 . . . . 0.0 111.476 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -89.45 -8.76 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.905 3.07 . . . . 0.0 110.36 170.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 140.98 139.31 3.68 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 104.483 -3.447 . . . . 0.0 104.483 -173.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.619 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -158.35 -177.58 6.65 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.309 1.055 . . . . 0.0 113.166 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.619 ' N ' HD22 ' A' ' 20' ' ' LEU . 36.5 mt-30 -133.03 135.46 45.42 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.762 0.664 . . . . 0.0 112.326 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -108.76 135.35 50.12 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.0 ptp -135.18 145.5 47.79 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.636 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.1 tm? -107.21 144.15 34.41 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.866 1.266 . . . . 0.0 108.562 -176.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.606 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.2 mt -141.63 161.16 38.62 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -168.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.614 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 31.1 m 68.24 -110.86 0.11 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 125.189 1.556 . . . . 0.0 108.405 171.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.49 78.56 0.1 Allowed 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 176.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.6 p -136.59 -174.0 3.58 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 119.05 -173.13 14.84 Favored Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 113.302 167.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.67 6.88 4.18 Favored 'Trans proline' 0 N--CA 1.45 -1.052 1 C-N-CA 125.753 4.302 . . . . 0.0 113.309 -177.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 31' ' ' VAL . 17.6 t 75.16 1.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 123.837 0.855 . . . . 0.0 112.371 175.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -131.78 -4.66 3.63 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.429 0.691 . . . . 0.0 110.43 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.64 58.43 8.45 Favored Pre-proline 0 C--O 1.234 0.258 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 168.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.51 152.88 60.44 Favored 'Trans proline' 0 N--CA 1.442 -1.523 0 C-N-CA 123.639 2.893 . . . . 0.0 112.133 -171.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -119.92 106.53 12.14 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.63 1.205 . . . . 0.0 113.052 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -104.89 140.17 38.54 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 113.133 -1.849 . . . . 0.0 107.212 -175.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.614 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 16.4 t -125.13 104.37 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 C-N-CA 118.799 -1.161 . . . . 0.0 111.694 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.448 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.0 mtp -99.66 131.59 45.55 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -176.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 60.4 p -128.54 135.66 49.7 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 46' ' ' VAL . 15.0 p -111.53 143.76 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -128.39 118.28 22.87 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 123.466 0.479 . . . . 0.0 109.733 -171.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.409 HG21 ' CE2' ' A' ' 69' ' ' PHE . 5.0 t -136.04 132.94 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.423 1.089 . . . . 0.0 109.871 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 52.32 1.62 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.22 0.77 18.9 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-N 118.83 0.741 . . . . 0.0 111.884 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -104.0 134.48 47.21 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.2 t -126.66 135.12 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 39' ' ' SER . 61.6 m-85 -132.15 135.31 46.29 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -175.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -114.47 136.77 52.64 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 124.267 0.979 . . . . 0.0 111.705 -166.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -133.26 135.36 8.03 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.1 p -123.36 115.82 22.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.912 0.863 . . . . 0.0 110.557 -173.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -153.89 170.82 32.56 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.587 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.446 ' O ' HG22 ' A' ' 53' ' ' THR . 64.9 Cg_endo -70.25 136.64 32.19 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.96 2.44 . . . . 0.0 108.111 171.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 52' ' ' PRO 0.275 14.7 t 57.29 160.64 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.615 1.197 . . . . 0.0 113.642 -174.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.76 -30.12 67.62 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -171.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -55.76 -66.96 0.33 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.93 0.395 . . . . 0.0 111.496 -172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -57.04 -40.55 76.98 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 123.486 0.715 . . . . 0.0 111.938 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.29 -61.14 2.69 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.251 0.478 . . . . 0.0 110.845 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.614 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.2 tttm -57.92 -36.64 72.75 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.059 178.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.407 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.1 tm? -56.47 -61.3 2.51 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.966 0.507 . . . . 0.0 110.869 177.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.57 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 5.3 t-160 -55.63 -42.52 75.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.56 -46.17 80.88 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 119.774 -0.155 . . . . 0.0 111.098 175.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.13 -49.52 73.68 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.759 . . . . 0.0 110.467 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.81 -54.54 43.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.123 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.57 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.5 mttt -56.17 -56.19 23.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.053 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.26 -51.22 70.24 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.702 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HB2' HD11 ' A' ' 16' ' ' ILE . 1.1 pp -55.77 -52.42 64.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -61.56 -27.7 68.81 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.726 -0.609 . . . . 0.0 111.502 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 t -77.86 -73.14 0.33 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.378 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CE2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -63.66 -10.33 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 p -53.91 -19.96 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 120.529 1.513 . . . . 0.0 110.762 172.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -88.6 -10.34 49.05 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.095 0.474 . . . . 0.0 111.848 178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -145.62 62.06 8.21 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.328 0.651 . . . . 0.0 111.551 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -72.49 -23.0 20.63 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 124.088 3.192 . . . . 0.0 112.862 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -158.81 9.07 0.13 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.117 0.567 . . . . 0.0 110.627 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 170.96 5.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 122.936 0.494 . . . . 0.0 111.341 -178.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 46.2 m -109.36 -1.93 18.14 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.495 0.718 . . . . 0.0 110.965 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -76.11 16.89 0.39 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.644 0.778 . . . . 0.0 111.338 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -131.26 13.2 5.1 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.494 1.117 . . . . 0.0 110.578 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.8 t60 -146.16 170.94 15.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.16 0.984 . . . . 0.0 109.427 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.1 tp -153.33 155.87 37.3 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 122.233 -0.292 . . . . 0.0 110.976 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.09 16.56 1.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.147 0.579 . . . . 0.0 110.784 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.4 tpt -146.11 164.59 31.68 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -174.29 -167.64 34.06 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.31 -0.471 . . . . 0.0 112.611 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -137.76 -173.73 3.58 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.27 1.028 . . . . 0.0 108.697 -178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -140.28 164.49 29.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.511 0.672 . . . . 0.0 111.406 -178.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -153.48 -176.18 5.69 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.679 1.192 . . . . 0.0 110.143 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 t -140.66 -0.09 1.58 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.849 0.459 . . . . 0.0 111.565 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -66.31 143.57 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -156.68 156.24 33.1 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -162.01 176.37 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -59.86 158.73 10.09 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.154 0.582 . . . . 0.0 110.582 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.8 p90 -155.59 7.67 0.24 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.3 t -144.22 166.4 25.15 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.288 0.566 . . . . 0.0 110.752 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 95.0 p -161.79 -172.09 3.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.506 0.722 . . . . 0.0 110.52 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -123.21 9.17 9.19 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.876 0.471 . . . . 0.0 111.128 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 44.78 36.4 1.82 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.962 1.305 . . . . 0.0 113.007 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.28 166.66 1.1 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.209 0.528 . . . . 0.0 111.461 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -150.75 171.53 17.03 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.42 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -142.88 154.2 61.86 Favored Pre-proline 0 N--CA 1.454 -0.229 0 C-N-CA 124.155 0.982 . . . . 0.0 109.015 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.6 171.41 15.43 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.816 3.011 . . . . 0.0 111.922 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -151.82 28.36 0.61 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.032 0.533 . . . . 0.0 110.557 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.9 p -127.88 3.69 5.98 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.414 0.686 . . . . 0.0 111.456 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.2 173.31 14.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.543 0.737 . . . . 0.0 110.747 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.51 22.71 2.16 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.921 0.488 . . . . 0.0 111.113 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.7 t30 51.46 28.33 4.41 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.125 0.97 . . . . 0.0 111.237 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.16 -174.21 38.12 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -140.52 -178.33 5.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.189 0.595 . . . . 0.0 110.631 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -137.7 2.6 2.44 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.981 0.512 . . . . 0.0 110.808 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.3 p -69.89 157.83 88.74 Favored Pre-proline 0 N--CA 1.457 -0.122 0 O-C-N 122.007 -0.433 . . . . 0.0 110.774 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -72.97 179.04 5.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.972 2.448 . . . . 0.0 111.223 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -149.11 163.23 38.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.755 0.422 . . . . 0.0 109.872 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 97.0 mttt 50.34 17.66 0.36 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.578 1.151 . . . . 0.0 112.458 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.9 t -158.59 177.24 11.43 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.305 1.042 . . . . 0.0 108.621 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 41.01 56.76 8.47 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.859 1.263 . . . . 0.0 113.085 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.61 156.27 66.75 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.252 2.635 . . . . 0.0 111.112 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -77.36 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.422 3.414 . . . . 0.0 112.612 -177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.04 156.57 40.21 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.441 0.564 . . . . 0.0 110.991 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -160.73 173.6 15.17 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.702 0.801 . . . . 0.0 109.838 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.54 157.54 4.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 C-N-CA 123.186 0.594 . . . . 0.0 109.484 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 122' ' ' ASN . . . 172.3 -171.07 44.03 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.7 m -69.29 20.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.083 0.953 . . . . 0.0 112.663 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 120' ' ' GLY . 39.7 p-10 -136.65 20.08 3.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 110.376 -176.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -161.82 -161.21 11.63 Favored Glycine 0 CA--C 1.53 1.011 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -143.41 159.46 42.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -72.91 -6.46 45.31 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.5 m 51.59 24.83 2.47 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.857 0.863 . . . . 0.0 111.775 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 129' ' ' SER . 46.4 t80 -65.06 177.05 1.08 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.552 1.141 . . . . 0.0 111.29 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . 0.42 ' N ' ' CG ' ' A' ' 127' ' ' PHE . 41.7 m -68.52 18.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.462 1.105 . . . . 0.0 112.318 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 127' ' ' PHE . 49.9 m -142.31 -172.02 3.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.589 1.156 . . . . 0.0 109.728 -177.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.3 t -134.55 13.21 3.76 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.84 0.856 . . . . 0.0 111.213 -177.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 177.41 178.01 46.71 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -142.12 17.46 2.09 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.304 1.042 . . . . 0.0 110.263 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.8 14.37 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.159 0 C-N-CA 123.158 0.583 . . . . 0.0 110.716 -176.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 78.6 p -144.17 173.94 11.31 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.899 0.88 . . . . 0.0 110.936 -177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.05 166.22 7.93 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.071 0.548 . . . . 0.0 110.81 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 24.1 t -151.28 -179.61 7.5 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.524 1.13 . . . . 0.0 109.103 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.5 158.7 9.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.667 0.387 . . . . 0.0 111.569 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.5 p -156.63 164.79 20.37 Favored Pre-proline 0 N--CA 1.464 0.246 0 C-N-CA 123.819 0.848 . . . . 0.0 109.783 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.83 161.96 2.84 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.965 3.11 . . . . 0.0 113.247 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.6 p -153.81 144.29 15.8 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.38 -15.55 8.68 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.122 3.215 . . . . 0.0 115.431 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -68.59 169.84 10.31 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.267 0.485 . . . . 0.0 111.471 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.8 p -150.28 2.76 0.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.407 ' N ' HD22 ' A' ' 144' ' ' LEU . 3.7 mm? -70.48 159.94 33.33 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.606 -0.684 . . . . 0.0 109.509 177.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.3 p -142.56 3.5 1.49 Allowed 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -143.25 147.83 42.06 Favored Pre-proline 0 CA--C 1.531 0.222 0 O-C-N 121.715 -0.616 . . . . 0.0 109.733 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -79.02 169.25 19.55 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 123.574 2.85 . . . . 0.0 110.916 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.52 166.42 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.063 3.175 . . . . 0.0 112.404 171.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.401 ' N ' ' CD ' ' A' ' 150' ' ' PRO . 95.1 mt -141.04 47.12 0.99 Allowed Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 123.576 0.751 . . . . 0.0 112.071 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 149' ' ' LEU . 58.3 Cg_endo -67.38 149.32 80.63 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.535 2.157 . . . . 0.0 110.159 178.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 25.3 pt -147.51 49.86 0.84 Allowed Pre-proline 0 C--O 1.234 0.262 0 C-N-CA 123.374 0.67 . . . . 0.0 112.54 -174.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.98 157.83 59.73 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 122.23 1.953 . . . . 0.0 110.542 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.06 122.97 10.1 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.374 2.716 . . . . 0.0 111.292 -174.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -85.2 8.9 4.36 Favored 'Trans proline' 0 N--CA 1.45 -1.046 0 C-N-CA 124.341 3.361 . . . . 0.0 111.985 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -54.44 132.84 62.81 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 118.445 0.566 . . . . 0.0 112.008 -174.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -78.91 167.9 21.52 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 123.696 2.931 . . . . 0.0 110.265 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.14 164.37 34.2 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 123.604 2.87 . . . . 0.0 109.835 175.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.25 162.75 41.17 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 123.301 2.667 . . . . 0.0 110.865 -178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 54.4 m -150.75 174.14 13.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.91 0.884 . . . . 0.0 110.071 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -176.55 22.98 0.05 OUTLIER Glycine 0 CA--C 1.529 0.941 0 CA-C-O 119.74 -0.478 . . . . 0.0 112.394 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -140.53 19.22 2.37 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-N 117.72 0.76 . . . . 0.0 111.827 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -50.06 112.91 3.02 Favored Pre-proline 0 CA--C 1.531 0.249 0 C-N-CA 123.37 0.668 . . . . 0.0 112.199 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.454 ' HA ' HD12 ' A' ' 166' ' ' ILE . 89.4 Cg_endo -83.42 -11.04 9.65 Favored 'Trans proline' 0 N--CA 1.443 -1.451 0 C-N-CA 124.008 3.139 . . . . 0.0 111.81 -172.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.424 HG11 H5'' ' B' ' 291' ' ' ' C' . 85.8 t -64.15 -45.44 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 118.331 0.514 . . . . 0.0 110.251 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . 0.432 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 38.9 ttm -71.11 -41.62 70.34 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 117.738 0.244 . . . . 0.0 110.946 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' A' ' 163' ' ' PRO . 58.4 mt -55.36 -50.01 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -62.86 -47.07 84.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -70.06 5.13 1.73 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.477 1.111 . . . . 0.0 112.665 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -134.52 -22.08 1.72 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 119.209 0.913 . . . . 0.0 112.019 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.08 -38.29 19.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.171 0.896 . . . . 0.0 110.526 175.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -158.85 69.94 3.55 Favored Pre-proline 0 N--CA 1.454 -0.248 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -175.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.98 -170.36 0.28 Allowed 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.427 2.751 . . . . 0.0 109.267 176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.09 35.11 4.9 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 121.755 -0.59 . . . . 0.0 112.788 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.14 -177.28 3.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 123.869 0.868 . . . . 0.0 109.891 -177.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -139.58 152.43 46.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.463 ' CG ' HG13 ' A' ' 194' ' ' VAL . 25.8 m-85 -127.67 153.3 46.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -135.24 159.4 41.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -115.15 141.79 47.54 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.08 157.04 40.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 124.079 0.862 . . . . 0.0 109.642 -174.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 25.3 m -41.48 169.65 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.897 2.479 . . . . 0.0 117.377 -169.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.86 169.11 18.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.17 -176.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 54.8 m -151.82 147.74 27.0 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 146.47 -174.36 26.38 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.86 12.11 3.39 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.445 0.698 . . . . 0.0 111.299 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 51.0 m 106.42 -8.61 0.01 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 127.78 2.432 . . . . 0.0 112.35 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -121.92 5.98 9.87 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.339 0.4 . . . . 0.0 111.327 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.66 17.04 1.01 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -58.28 143.33 44.99 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.197 1.399 . . . . 0.0 110.981 -174.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 66.7 m -148.08 158.32 44.0 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 109.814 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -144.26 174.02 11.26 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.34 158.87 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 118.469 0.577 . . . . 0.0 111.411 173.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 92.9 mmm -129.98 155.72 45.64 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 89.9 p -128.53 173.67 10.04 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 167.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.463 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.8 t -150.8 161.68 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -177.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 84.0 t -136.31 128.85 45.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 171.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.7 p -150.38 131.62 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -177.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 57.8 -0.67 0.09 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.382 -175.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 115.61 -16.54 16.59 Favored Glycine 0 C--N 1.342 0.889 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -75.46 172.29 12.77 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -138.12 136.75 37.04 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 122.211 -0.306 . . . . 0.0 110.231 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -130.67 168.88 16.42 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.68 0.613 . . . . 0.0 112.142 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.3 tt0 -153.34 156.69 38.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.46 130.83 2.16 Favored Glycine 0 C--O 1.225 -0.408 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 77.2 p -102.96 169.87 8.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.151 0.5 . . . . 0.0 111.124 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -178.09 164.06 32.62 Favored Glycine 0 C--N 1.336 0.547 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -69.84 -12.04 61.32 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.375 0.879 . . . . 0.0 113.375 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -149.89 163.71 37.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.415 1.086 . . . . 0.0 108.519 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -67.68 -24.74 65.45 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -175.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -70.25 -39.97 74.71 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.22 0.464 . . . . 0.0 109.98 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -77.74 -39.42 44.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.614 0.766 . . . . 0.0 109.651 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.92 -43.3 98.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.176 0.59 . . . . 0.0 110.619 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -72.76 -34.21 66.84 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 117.804 0.275 . . . . 0.0 111.301 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.01 -23.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.674 0.216 . . . . 0.0 110.789 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -86.71 -49.8 7.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.623 0.249 . . . . 0.0 111.007 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.91 74.46 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 176.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.13 4.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -40.33 -39.82 1.04 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.8 m -70.86 -44.08 67.11 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.354 0.524 . . . . 0.0 110.055 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.18 -43.02 99.39 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.917 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -63.03 -52.9 61.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.04 -45.71 75.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 90.0 m -76.86 -36.74 56.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.3 t -88.29 -22.23 6.78 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 119.374 0.988 . . . . 0.0 110.326 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -101.07 -1.6 33.73 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.067 -179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 58.19 40.38 24.95 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.496 0.589 . . . . 0.0 111.964 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 84.8 mt -135.77 -175.07 3.84 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.61 0.764 . . . . 0.0 110.844 -175.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -138.69 18.25 2.69 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 19.0 tp 55.55 29.43 13.43 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.474 0.71 . . . . 0.0 112.026 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 56.8 tp -148.68 137.46 21.43 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.061 0.545 . . . . 0.0 109.858 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -145.27 1.53 0.96 Allowed 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 123.358 0.411 . . . . 0.0 111.0 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -65.18 161.03 20.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.012 0.434 . . . . 0.0 110.722 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -156.89 173.29 17.22 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.64 0.776 . . . . 0.0 110.794 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -146.85 169.98 17.98 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 121.234 0.54 . . . . 0.0 110.29 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 45.3 p-80 -146.89 8.47 0.97 Allowed 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.625 0.77 . . . . 0.0 110.536 178.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -152.97 173.39 15.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.488 0.715 . . . . 0.0 110.088 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.692 179.241 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 114.069 3.478 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 O4'-C1'-N19 111.342 3.142 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 100.244 -2.456 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.617 -3.083 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.568 0 O4'-C1'-N19 112.12 3.92 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.487 0 C4'-C3'-C2' 99.342 -3.358 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.633 0 C4'-C3'-C2' 99.03 -3.67 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 N19-C1'-C2' 108.769 -2.894 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.239 -3.461 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.366 -3.334 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 O4'-C1'-N19 111.26 3.06 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.224 0 C4'-C3'-C2' 99.144 -3.556 . 0.726 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 C4'-C3'-C2' 98.914 -3.786 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C4'-C3'-C2' 99.929 -2.771 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C4'-C3'-C2' 98.73 -3.97 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.812 -2.888 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.397 -3.303 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.236 0 C4'-C3'-C2' 98.703 -3.997 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.012 -3.688 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.094 0 C4'-C3'-C2' 99.118 -3.582 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.242 -3.458 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C4'-C3'-C2' 99.629 -3.071 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.465 1 O4'-C1'-N19 112.363 4.163 . 0.729 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C5'-C4'-C3' 110.377 -3.415 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C4'-C3'-C2' 99.27 -3.43 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.967 0 C4'-C3'-C2' 99.625 -3.075 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 99.163 -3.537 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C4'-C3'-C2' 99.199 -3.501 . 0.875 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C4'-C3'-C2' 99.51 -3.19 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 O4'-C1'-N19 111.474 3.274 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.445 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C4'-C3'-C2' 99.292 -3.408 . 0.707 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 99.686 -3.014 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C3'-C2'-C1' 104.347 3.163 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . 0.489 ' N2 ' ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.412 -3.45 1 C5'-C4'-C3' 108.769 -4.487 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.518 " O5'" ' C6 ' ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C3'-C2'-C1' 104.626 3.473 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.505 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.994 3 P-O3'-C3' 125.007 4.423 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.627 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.541 0 C4'-C3'-C2' 98.913 -3.787 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.627 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.403 -4.15 1 N19-C1'-C2' 121.602 5.126 . 0.2 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C4'-C3'-C2' 99.465 -3.235 . 0.412 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . 0.417 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.274 0 C4'-C3'-C2' 99.027 -3.673 . 0.773 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.614 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.414 -3.234 0 C4'-C3'-C2' 99.992 -2.708 . 0.538 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.523 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 C4'-C3'-C2' 99.395 -3.305 . 0.92 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 98.877 -3.823 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.175 -3.525 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.108 -3.592 . 0.897 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 C4'-C3'-C2' 99.415 -3.285 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.335 -3.365 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.012 0 C4'-C3'-C2' 99.996 -2.704 . 0.904 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.212 0 C4'-C3'-C2' 99.971 -2.729 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.321 1 O4'-C1'-N19 112.815 4.615 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-O4' 113.549 3.106 . 0.589 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 110.614 2.414 . 0.839 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C4'-C3'-C2' 99.307 -3.393 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 98.946 -3.754 . 0.851 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.432 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C4'-C3'-C2' 99.416 -3.284 . 0.539 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.222 0 O4'-C1'-N19 111.862 3.662 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C4'-C3'-C2' 99.213 -3.487 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 C4'-C3'-C2' 99.369 -3.331 . 0.646 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 100.217 -2.483 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.977 0 C4'-C3'-C2' 99.376 -3.324 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 C4'-C3'-C2' 99.431 -3.269 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 O4'-C1'-N19 111.699 3.499 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.898 2.698 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.141 0 C4'-C3'-C2' 100.093 -2.607 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.442 0 C4'-C3'-C2' 99.277 -3.423 . 0.634 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.163 0 C4'-C3'-C2' 99.187 -3.513 . 0.682 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.753 1 C4'-C3'-C2' 98.631 -4.069 . 0.784 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C4'-C3'-C2' 99.183 -3.517 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C4'-C3'-C2' 99.95 -2.75 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.512 1 C4'-C3'-C2' 97.965 -4.735 . 0.782 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.472 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.003 1 O4'-C1'-N19 112.297 4.097 . 0.816 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.474 0.352 0 N-CA-C 112.587 0.187 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.89 -176.53 42.48 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.24 -14.12 3.91 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.836 3.69 . . . . 0.0 114.062 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -76.07 -20.02 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.822 0.449 . . . . 0.0 110.915 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.69 63.61 4.06 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.763 0.825 . . . . 0.0 109.217 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.58 -26.1 44.21 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.765 2.977 . . . . 0.0 113.452 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -54.26 -28.09 39.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 119.664 -0.208 . . . . 0.0 111.245 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -56.55 -66.71 0.39 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 122.413 0.285 . . . . 0.0 110.55 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.4 -31.08 70.98 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.86 -48.68 35.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -174.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.0 mtt -68.39 -40.86 81.22 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 122.455 0.302 . . . . 0.0 111.519 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -58.85 -45.0 91.13 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 121.913 -0.492 . . . . 0.0 109.905 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.87 -43.02 98.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.37 -35.43 73.88 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 122.209 -0.307 . . . . 0.0 111.291 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -66.96 -56.63 9.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 119.637 -0.22 . . . . 0.0 111.167 175.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 66' ' ' LEU . 6.9 pt -63.88 -24.18 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.2 ttmt -44.89 104.15 0.37 Allowed Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 126.715 2.006 . . . . 0.0 114.437 -176.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.46 -8.57 10.51 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.121 2.547 . . . . 0.0 109.565 170.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.21 37.53 0.2 Allowed Glycine 0 CA--C 1.528 0.845 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -58.99 169.84 0.96 Allowed 'General case' 0 C--O 1.233 0.229 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -171.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.682 ' N ' HD22 ' A' ' 20' ' ' LEU . 10.2 mt-30 -132.45 135.69 46.22 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.29 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -104.82 135.52 46.04 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.26 143.96 46.58 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.672 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -104.33 142.74 34.02 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.758 0.823 . . . . 0.0 108.88 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.603 ' H ' HD22 ' A' ' 24' ' ' LEU . 65.0 mt -143.24 177.67 8.25 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 -171.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.542 ' CB ' HG22 ' A' ' 37' ' ' VAL . 23.1 t 48.83 -122.48 1.67 Allowed 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.193 0.52 . . . . 0.0 111.352 -168.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.454 ' NE2' ' CE1' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.78 81.79 0.15 Allowed 'General case' 0 N--CA 1.426 -1.627 0 C-N-CA 127.513 2.325 . . . . 0.0 109.027 -171.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 t -167.64 167.77 13.14 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 122.57 -169.7 15.11 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.41 162.76 7.51 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 C-N-CA 122.438 2.092 . . . . 0.0 111.192 172.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.5 HG11 " H1'" ' B' ' 287' ' ' ' U' . 40.9 t -85.48 2.41 4.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.424 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -132.41 -3.31 3.41 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.413 0.685 . . . . 0.0 110.769 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.19 59.05 11.84 Favored Pre-proline 0 N--CA 1.452 -0.351 0 C-N-CA 123.42 0.688 . . . . 0.0 109.704 170.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -72.74 147.15 44.33 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 124.527 3.485 . . . . 0.0 110.952 -177.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.84 120.3 40.99 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.487 0.661 . . . . 0.0 111.125 176.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.454 ' CE1' ' NE2' ' A' ' 27' ' ' GLN . 40.5 m-85 -114.71 135.87 53.69 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -120.13 113.86 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.648 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.243 174.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.672 ' HG2' HD23 ' A' ' 24' ' ' LEU . 30.3 mtp -100.55 135.08 42.54 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.7 p -127.89 135.26 49.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.518 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.1 p -115.22 142.02 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.568 -172.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -125.49 122.98 38.18 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.277 0.361 . . . . 0.0 110.235 -170.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.602 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.6 t -134.87 131.0 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.3 t30 53.39 1.57 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 116.31 0.77 20.51 Favored Glycine 0 C--N 1.341 0.854 0 O-C-N 120.767 -1.208 . . . . 0.0 111.313 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -101.98 126.43 48.9 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.2 t -117.38 135.69 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -176.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 56.7 m-85 -134.5 131.94 38.62 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.646 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -112.17 137.62 50.0 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.418 0.449 . . . . 0.0 111.604 -168.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.37 135.71 8.73 Favored Glycine 0 C--N 1.337 0.592 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.456 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.2 p -115.03 105.78 13.36 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.926 1.29 . . . . 0.0 110.799 -170.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.76 159.19 26.85 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 113.521 0.168 . . . . 0.0 113.521 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -73.69 135.24 21.43 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 122.963 2.442 . . . . 0.0 106.792 168.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.0 m 64.17 151.78 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 122.088 0.946 . . . . 0.0 110.86 -172.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.24 -30.53 71.42 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -170.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -55.68 -66.23 0.46 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.262 0.483 . . . . 0.0 112.048 -170.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.17 -37.54 69.69 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.281 1.032 . . . . 0.0 111.908 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.35 -62.91 1.44 Allowed 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.109 -0.37 . . . . 0.0 110.981 177.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.628 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 tttm -56.31 -38.4 71.22 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 177.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.92 -63.3 1.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.239 0.542 . . . . 0.0 111.265 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.507 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 12.4 t-160 -57.57 -40.51 79.15 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.01 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.87 -50.32 70.94 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.464 0.173 . . . . 0.0 110.816 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -46.3 78.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.337 0.655 . . . . 0.0 110.776 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.74 -57.02 13.76 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.753 0.421 . . . . 0.0 111.058 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.507 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 99.2 mttt -56.27 -49.95 72.77 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.459 0.171 . . . . 0.0 110.998 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.45 73.31 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.546 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 16' ' ' ILE . 34.4 tp -56.92 -53.14 61.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -55.52 -38.33 69.08 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 117.585 0.175 . . . . 0.0 111.327 -174.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.1 t -79.08 -53.07 7.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.734 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 14.7 t80 -57.3 -28.36 62.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -174.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.4 m -55.58 -14.64 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-N 119.344 0.975 . . . . 0.0 112.29 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -95.68 -11.82 26.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.761 0.71 . . . . 0.0 111.068 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.408 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 22.5 m-85 -146.38 50.69 1.05 Allowed Pre-proline 0 CA--C 1.532 0.27 0 O-C-N 121.727 -0.608 . . . . 0.0 112.236 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.734 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 79.0 Cg_endo -70.63 -24.77 25.33 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 124.329 3.352 . . . . 0.0 113.032 -176.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -161.01 11.38 0.09 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.454 0.57 . . . . 0.0 112.136 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -149.19 170.72 17.81 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.935 0.494 . . . . 0.0 111.078 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -140.51 23.77 2.3 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.222 1.009 . . . . 0.0 109.977 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -121.79 17.67 11.06 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.165 0.986 . . . . 0.0 110.5 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.64 -3.48 3.23 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.011 0.524 . . . . 0.0 112.29 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -69.86 7.99 0.8 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.892 0.877 . . . . 0.0 111.451 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.8 tp -131.57 14.46 4.95 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.542 1.137 . . . . 0.0 109.328 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.21 -178.61 5.93 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.915 0.886 . . . . 0.0 110.073 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -147.86 171.61 15.46 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 121.201 0.524 . . . . 0.0 110.74 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 177.9 -175.35 47.47 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -150.92 172.41 15.71 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 123.066 0.547 . . . . 0.0 110.453 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.5 t -148.05 176.79 9.9 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.885 0.874 . . . . 0.0 108.99 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -117.27 166.81 11.84 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.354 0.662 . . . . 0.0 110.373 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.1 t -151.83 -179.68 7.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.4 m -138.78 169.19 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.993 0.425 . . . . 0.0 111.218 -175.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.16 -174.47 4.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.271 1.028 . . . . 0.0 108.779 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.4 p -128.87 169.13 14.97 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.757 0.423 . . . . 0.0 110.026 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.71 166.41 32.26 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -151.97 174.96 13.01 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.33 0.652 . . . . 0.0 110.723 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -148.97 -176.85 5.5 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.631 0.772 . . . . 0.0 109.658 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.7 p -140.54 169.86 16.87 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.354 0.662 . . . . 0.0 110.332 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -153.22 168.25 26.62 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -148.49 149.73 32.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -158.22 -178.24 7.15 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.509 0.724 . . . . 0.0 109.55 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -150.46 149.06 29.5 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 122.93 0.492 . . . . 0.0 110.202 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.461 ' CD1' ' HD2' ' A' ' 100' ' ' PRO . 57.2 t80 -154.29 144.8 15.92 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.676 0.791 . . . . 0.0 109.425 -179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.461 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 67.3 Cg_endo -69.62 171.83 13.61 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.775 2.316 . . . . 0.0 111.74 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -150.28 168.51 23.85 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.138 0.575 . . . . 0.0 110.302 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 69.1 p -66.7 -5.44 11.86 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.268 0.627 . . . . 0.0 112.36 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.5 tp -152.15 147.54 26.56 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.437 0.695 . . . . 0.0 109.318 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -154.83 15.12 0.42 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.904 0.482 . . . . 0.0 110.811 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 50.46 33.33 7.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.965 0.506 . . . . 0.0 111.22 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -140.39 -174.66 14.01 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -145.3 179.9 7.08 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 122.779 0.431 . . . . 0.0 110.849 -173.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -149.09 161.75 41.32 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.8 m -138.76 73.02 41.23 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 123.6 0.76 . . . . 0.0 109.645 -177.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.72 9.55 1.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 124.903 3.735 . . . . 0.0 113.127 -173.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -140.05 163.63 32.18 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.423 0.556 . . . . 0.0 111.499 -178.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -72.51 1.39 8.17 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -177.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.8 m -59.41 163.81 3.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.449 0.7 . . . . 0.0 111.509 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.27 136.03 91.36 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -50.63 150.64 11.75 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.309 2.673 . . . . 0.0 112.976 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.38 3.27 6.45 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.255 3.303 . . . . 0.0 112.356 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -65.6 146.25 55.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 122.149 -0.345 . . . . 0.0 111.327 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -150.81 -174.11 4.68 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.966 0.907 . . . . 0.0 109.844 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -57.36 172.6 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 123.592 0.757 . . . . 0.0 112.263 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -151.35 -165.11 12.63 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -177.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 30.2 m -131.93 18.82 4.59 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.06 0.544 . . . . 0.0 112.146 -175.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 50.1 28.61 3.1 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.875 0.87 . . . . 0.0 112.21 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -156.59 29.36 0.56 Allowed Glycine 0 CA--C 1.53 0.998 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -142.65 165.24 27.92 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.76 0.824 . . . . 0.0 110.095 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.91 168.87 25.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.05 0.452 . . . . 0.0 110.582 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.8 p -157.24 -176.32 5.9 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.059 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -139.36 168.78 19.05 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.269 0.628 . . . . 0.0 109.564 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.3 p -149.12 8.92 0.74 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 26.8 t -64.84 -19.48 65.89 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.004 -0.435 . . . . 0.0 111.381 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 78.7 p -160.98 167.19 27.01 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.545 0.738 . . . . 0.0 109.808 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.12 -166.84 37.18 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -61.23 171.25 1.4 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.362 0.601 . . . . 0.0 110.652 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 9.9 p -134.56 13.7 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.064 0.546 . . . . 0.0 111.622 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.9 t -139.61 163.99 31.11 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.101 0.56 . . . . 0.0 110.295 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 tp -151.63 12.77 0.62 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.323 0.649 . . . . 0.0 110.213 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 34.6 m -61.86 162.17 9.31 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.117 0.567 . . . . 0.0 111.45 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.83 -177.72 6.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.255 0.622 . . . . 0.0 109.815 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 t -150.95 145.52 18.26 Favored Pre-proline 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 109.591 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.54 -5.12 15.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 123.555 2.837 . . . . 0.0 112.478 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.8 m -146.04 159.67 45.57 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 122.96 0.504 . . . . 0.0 110.238 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.96 -11.4 3.63 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.996 3.131 . . . . 0.0 114.23 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.95 -178.14 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.57 1.148 . . . . 0.0 112.912 -175.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 78.5 p -143.36 6.62 1.5 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 32.9 tp -65.43 -9.23 23.69 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.903 0.481 . . . . 0.0 111.742 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 46.1 p -100.21 0.44 40.39 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.4 1.08 . . . . 0.0 111.096 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.481 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 28.1 pt20 -152.19 36.08 0.09 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.527 0.731 . . . . 0.0 112.793 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.481 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 90.9 Cg_endo -72.73 168.17 25.25 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.447 2.098 . . . . 0.0 109.895 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.15 140.37 49.19 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.263 1.975 . . . . 0.0 109.294 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 81.6 mt -147.82 158.28 42.74 Favored Pre-proline 0 N--CA 1.456 -0.147 0 C-N-CA 123.422 0.689 . . . . 0.0 110.511 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -71.57 174.21 11.33 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.535 2.823 . . . . 0.0 110.179 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 28.9 pt -141.91 157.98 63.15 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.642 0.777 . . . . 0.0 109.32 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 169.35 16.29 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.04 2.494 . . . . 0.0 111.07 177.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.95 161.46 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 124.629 3.552 . . . . 0.0 112.984 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.8 -0.08 6.43 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 123.56 2.84 . . . . 0.0 112.338 -178.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -141.64 144.81 34.66 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.28 150.12 34.32 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.497 2.798 . . . . 0.0 112.803 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.54 152.15 16.94 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 124.054 3.169 . . . . 0.0 112.66 175.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -75.18 1.24 8.04 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.787 2.991 . . . . 0.0 112.404 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.1 p -145.62 19.14 1.5 Allowed 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 123.363 0.665 . . . . 0.0 110.297 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -157.67 37.67 0.54 Allowed Glycine 0 C--N 1.335 0.508 0 N-CA-C 110.409 -1.076 . . . . 0.0 110.409 -175.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -54.38 -23.42 15.55 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.35 0.66 . . . . 0.0 112.21 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -148.27 151.03 36.18 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.194 0.598 . . . . 0.0 110.092 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.421 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 81.0 Cg_endo -75.18 -15.27 20.44 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.744 2.963 . . . . 0.0 110.806 178.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.81 -40.06 87.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.308 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 42.4 ttm -81.75 -48.21 11.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.53 0.605 . . . . 0.0 111.852 -175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 5.5 pt -55.96 -41.99 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.066 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.786 179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.65 -48.41 77.36 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -72.78 12.79 0.45 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -136.87 -0.17 2.34 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.977 0.808 . . . . 0.0 110.867 174.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -115.37 -25.64 7.89 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.627 0.371 . . . . 0.0 110.169 174.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -159.86 57.84 1.05 Allowed Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 122.689 0.396 . . . . 0.0 110.263 -179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.3 12.71 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 124.435 3.424 . . . . 0.0 113.736 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . -86.97 52.61 4.42 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.39 -175.24 3.74 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 117.79 0.795 . . . . 0.0 111.865 -174.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 37.4 mtmt -140.29 153.09 46.35 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 29.5 m-85 -129.26 155.7 45.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.0 0.429 . . . . 0.0 110.04 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.93 162.6 34.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.881 172.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -121.11 144.08 48.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -127.29 153.13 46.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.809 0.814 . . . . 0.0 109.778 -174.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 87.7 p -54.16 177.58 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 -167.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -121.88 168.71 11.56 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.936 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 24.4 m -151.95 31.45 0.56 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -170.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -153.89 169.14 32.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 119.269 0.941 . . . . 0.0 113.995 -178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -73.65 165.56 24.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.33 0.652 . . . . 0.0 111.127 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 21.9 m -60.1 -2.01 0.38 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -124.14 6.86 8.52 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 119.255 0.934 . . . . 0.0 111.463 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -149.53 17.3 0.91 Allowed 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -60.7 155.51 18.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.053 1.341 . . . . 0.0 112.802 -173.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 77.3 p -151.69 159.47 43.98 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 123.932 0.893 . . . . 0.0 110.062 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -146.35 173.14 12.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.57 160.81 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 122.141 0.972 . . . . 0.0 111.802 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.4 mmm -130.48 156.06 45.41 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.0 p -129.74 171.26 12.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.995 167.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.51 166.02 3.37 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 74.5 t -138.8 127.44 29.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 198' ' ' GLY . 24.8 t -145.07 127.02 9.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -173.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.2 t70 55.32 3.16 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 117.98 -16.69 12.01 Favored Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -73.51 174.52 8.12 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.229 1.012 . . . . 0.0 109.609 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -140.29 136.08 32.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -131.34 172.21 12.44 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.3 tt0 -157.91 158.31 34.79 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 135.35 3.45 Favored Glycine 0 C--N 1.339 0.732 0 N-CA-C 111.697 -0.561 . . . . 0.0 111.697 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 81.9 p -107.0 172.12 6.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.644 0.377 . . . . 0.0 111.173 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -179.34 171.11 42.93 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 110.794 -0.922 . . . . 0.0 110.794 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.5 ptm85 -75.3 -11.5 60.07 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -150.28 163.1 39.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.311 0.645 . . . . 0.0 109.366 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.8 -30.48 71.51 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -68.65 -45.08 72.73 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.505 -0.747 . . . . 0.0 110.951 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.52 -37.84 74.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.689 0.796 . . . . 0.0 109.412 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.07 95.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.476 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -66.79 -28.16 68.16 Favored 'General case' 0 C--O 1.221 -0.403 0 O-C-N 122.005 -0.434 . . . . 0.0 110.714 177.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -68.69 -29.44 67.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.04 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -78.15 -49.67 13.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.654 1.115 . . . . 0.0 110.141 174.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.31 78.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.501 0.5 . . . . 0.0 111.221 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.57 3.8 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 118.823 -0.608 . . . . 0.0 109.868 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -41.4 -42.09 2.18 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 172.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 48.9 m -67.66 -45.42 75.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.369 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.406 ' HB1' HG21 ' A' ' 196' ' ' VAL . . . -62.58 -41.05 98.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 123.527 0.517 . . . . 0.0 110.782 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.434 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -63.48 -52.77 59.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.74 -50.96 64.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 84.1 m -75.2 -37.8 61.03 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -176.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 51.3 t -83.63 -20.28 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 118.76 0.709 . . . . 0.0 110.997 -174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 170' ' ' LEU . 2.0 m-30 -107.37 6.64 28.54 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.963 -177.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.62 32.17 21.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.008 0.923 . . . . 0.0 113.01 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.5 -171.28 2.51 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.436 0.694 . . . . 0.0 110.44 -175.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -142.76 21.32 1.98 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.521 0.2 . . . . 0.0 111.025 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 20.3 tp 63.59 11.82 6.01 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.534 1.134 . . . . 0.0 112.042 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.44 ' C ' HD12 ' A' ' 229' ' ' LEU . 3.1 pp -148.42 177.68 9.24 Favored 'General case' 0 C--N 1.342 0.267 0 O-C-N 121.586 -0.696 . . . . 0.0 110.987 176.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -149.34 177.6 9.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.412 0.685 . . . . 0.0 110.35 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -143.28 6.57 1.52 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.672 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -82.36 -14.65 54.93 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 119.58 -0.247 . . . . 0.0 111.238 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 44.32 25.65 0.13 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.458 1.103 . . . . 0.0 113.971 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -73.7 6.98 2.73 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.528 0.731 . . . . 0.0 112.155 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -139.25 16.55 2.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.866 -0.521 . . . . 0.0 110.898 -177.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.844 -177.295 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.85 0 C4'-C3'-C2' 98.79 -3.91 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.694 0 C4'-C3'-C2' 99.091 -3.609 . 0.701 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.373 -3.327 . 0.775 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 0 C4'-C3'-C2' 99.52 -3.18 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 O4'-C1'-N19 112.155 3.955 . 0.732 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.039 -3.661 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 98.803 -3.897 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.751 0 C4'-C3'-C2' 99.726 -2.974 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C4'-C3'-C2' 99.606 -3.094 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C4'-C3'-C2' 99.329 -3.371 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.877 3.677 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.747 3.547 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.742 0 C4'-C3'-C2' 99.41 -3.29 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.132 -3.568 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 99.099 -3.601 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.014 -3.686 . 0.768 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 0 C4'-C3'-C2' 99.242 -3.458 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C4'-C3'-C2' 99.123 -3.577 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.208 0 C4'-C3'-C2' 99.399 -3.301 . 0.759 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.449 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C4'-C3'-C2' 99.655 -3.045 . 0.834 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.449 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C4'-C3'-C2' 98.854 -3.846 . 0.876 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 2.207 1 O4'-C1'-N19 113.437 5.237 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.715 0 O4'-C1'-N19 111.548 3.348 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 1 C4'-C3'-C2' 98.697 -4.003 . 0.803 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C4'-C3'-C2' 98.34 -4.36 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C4'-C3'-C2' 99.499 -3.201 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.492 0 C4'-C3'-C2' 99.265 -3.435 . 0.93 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.831 -2.869 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.417 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.375 -3.325 . 0.701 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.483 ' H3 ' ' H22' ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.611 -3.089 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . 0.482 " H2'" ' C6 ' ' B' ' 269' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.032 0 C4'-C3'-C2' 99.352 -3.348 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . 0.482 ' C6 ' " H2'" ' B' ' 268' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.948 1 C4'-C3'-C2' 98.172 -4.528 . 0.728 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.508 1 C5'-C4'-C3' 107.776 -5.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.54 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -3.038 1 P-O3'-C3' 125.131 4.526 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.54 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.411 -3.476 0 C3'-C2'-C1' 105.081 3.979 OUTLIER-DELTA 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.458 H5'' " H3'" ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.333 1 C4'-C3'-C2' 98.104 -4.596 . 0.0 OUTLIER beta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.437 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.118 0 C4'-C3'-C2' 99.432 -3.268 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 C4'-C3'-C2' 99.277 -3.423 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 98.747 -3.953 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.628 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.412 -3.432 1 C4'-C3'-C2' 98.599 -4.101 . 0.626 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.488 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.089 2.889 . 0.873 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.202 1 C4'-C3'-C2' 98.095 -4.605 . 0.814 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C4'-C3'-C2' 99.949 -2.751 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 0 C4'-C3'-C2' 99.334 -3.366 . 0.878 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.075 0 C4'-C3'-C2' 99.362 -3.338 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.022 0 C4'-C3'-C2' 99.635 -3.065 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.404 -3.296 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.153 0 C4'-C3'-C2' 100.201 -2.499 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.938 1 O4'-C1'-N19 112.553 4.353 . 0.557 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.5 " H1'" HG11 ' A' ' 31' ' ' VAL . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.32 3.12 . 0.519 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.433 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C5'-C4'-C3' 111.311 -2.793 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.528 -3.172 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.926 0 O4'-C1'-N19 111.478 3.278 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 C4'-C3'-C2' 99.368 -3.332 . 0.436 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-O4' 113.033 2.738 . 0.621 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 99.05 -3.65 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O4'-C1'-N19 111.713 3.513 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 O4'-C1'-N19 111.477 3.277 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.372 0 C4'-C3'-C2' 99.0 -3.7 . 0.793 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.467 0 C4'-C3'-C2' 99.53 -3.17 . 0.665 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.131 1 O4'-C1'-N19 112.465 4.265 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 O4'-C1'-N19 111.774 3.574 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 99.808 -2.892 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.563 -3.137 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C4'-C3'-C2' 99.228 -3.472 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 C4'-C3'-C2' 98.797 -3.903 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.464 4.264 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C4'-C3'-C2' 99.415 -3.285 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.437 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 98.727 -3.973 . 0.754 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.437 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.821 3.621 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 N--CA 1.473 0.271 0 CA-C-O 120.462 0.109 . . . . 0.0 111.878 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 173.34 43.43 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -75.68 -179.74 5.43 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.95 3.767 . . . . 0.0 111.088 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.8 t -138.91 151.9 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 124.034 0.934 . . . . 0.0 108.89 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' N ' ' A' ' 5' ' ' LEU . 1.3 pt? -153.03 153.63 29.95 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 122.734 0.413 . . . . 0.0 110.903 -177.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.6 -12.66 29.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.419 2.746 . . . . 0.0 113.145 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -53.78 -28.95 37.97 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.364 -0.835 . . . . 0.0 109.902 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -55.49 -64.72 0.76 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.541 0.337 . . . . 0.0 111.01 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.0 69.78 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 117.901 0.319 . . . . 0.0 111.694 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 mp -67.63 -57.04 7.11 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -45.08 94.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.087 0.555 . . . . 0.0 111.439 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -55.77 -50.66 69.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.25 -45.81 83.62 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 117.538 0.154 . . . . 0.0 111.001 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -55.63 -38.2 69.21 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.282 0.563 . . . . 0.0 111.355 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -70.97 -53.39 15.06 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.462 HD13 HD13 ' A' ' 66' ' ' LEU . 7.4 pt -65.53 -41.32 90.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HD2' ' CD1' ' A' ' 20' ' ' LEU . 33.4 pttt -63.9 145.5 97.71 Favored Pre-proline 0 N--CA 1.453 -0.296 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -91.98 -20.58 0.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.649 2.899 . . . . 0.0 111.999 172.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.85 47.15 0.01 OUTLIER Glycine 0 CA--C 1.527 0.794 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -57.41 -179.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 30.7 mt-30 -135.5 135.3 40.33 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -105.63 137.36 43.62 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 172.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.7 ptp -135.61 143.32 45.52 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.683 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.0 tm? -105.0 139.15 40.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.61 0.764 . . . . 0.0 109.946 -173.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.526 ' H ' HD22 ' A' ' 24' ' ' LEU . 74.2 mt -139.95 177.99 7.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -171.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.554 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.9 t 48.82 -117.86 0.99 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.56 0.695 . . . . 0.0 111.233 -167.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.461 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER 66.02 81.94 0.19 Allowed 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.615 1.966 . . . . 0.0 110.457 -173.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 t -164.23 158.05 18.53 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.166 -1.379 . . . . 0.0 107.292 176.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.74 -171.01 34.8 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -73.45 5.75 3.08 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.342 3.361 . . . . 0.0 113.123 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.8 t 75.87 3.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 124.536 1.135 . . . . 0.0 112.231 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -132.3 -7.91 3.36 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 110.443 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -137.65 60.5 25.57 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 124.009 0.924 . . . . 0.0 108.581 168.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.32 145.71 38.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 124.82 3.68 . . . . 0.0 110.221 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -112.47 120.78 42.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.635 0.731 . . . . 0.0 111.228 176.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 45.4 m-85 -113.12 137.07 51.99 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.554 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.07 115.54 46.0 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.874 174.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.683 ' HG2' HD23 ' A' ' 24' ' ' LEU . 23.0 mtp -101.6 134.08 45.28 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 24.6 p -122.26 135.2 54.71 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.519 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.5 p -115.89 138.7 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.355 -172.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -124.37 125.86 45.01 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 123.884 0.74 . . . . 0.0 110.61 -171.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 ' CE2' ' A' ' 69' ' ' PHE . 44.7 t -134.86 127.8 49.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 C-N-CA 123.875 0.87 . . . . 0.0 108.684 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 51.36 9.95 0.08 Allowed 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 113.99 0.57 24.1 Favored Glycine 0 C--N 1.338 0.691 0 O-C-N 121.593 -0.692 . . . . 0.0 112.07 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -104.69 133.96 48.65 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.0 t -127.31 136.1 61.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -175.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 39' ' ' SER . 67.4 m-85 -134.21 135.15 42.79 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -112.62 135.49 53.29 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.827 0.705 . . . . 0.0 110.706 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -128.32 135.22 8.48 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.529 -1.029 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 88.3 p -113.95 106.98 15.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.307 1.043 . . . . 0.0 111.625 -170.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.01 159.56 27.01 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 116.355 -0.384 . . . . 0.0 112.399 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.65 135.12 25.44 Favored 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 122.698 2.266 . . . . 0.0 107.114 168.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m 61.38 153.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.908 0.861 . . . . 0.0 111.614 -171.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -70.73 -23.06 62.37 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -55.55 -72.82 0.06 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.757 0.708 . . . . 0.0 111.517 -173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.59 -33.98 66.73 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.939 0.896 . . . . 0.0 112.22 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.43 -61.43 2.5 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.758 -0.589 . . . . 0.0 111.552 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.645 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 3.3 pttm -61.35 -32.96 72.86 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -177.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.8 tm? -56.28 -61.03 2.68 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.903 0.881 . . . . 0.0 110.266 177.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.511 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 6.2 t-160 -58.13 -42.77 86.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.97 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -49.59 73.17 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.918 176.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.38 -44.74 80.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.996 0.518 . . . . 0.0 111.483 177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.67 -57.32 12.46 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 121.967 -0.458 . . . . 0.0 110.195 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 68.7 mttm -56.29 -47.26 78.99 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.838 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.52 -41.17 80.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.392 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 16' ' ' ILE . 17.0 tp -56.95 -50.81 71.49 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.963 0.801 . . . . 0.0 109.498 172.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.1 mmm-85 -55.18 -40.56 70.84 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 122.119 0.168 . . . . 0.0 110.673 -176.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 47' ' ' PHE . 33.0 t -75.55 -50.86 14.35 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 177.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.774 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 10.4 t80 -58.24 -33.07 68.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.881 1.272 . . . . 0.0 113.241 -172.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.6 m -56.23 -14.52 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 119.576 1.08 . . . . 0.0 113.007 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -98.23 -15.31 19.9 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 122.852 0.461 . . . . 0.0 111.41 178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -145.15 58.76 5.42 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.724 0.41 . . . . 0.0 111.32 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.774 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 86.8 Cg_endo -70.55 -9.02 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.235 1 C-N-CA 125.502 4.135 . . . . 0.0 112.514 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -154.07 171.47 19.05 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 122.929 0.492 . . . . 0.0 110.558 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.37 19.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.147 0.979 . . . . 0.0 112.217 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.8 p -140.07 -179.51 6.01 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.491 0.717 . . . . 0.0 111.14 -174.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.18 153.63 11.55 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.155 0.582 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.43 179.04 8.92 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.939 0.896 . . . . 0.0 110.409 -178.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -142.75 168.72 19.06 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 122.456 0.302 . . . . 0.0 110.418 -176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' C ' ' H ' ' A' ' 82' ' ' MET . 19.3 tp -147.8 23.62 1.1 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.939 0.496 . . . . 0.0 110.896 -177.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.42 15.3 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.071 0.948 . . . . 0.0 112.658 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . 0.426 ' H ' ' C ' ' A' ' 80' ' ' LEU . 3.3 ppp? -138.83 12.56 2.68 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.538 0.735 . . . . 0.0 111.299 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -117.86 174.59 15.33 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.434 ' HG2' ' H ' ' A' ' 85' ' ' THR . 59.0 ttp85 -157.65 177.87 10.91 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.434 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 10.1 t -144.45 167.25 22.95 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 121.37 0.605 . . . . 0.0 110.287 177.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 pp -152.51 180.0 8.08 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.576 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.8 t -152.07 166.76 30.63 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 122.985 0.514 . . . . 0.0 110.496 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.9 m -145.75 -176.07 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.108 0 C-N-CA 123.749 0.82 . . . . 0.0 109.272 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -142.02 167.79 21.28 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 122.849 0.46 . . . . 0.0 111.184 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.7 p -142.31 6.34 1.7 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.565 0.746 . . . . 0.0 111.044 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -151.14 149.31 29.32 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.55 0.74 . . . . 0.0 109.206 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -160.37 174.38 14.23 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 59.8 p -77.42 12.78 1.41 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.964 0.905 . . . . 0.0 112.367 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 37.5 t -57.97 164.59 2.18 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.61 0.764 . . . . 0.0 111.408 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -142.66 4.79 1.54 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.693 0.797 . . . . 0.0 111.37 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.47 -1.43 6.57 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.392 0.677 . . . . 0.0 111.017 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.53 9.7 1.0 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.938 0.895 . . . . 0.0 113.342 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 55.0 -166.89 0.09 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.073 0.949 . . . . 0.0 112.09 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -139.63 155.5 71.57 Favored Pre-proline 0 C--N 1.341 0.2 0 C-N-CA 123.419 0.688 . . . . 0.0 109.891 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -70.36 173.39 11.57 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 124.257 3.305 . . . . 0.0 111.632 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.23 174.39 12.44 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.085 0.554 . . . . 0.0 110.701 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 75.9 p -142.62 15.36 1.98 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.629 0.772 . . . . 0.0 111.225 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 49.0 tp -57.71 151.29 17.77 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.89 0.376 . . . . 0.0 110.968 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -151.73 164.52 36.8 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.543 0.737 . . . . 0.0 109.686 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 48.6 p30 -154.95 179.06 9.49 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 122.828 0.451 . . . . 0.0 110.729 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -176.59 -170.67 39.44 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -142.64 169.37 17.7 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.144 0.497 . . . . 0.0 111.445 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -152.88 165.68 34.69 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 58.2 p -57.03 154.56 19.04 Favored Pre-proline 0 C--O 1.233 0.227 0 O-C-N 121.75 -0.594 . . . . 0.0 110.599 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.89 162.43 2.59 Favored 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 123.572 2.848 . . . . 0.0 113.319 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -150.88 158.42 44.12 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.713 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -146.3 -176.09 5.03 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.687 0.795 . . . . 0.0 109.946 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.1 m -137.76 23.59 2.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.141 0.576 . . . . 0.0 111.607 -176.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.54 153.67 28.21 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.437 0.295 . . . . 0.0 110.648 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.49 163.35 38.39 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.538 2.825 . . . . 0.0 111.423 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.06 120.38 4.19 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.815 3.677 . . . . 0.0 112.941 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -156.03 8.79 0.24 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.997 0.519 . . . . 0.0 110.8 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -151.62 175.27 12.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.351 1.06 . . . . 0.0 109.632 -176.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.1 m -141.77 172.35 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 C-N-CA 123.538 0.735 . . . . 0.0 109.548 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -168.97 -13.46 0.02 OUTLIER Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -72.1 0.08 10.49 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.461 0.63 . . . . 0.0 111.586 174.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -152.41 166.83 30.7 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.176 0.59 . . . . 0.0 110.275 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.22 -2.03 0.03 OUTLIER Glycine 0 CA--C 1.525 0.695 0 C-N-CA 123.7 0.666 . . . . 0.0 112.264 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -72.17 -3.88 25.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 117.412 0.606 . . . . 0.0 112.034 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -60.93 140.12 57.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 118.274 0.488 . . . . 0.0 109.693 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.0 p -91.68 -3.3 56.45 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.088 0.555 . . . . 0.0 110.906 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 49.45 27.56 2.07 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.111 0.965 . . . . 0.0 112.111 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.8 m 50.34 25.07 1.71 Allowed 'General case' 0 C--N 1.342 0.271 0 C-N-CA 124.286 1.035 . . . . 0.0 112.012 -177.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.8 m -139.36 8.65 2.44 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.642 0.777 . . . . 0.0 111.923 -178.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 86.1 p 44.37 30.28 0.46 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.666 1.186 . . . . 0.0 112.829 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -166.18 -168.05 27.76 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.72 163.57 32.53 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 122.685 0.394 . . . . 0.0 110.229 -176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.52 169.54 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 123.541 0.736 . . . . 0.0 111.754 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 86.8 p -151.59 22.4 0.71 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.976 0.911 . . . . 0.0 109.675 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.9 tp -131.37 5.91 4.44 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.424 0.69 . . . . 0.0 110.54 -173.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.7 p -151.46 163.02 39.93 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.411 0.684 . . . . 0.0 110.629 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -154.44 168.7 25.79 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.477 0.311 . . . . 0.0 110.902 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 69.3 m -145.17 163.66 31.27 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.213 0.605 . . . . 0.0 109.993 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -50.53 160.27 1.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 124.38 3.386 . . . . 0.0 113.401 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.508 ' N ' ' HD3' ' A' ' 141' ' ' PRO . 27.5 m -138.45 38.08 0.33 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.508 ' HD3' ' N ' ' A' ' 140' ' ' VAL . 71.3 Cg_exo -48.17 162.54 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.753 2.302 . . . . 0.0 112.559 173.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.18 2.38 1.69 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.435 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 17.3 t -155.22 -175.22 5.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 177.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 26.4 tp -155.93 169.68 23.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.464 0.706 . . . . 0.0 109.934 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 3.0 m 52.97 35.15 18.55 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.956 0.902 . . . . 0.0 112.18 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -145.39 158.12 51.5 Favored Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 122.089 -0.382 . . . . 0.0 110.337 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.67 164.46 35.36 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.171 2.581 . . . . 0.0 109.902 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.11 179.18 5.15 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 124.013 3.142 . . . . 0.0 110.676 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 23.2 tp -145.39 136.6 12.59 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -51.52 155.75 6.99 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 123.409 2.74 . . . . 0.0 112.666 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 10.1 tp -64.81 140.47 98.07 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.851 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -54.12 166.71 1.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.4 2.734 . . . . 0.0 111.108 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.53 156.1 54.28 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.394 2.063 . . . . 0.0 110.672 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.83 -176.99 1.69 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.547 2.831 . . . . 0.0 111.735 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -129.44 153.8 80.65 Favored Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 109.689 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.49 135.34 47.56 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.767 . . . . 0.0 111.598 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 159' ' ' SER . 89.3 Cg_endo -76.27 174.0 13.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.795 2.997 . . . . 0.0 109.64 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.48 7.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.464 1 C-N-CA 125.485 4.124 . . . . 0.0 114.331 172.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 157' ' ' PRO . 86.1 p -147.54 -175.94 5.05 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.582 0.753 . . . . 0.0 109.502 -177.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -166.65 169.2 40.55 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.024 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.2 mtmm -142.6 16.57 2.0 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.808 0.443 . . . . 0.0 110.828 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 43.6 t30 46.79 81.7 0.25 Allowed Pre-proline 0 C--O 1.234 0.28 0 C-N-CA 124.384 1.073 . . . . 0.0 111.356 -175.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.481 ' HB3' HD21 ' A' ' 228' ' ' LEU . 88.8 Cg_endo -79.7 -13.23 13.29 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.766 3.644 . . . . 0.0 110.455 -169.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 75.9 t -67.53 -40.98 85.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.346 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 98.8 mmm -79.26 -45.78 19.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.556 0.217 . . . . 0.0 110.678 -174.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.429 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 9.0 pt -58.42 -38.88 72.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.515 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.407 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -64.82 -54.73 26.5 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 175.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -71.02 12.39 0.29 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.108 0.963 . . . . 0.0 113.094 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -139.38 -5.43 1.41 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.156 0.889 . . . . 0.0 111.64 177.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -102.91 -33.57 9.27 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.248 0.931 . . . . 0.0 109.652 174.364 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 61.61 3.35 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.95 -174.93 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 123.859 3.039 . . . . 0.0 110.403 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.94 36.03 4.35 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 119.345 0.975 . . . . 0.0 111.862 -173.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.02 -175.68 3.42 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 118.067 0.933 . . . . 0.0 110.076 -176.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.422 ' HE3' ' HB2' ' A' ' 175' ' ' LYS . 39.1 mtmt -141.0 151.17 43.91 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.448 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.0 m-85 -128.93 153.59 47.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -136.53 161.99 34.35 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.0 174.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -117.82 141.97 47.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -127.01 159.13 35.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.794 0.807 . . . . 0.0 110.15 -175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.4 m -46.29 169.78 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.136 2.574 . . . . 0.0 115.868 -167.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.4 168.49 18.5 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.633 -175.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 88.6 p -162.86 164.92 25.8 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.826 0.85 . . . . 0.0 110.01 177.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 119.48 -156.1 15.89 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.614 -0.594 . . . . 0.0 111.614 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.08 172.1 11.73 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.969 1.308 . . . . 0.0 108.816 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.2 m -60.45 -8.12 2.52 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -175.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -125.58 11.17 7.91 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.896 0.478 . . . . 0.0 111.11 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -152.14 16.68 0.65 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.436 0.295 . . . . 0.0 110.542 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -57.87 153.37 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.171 0.988 . . . . 0.0 111.106 -177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 71.7 m -149.36 156.37 41.95 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 123.549 0.739 . . . . 0.0 109.46 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -145.12 173.32 12.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -149.54 159.24 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 119.56 1.073 . . . . 0.0 112.432 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 90.9 mmm -130.39 159.55 36.68 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.6 p -132.49 172.76 12.07 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 167.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.448 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.9 t -148.08 163.48 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 93.3 t -136.6 126.33 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 171.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.4 t -143.89 126.98 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -173.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 33.3 t70 54.81 5.83 0.1 Allowed 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 113.25 -19.14 20.41 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -73.45 172.9 10.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -138.8 135.87 35.07 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -132.08 167.32 19.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.392 0.433 . . . . 0.0 111.861 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.6 tt0 -153.25 159.28 42.56 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.03 129.08 1.72 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.8 p -99.32 171.28 8.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.682 -0.305 . . . . 0.0 111.269 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -177.92 167.57 38.46 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -72.5 -12.26 61.01 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.01 0.524 . . . . 0.0 112.248 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -152.76 167.46 28.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.986 0.914 . . . . 0.0 109.09 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -30.57 70.58 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -176.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.425 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.8 tttt -69.67 -43.93 71.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.298 0.499 . . . . 0.0 111.148 -176.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -70.19 -39.77 75.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.93 99.71 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.715 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -71.49 -33.56 69.37 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.235 0.47 . . . . 0.0 110.142 177.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.22 -25.86 67.87 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.761 -0.587 . . . . 0.0 110.812 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -88.21 -46.03 9.59 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -61.64 -36.55 81.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.129 0.422 . . . . 0.0 110.94 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.1 -54.45 7.78 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.422 0.289 . . . . 0.0 110.35 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -37.99 -43.55 0.73 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 168.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.8 m -71.51 -41.19 69.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.009 0.368 . . . . 0.0 111.235 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.18 94.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.814 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.463 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.6 tt -61.05 -57.6 11.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 119.225 -0.417 . . . . 0.0 110.707 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.87 -45.36 74.57 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.207 0.458 . . . . 0.0 111.022 -175.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.8 m -74.31 -40.97 61.89 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.12 -0.987 . . . . 0.0 113.422 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 63.8 t -85.82 -26.08 6.47 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-N 119.581 1.082 . . . . 0.0 111.518 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -91.2 0.9 57.44 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.1 42.22 22.68 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.911 0.484 . . . . 0.0 111.576 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 77.3 mt -136.84 -168.54 2.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.151 0.98 . . . . 0.0 110.953 -175.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -136.51 162.99 31.56 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.481 HD21 ' HB3' ' A' ' 163' ' ' PRO . 14.1 tp -152.93 29.71 0.51 Allowed 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.801 -169.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.461 ' HG ' ' H ' ' A' ' 231' ' ' HIS . 37.4 tp -140.67 166.21 25.36 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.744 0.817 . . . . 0.0 109.054 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -137.31 6.57 2.81 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . 0.461 ' H ' ' HG ' ' A' ' 229' ' ' LEU . 28.1 t-80 -63.17 153.69 33.61 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -68.23 163.73 22.14 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 -156.95 174.46 15.48 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.075 0.464 . . . . 0.0 110.704 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -149.37 173.48 13.48 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.422 0.689 . . . . 0.0 109.661 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -151.33 171.67 17.11 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.717 0.294 . . . . 0.0 110.98 -176.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.0 t60 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 116.983 -1.484 . . . . 0.0 109.513 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 C5'-C4'-O4' 113.993 3.423 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 O4'-C1'-N19 111.856 3.656 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C4'-C3'-C2' 99.084 -3.616 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.182 -3.518 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.728 1 O4'-C1'-N19 112.299 4.099 . 0.672 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 98.839 -3.861 . 0.773 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.917 0 C4'-C3'-C2' 98.946 -3.754 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.775 -2.925 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.847 0 C4'-C3'-C2' 99.879 -2.821 . 0.821 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 C4'-C3'-C2' 99.512 -3.188 . 0.569 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 99.28 -3.42 . 0.865 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C4'-C3'-C2' 99.094 -3.606 . 0.749 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 N19-C1'-C2' 109.021 -2.737 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.928 0 C4'-C3'-C2' 99.368 -3.332 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.564 0 C4'-C3'-C2' 99.453 -3.247 . 0.67 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 O4'-C1'-N19 111.533 3.333 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.0 0 C4'-C3'-C2' 99.816 -2.884 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.642 0 C4'-C3'-C2' 99.633 -3.067 . 0.764 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 0 C4'-C3'-C2' 99.397 -3.303 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C4'-C3'-C2' 99.208 -3.492 . 0.766 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.452 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.774 0 C4'-C3'-C2' 99.793 -2.907 . 0.869 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.452 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.626 -3.074 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 1 O4'-C1'-N19 112.585 4.385 . 0.712 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C4'-C3'-C2' 99.838 -2.862 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.605 0 C4'-C3'-C2' 99.414 -3.286 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.316 -3.384 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 1 C4'-C3'-C2' 98.63 -4.07 . 0.702 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 99.426 -3.274 . 0.896 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 99.869 -2.831 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.411 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.682 -3.018 . 0.776 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.411 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 O4'-C1'-N19 111.568 3.368 . 0.743 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.465 -3.235 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.213 0 C4'-C3'-C2' 99.428 -3.272 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.139 0 N19-C1'-C2' 108.36 -3.15 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.487 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.62 2.728 1 C4'-C3'-O3' 121.225 4.087 OUTLIER-EPSILON 0.112 1a . 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.529 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.642 3 C3'-C2'-C1' 105.963 4.959 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.407 -3.861 0 C4'-C3'-C2' 100.128 -2.572 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.13 -3.57 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.618 2.521 0 C4'-C3'-C2' 99.421 -3.279 . 0.591 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . 0.406 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 P--O5' 1.616 2.303 0 C4'-C3'-C2' 99.512 -3.188 . 0.659 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.645 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.042 -3.658 . 0.703 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.477 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.22 -3.48 . 0.843 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.071 1 C4'-C3'-C2' 97.998 -4.702 . 0.809 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.19 -3.51 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 98.891 -3.809 . 0.9 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.935 0 C4'-C3'-C2' 99.091 -3.609 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 0 C4'-C3'-C2' 99.926 -2.774 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.105 0 C4'-C3'-C2' 99.337 -3.363 . 0.877 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 100.364 -2.336 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 1 O4'-C1'-N19 112.821 4.621 . 0.585 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.845 0 O4'-C1'-N19 111.596 3.396 . 0.603 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C4'-C3'-C2' 100.455 -2.245 . 0.741 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.382 3.182 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 99.2 -3.5 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.411 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 C4'-C3'-C2' 99.618 -3.082 . 0.51 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.425 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C5'-C4'-C3' 111.219 -2.854 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.401 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.351 0 C4'-C3'-C2' 99.363 -3.337 . 0.678 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 98.995 -3.705 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 99.359 -3.341 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.389 -3.311 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.51 0 C4'-C3'-C2' 98.932 -3.768 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.058 0 C4'-C3'-C2' 99.018 -3.682 . 0.664 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.481 3.281 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . 0.437 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C4'-C3'-C2' 99.745 -2.955 . 0.705 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . 0.437 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.266 -3.434 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C4'-C3'-C2' 99.026 -3.674 . 0.695 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.015 -3.685 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 1 O4'-C1'-N19 112.393 4.193 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 O4'-C1'-N19 111.578 3.378 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.417 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.89 1 C4'-C3'-C2' 97.904 -4.796 . 0.752 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.417 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.908 0 O4'-C1'-N19 112.183 3.983 . 0.768 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 112.791 0.266 . . . . 0.0 112.791 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.9 177.06 48.36 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.11 154.56 62.23 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.511 2.808 . . . . 0.0 111.223 -178.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.81 7.46 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.336 0.654 . . . . 0.0 109.966 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.18 155.92 34.97 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.72 0.808 . . . . 0.0 109.566 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -73.82 -14.69 24.14 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.394 2.73 . . . . 0.0 112.344 -175.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -50.18 -31.6 14.15 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 117.996 0.362 . . . . 0.0 111.047 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -55.29 -72.34 0.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.507 0.723 . . . . 0.0 111.673 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.51 -23.64 58.6 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.953 0.501 . . . . 0.0 111.761 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 mp -73.04 -59.87 2.5 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -49.09 78.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -55.98 -46.58 78.62 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.608 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.7 -44.52 96.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.708 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -59.96 -34.67 73.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.754 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.06 -55.67 13.36 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.85 -0.531 . . . . 0.0 111.289 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.2 pt -68.11 -20.3 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 20' ' ' LEU . 34.3 ttmt -44.81 102.07 0.28 Allowed Pre-proline 0 N--CA 1.465 0.283 0 C-N-CA 127.183 2.193 . . . . 0.0 113.209 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.0 -13.89 12.56 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.746 1.631 . . . . 0.0 110.314 171.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 141.09 35.48 0.1 Allowed Glycine 0 CA--C 1.531 1.041 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.689 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.37 171.7 1.34 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -170.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.689 ' N ' HD22 ' A' ' 20' ' ' LEU . 12.2 mt-30 -133.86 136.53 44.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.12 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 13.7 m-85 -105.86 135.78 46.68 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.6 ptp -135.47 145.01 46.73 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.632 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.2 tm? -105.64 139.09 40.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.053 0.941 . . . . 0.0 109.76 -172.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.504 ' H ' HD22 ' A' ' 24' ' ' LEU . 76.8 mt -139.27 178.86 6.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -174.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.565 ' CB ' HG22 ' A' ' 37' ' ' VAL . 32.8 t 47.25 -116.86 0.75 Allowed 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.274 0.63 . . . . 0.0 109.854 -165.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.3 tp-100 63.29 78.75 0.28 Allowed 'General case' 0 N--CA 1.426 -1.644 0 C-N-CA 125.874 1.67 . . . . 0.0 109.515 -170.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -165.89 159.37 15.81 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 113.881 -1.508 . . . . 0.0 108.231 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.78 -163.92 25.23 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 -175.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -70.62 161.99 44.08 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.127 1.885 . . . . 0.0 108.61 173.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 t -78.69 11.17 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.631 0.772 . . . . 0.0 111.479 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.8 p-80 -137.51 -6.36 1.75 Allowed 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.526 -0.734 . . . . 0.0 112.3 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.32 60.34 10.21 Favored Pre-proline 0 N--CA 1.454 -0.247 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HB2' HE22 ' A' ' 27' ' ' GLN . 90.6 Cg_endo -76.02 143.75 26.3 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.369 3.38 . . . . 0.0 110.831 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -108.27 123.14 48.34 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.453 0.644 . . . . 0.0 110.549 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.466 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.3 m-85 -113.32 136.86 52.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.565 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -123.81 110.61 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.16 173.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.632 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.1 mtp -98.22 135.42 39.88 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 52.6 p -122.96 136.88 55.02 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.501 ' CG2' HD23 ' A' ' 20' ' ' LEU . 10.0 p -113.73 135.35 53.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.195 -174.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -114.13 121.09 42.74 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.509 -176.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 20' ' ' LEU . 14.6 t -135.93 134.47 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 124.928 1.291 . . . . 0.0 108.673 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.45 HD21 ' HB2' ' A' ' 75' ' ' ALA . 10.0 t-20 51.16 22.26 1.26 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.98 8.03 82.94 Favored Glycine 0 CA--C 1.526 0.767 0 O-C-N 121.919 -0.488 . . . . 0.0 112.875 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -104.44 133.88 48.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 174.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.5 t -124.29 135.34 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.3 m-85 -133.17 135.52 45.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -176.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -109.13 140.87 42.14 Favored 'General case' 0 C--N 1.342 0.259 0 O-C-N 123.827 0.704 . . . . 0.0 111.275 -169.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.05 135.52 7.96 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 95.8 p -110.97 135.72 51.06 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.36 0.664 . . . . 0.0 111.326 -174.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.02 167.65 38.8 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.34 137.52 31.11 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.955 2.437 . . . . 0.0 107.335 168.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.7 t 51.79 -172.64 0.03 OUTLIER 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.537 0.523 . . . . 0.0 111.599 -172.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -93.34 -21.38 19.6 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -166.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -57.78 -73.23 0.07 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -55.77 -36.6 67.53 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.488 1.115 . . . . 0.0 112.567 -176.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.87 -61.74 2.17 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.063 0.392 . . . . 0.0 111.585 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.588 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 4.1 pttm -59.24 -35.55 73.88 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.82 -63.01 1.31 Allowed 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.555 0.742 . . . . 0.0 110.392 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.48 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -56.02 -41.92 75.69 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.614 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.52 -49.24 75.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.341 176.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.83 -48.68 75.02 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 111.706 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.62 -52.96 60.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.456 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.87 -56.14 24.15 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.554 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.67 -46.25 77.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 119.51 -0.281 . . . . 0.0 111.259 -178.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -50.77 -62.93 1.31 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -58.48 -26.11 63.06 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 123.261 0.35 . . . . 0.0 111.205 -174.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.2 t -76.55 -72.23 0.35 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 174.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.419 ' CE2' HG11 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -62.78 -12.83 26.77 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -173.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.6 p -51.27 -21.59 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 119.626 1.103 . . . . 0.0 112.062 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -88.57 -6.88 57.27 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.748 -0.595 . . . . 0.0 111.809 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -148.62 64.07 7.52 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 124.152 0.981 . . . . 0.0 111.416 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.21 -4.11 14.84 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 124.043 3.162 . . . . 0.0 111.462 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -150.54 29.45 0.69 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.057 0.543 . . . . 0.0 110.747 -176.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.45 ' HB2' HD21 ' A' ' 43' ' ' ASN . . . 62.39 16.32 8.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.139 0.976 . . . . 0.0 113.498 -178.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.2 m -141.35 167.27 22.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.7 143.71 55.75 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.722 0.296 . . . . 0.0 110.448 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -156.97 9.16 0.2 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.177 0.591 . . . . 0.0 111.452 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -155.29 168.45 27.01 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 121.969 -0.457 . . . . 0.0 110.74 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 80' ' ' LEU . 3.3 mm? -70.48 -174.68 0.9 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.797 0.839 . . . . 0.0 109.66 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.08 155.92 49.03 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.09 0.471 . . . . 0.0 109.944 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.9 mtm -147.66 166.18 28.21 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 171.08 177.89 41.23 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -152.63 167.36 29.15 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 124.201 1.0 . . . . 0.0 110.537 177.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.0 p -142.6 177.84 8.02 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 122.866 0.466 . . . . 0.0 111.084 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.401 ' H ' HD23 ' A' ' 86' ' ' LEU . 1.7 pt? -149.4 -178.63 6.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.878 0.871 . . . . 0.0 110.7 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.3 m -132.21 26.52 4.52 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 122.996 0.518 . . . . 0.0 111.464 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.0 p -56.88 155.92 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.43 0.692 . . . . 0.0 110.877 179.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -139.25 7.27 2.39 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.283 0.633 . . . . 0.0 111.351 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 70.6 p -72.63 -5.19 35.69 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 122.882 0.473 . . . . 0.0 111.426 177.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 49.98 28.89 3.12 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.08 0.952 . . . . 0.0 112.031 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -145.24 160.59 41.24 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 121.974 -0.454 . . . . 0.0 111.171 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.6 m -69.2 167.47 16.17 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.133 0.973 . . . . 0.0 111.373 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.4 p -146.35 175.42 10.54 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.229 0.612 . . . . 0.0 109.879 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -155.48 168.19 27.93 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.176 0.59 . . . . 0.0 110.693 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -70.59 -3.76 19.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.996 0.518 . . . . 0.0 111.776 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.96 163.74 5.58 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.567 0.747 . . . . 0.0 111.874 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -95.94 -0.5 50.68 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.76 0.424 . . . . 0.0 111.847 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 39.01 59.19 5.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 123.956 0.902 . . . . 0.0 112.726 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.95 172.48 11.77 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.833 3.022 . . . . 0.0 110.137 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -149.28 174.57 12.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.432 0.293 . . . . 0.0 110.99 -176.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -150.76 168.09 25.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.889 178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.77 -3.26 55.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.995 0.518 . . . . 0.0 110.829 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 50.55 17.5 0.38 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.097 1.359 . . . . 0.0 113.349 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -146.02 167.95 22.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.933 0.893 . . . . 0.0 109.894 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 174.03 -170.05 43.14 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -145.12 166.2 26.1 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.472 0.709 . . . . 0.0 110.059 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -149.26 162.96 38.98 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.903 0.481 . . . . 0.0 110.036 -175.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.7 t -148.25 145.33 20.29 Favored Pre-proline 0 N--CA 1.451 -0.384 0 C-N-CA 123.381 0.672 . . . . 0.0 110.113 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.01 6.64 3.69 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 124.049 3.166 . . . . 0.0 111.823 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.06 145.46 16.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.105 0.411 . . . . 0.0 111.787 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -158.35 153.52 25.54 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.6 m -143.52 165.87 26.36 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.935 0.398 . . . . 0.0 111.057 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -146.87 138.72 13.53 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -177.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.72 166.52 25.83 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.04 2.493 . . . . 0.0 111.314 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.67 -174.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 1 C-N-CA 125.523 4.149 . . . . 0.0 113.877 174.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -131.12 -179.52 5.39 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.218 -178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -133.54 4.53 3.66 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.867 0.467 . . . . 0.0 111.804 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.2 p -158.33 162.53 1.41 Allowed 'Isoleucine or valine' 0 CA--C 1.526 0.057 0 C-N-CA 124.471 1.108 . . . . 0.0 108.296 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 171.58 -0.8 0.03 OUTLIER Glycine 0 CA--C 1.525 0.68 0 CA-C-O 119.704 -0.498 . . . . 0.0 113.493 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 35.4 t -152.55 165.94 33.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 110.612 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -153.1 10.8 0.46 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.103 0.561 . . . . 0.0 110.392 -179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.65 22.69 0.13 Allowed Glycine 0 CA--C 1.529 0.922 0 O-C-N 121.638 -0.664 . . . . 0.0 112.625 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -141.67 13.36 2.12 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 117.716 0.758 . . . . 0.0 111.518 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -152.68 163.12 40.28 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.071 0.548 . . . . 0.0 109.723 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 32.3 t -151.92 165.72 33.7 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.933 0.493 . . . . 0.0 110.115 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -155.8 174.14 15.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.223 0.609 . . . . 0.0 110.337 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 47.84 27.77 1.2 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.052 0.941 . . . . 0.0 113.059 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 50.9 m -142.98 178.37 7.73 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.084 0.554 . . . . 0.0 110.62 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -149.02 176.09 10.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.453 ' C ' ' H ' ' A' ' 133' ' ' VAL . . . 178.41 -171.16 43.45 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.581 -0.608 . . . . 0.0 111.581 -175.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -68.08 24.04 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.904 1.282 . . . . 0.0 112.164 178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.453 ' H ' ' C ' ' A' ' 131' ' ' GLY . 27.5 m -124.13 -1.54 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.746 0.819 . . . . 0.0 111.533 -177.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.4 m 41.55 39.51 1.12 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.11 -10.87 7.0 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 26.5 t -157.54 170.48 22.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -146.34 3.78 0.9 Allowed 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.084 0.554 . . . . 0.0 111.015 179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.438 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 42.2 m -145.98 41.15 0.28 Allowed Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 123.59 0.756 . . . . 0.0 111.715 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 138' ' ' SER . 45.0 Cg_endo -78.81 4.32 6.56 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.649 2.233 . . . . 0.0 112.38 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 42.3 t -56.04 -43.73 99.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -174.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.48 10.04 3.2 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 123.213 2.608 . . . . 0.0 111.448 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -140.57 20.49 2.36 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.402 0.681 . . . . 0.0 110.991 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 77.5 p -64.53 -4.27 3.89 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.269 0.627 . . . . 0.0 111.936 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 53.4 tp -147.78 151.15 35.54 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.7 p -146.87 173.22 12.61 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.337 0.655 . . . . 0.0 110.168 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.42 ' N ' ' HD3' ' A' ' 147' ' ' PRO . 77.5 mt-30 -141.35 61.97 14.81 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 122.836 0.454 . . . . 0.0 111.041 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 146' ' ' GLN . 76.8 Cg_exo -50.74 156.22 4.75 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.728 2.952 . . . . 0.0 112.826 177.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.34 172.95 13.91 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.529 2.819 . . . . 0.0 109.976 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.5 tp -146.97 71.5 12.28 Favored Pre-proline 0 CA--C 1.535 0.378 0 O-C-N 121.941 -0.474 . . . . 0.0 111.47 -178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.06 163.88 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.638 2.892 . . . . 0.0 111.353 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.1 tt -148.55 141.15 15.07 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 122.562 0.345 . . . . 0.0 110.468 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.78 166.31 2.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.527 2.818 . . . . 0.0 112.239 172.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -51.59 148.84 19.81 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.698 2.932 . . . . 0.0 112.133 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -74.63 174.64 12.29 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.681 2.921 . . . . 0.0 110.995 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -60.61 158.04 33.53 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.55 145.76 28.4 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.585 2.857 . . . . 0.0 112.472 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.47 161.7 41.8 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.812 3.008 . . . . 0.0 110.851 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.67 -13.8 19.94 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.969 3.113 . . . . 0.0 111.221 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 87.7 p -156.48 176.11 13.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.084 0.554 . . . . 0.0 110.35 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -175.08 170.68 43.82 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.45 163.84 36.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.11 0.564 . . . . 0.0 110.944 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -69.44 117.72 55.44 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 123.078 0.551 . . . . 0.0 110.23 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.08 -13.44 11.37 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 124.456 3.437 . . . . 0.0 111.913 -171.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 92.5 t -67.0 -36.36 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 O-C-N 121.945 -0.472 . . . . 0.0 111.23 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.2 mmm -84.45 -46.93 11.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.61 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 6.3 pt -56.71 -37.51 53.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.422 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.96 -52.46 42.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -72.36 15.46 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.886 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -136.2 -7.57 2.04 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.174 0.443 . . . . 0.0 111.063 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.1 -41.5 5.56 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.044 0.838 . . . . 0.0 110.665 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 85.0 mmt-85 -151.63 76.94 7.35 Favored Pre-proline 0 C--O 1.236 0.349 0 C-N-CA 122.761 0.425 . . . . 0.0 110.823 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.84 -179.7 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.505 2.804 . . . . 0.0 108.408 170.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 108.58 33.84 2.79 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 121.199 -0.938 . . . . 0.0 112.507 -175.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.57 -175.23 3.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 117.954 0.877 . . . . 0.0 110.118 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -142.26 148.21 37.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.507 ' CG ' HG13 ' A' ' 194' ' ' VAL . 30.3 m-85 -126.96 151.17 48.89 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.557 0.617 . . . . 0.0 109.544 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -130.6 170.47 14.23 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.796 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -131.76 134.79 46.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.11 149.43 41.04 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 124.116 0.885 . . . . 0.0 110.581 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 8.4 t -55.89 156.1 5.5 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -165.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -76.98 176.85 8.25 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.43 177.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 68.3 m -145.52 27.67 1.22 Allowed 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.432 0.693 . . . . 0.0 111.354 -177.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.37 -171.02 14.68 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -139.56 0.82 1.88 Allowed 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.167 -0.921 . . . . 0.0 113.091 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 69.1 m 114.46 -10.92 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.849 2.46 . . . . 0.0 111.628 174.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -86.96 -32.17 20.24 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -144.7 151.86 39.54 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 16.6 tptm -153.39 147.6 25.75 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 119.813 -0.755 . . . . 0.0 112.389 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 53.7 m -151.89 156.41 40.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.133 0.973 . . . . 0.0 108.952 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . 0.428 ' CZ ' " H5'" ' B' ' 247' ' ' ' U' . 63.5 m-85 -149.23 174.01 12.85 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -151.48 159.15 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.196 0.522 . . . . 0.0 111.68 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 89.4 mmm -129.71 155.58 45.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.108 -1.812 . . . . 0.0 106.108 176.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 95.2 p -128.92 169.54 14.51 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 167.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.65 162.23 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -177.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 82.6 t -135.35 124.46 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 18.5 t -140.97 127.36 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -174.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 54.5 12.6 0.55 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 104.5 -16.77 47.94 Favored Glycine 0 C--N 1.337 0.639 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.42 172.66 11.53 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 122.92 0.488 . . . . 0.0 109.969 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -137.27 140.5 41.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.538 -0.726 . . . . 0.0 109.532 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -137.26 164.61 28.14 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.874 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.4 tt0 -150.9 161.89 41.83 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -167.14 128.59 1.76 Allowed Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 88.1 p -110.51 145.61 37.44 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.348 0.594 . . . . 0.0 111.837 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 210' ' ' LEU . . . -158.34 172.34 35.33 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.226 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.3 -18.02 65.1 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.761 0.825 . . . . 0.0 112.263 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -151.55 163.54 38.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -59.37 -32.39 70.09 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.473 ' HE3' ' OP1' ' B' ' 292' ' ' ' C' . 87.1 tttt -68.66 -44.76 73.41 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.626 0.77 . . . . 0.0 110.63 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . 0.438 HD12 ' HA3' ' A' ' 205' ' ' GLY . 2.9 tm? -74.1 -35.91 64.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.079 0.951 . . . . 0.0 109.624 -175.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -64.59 -43.14 94.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.877 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -69.98 -29.75 66.92 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 110.035 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.45 82.91 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.742 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -73.89 -43.3 58.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.189 0.449 . . . . 0.0 110.782 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.1 77.49 Favored 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.34 -13.14 44.34 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.173 0.589 . . . . 0.0 110.835 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -84.47 -37.42 21.39 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 175.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 44.4 m -72.24 -41.61 66.61 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.394 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.21 -47.14 83.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.095 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.0 tt -58.09 -57.64 11.95 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 119.229 -0.415 . . . . 0.0 110.852 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.59 30.34 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 118.375 0.534 . . . . 0.0 111.832 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -58.41 -58.65 7.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.98 -28.7 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -174.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.43 -5.18 52.49 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 119.325 -0.369 . . . . 0.0 110.932 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 56.22 31.79 19.08 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.826 0.451 . . . . 0.0 111.03 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 78.8 mt -139.26 -168.9 2.55 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.565 1.146 . . . . 0.0 110.097 -174.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -148.87 171.49 16.22 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.973 -0.455 . . . . 0.0 110.025 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.45 9.75 0.75 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.214 1.006 . . . . 0.0 111.822 -179.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 50.6 tp -140.93 146.64 37.66 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.292 0.637 . . . . 0.0 109.838 178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -139.83 20.79 2.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.796 0.838 . . . . 0.0 109.749 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 62.1 m80 -140.42 -177.98 5.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.0 0.52 . . . . 0.0 110.069 -174.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -143.74 28.57 1.43 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.478 0.711 . . . . 0.0 109.96 -175.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -69.27 -2.98 12.06 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -64.19 168.38 5.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.88 0.472 . . . . 0.0 110.998 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -70.56 -7.59 45.04 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.165 0.586 . . . . 0.0 112.089 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.635 -1.174 . . . . 0.0 110.54 -178.934 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.92 1 C4'-C3'-C2' 98.627 -4.073 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 99.186 -3.514 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 O4'-C1'-N19 110.891 2.691 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 98.74 -3.96 . 0.797 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.385 1 O4'-C1'-N19 112.209 4.009 . 0.687 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.568 3.368 . 0.756 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 O4'-C1'-N19 111.817 3.617 . 0.609 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C4'-C3'-C2' 99.242 -3.458 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.347 -3.353 . 0.795 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.216 0 N19-C1'-C2' 108.196 -3.253 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . 0.428 " H5'" ' CZ ' ' A' ' 190' ' ' PHE . . . . . . . . 0 O4'--C4' 1.416 -3.048 0 O4'-C1'-N19 111.38 3.18 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C4'-C3'-C2' 99.133 -3.567 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.898 0 C4'-C3'-C2' 99.283 -3.417 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C4'-C3'-C2' 100.098 -2.602 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.551 0 C4'-C3'-C2' 98.802 -3.898 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.569 -3.131 . 0.677 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 C4'-C3'-C2' 99.417 -3.283 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.132 -3.568 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C4'-C3'-C2' 100.047 -2.653 . 0.632 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.721 -2.979 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.432 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.207 0 C4'-C3'-C2' 99.789 -2.911 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.432 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C4'-C3'-C2' 98.789 -3.911 . 0.756 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 O4'-C1'-N19 112.25 4.05 . 0.728 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.006 0 C4'-C3'-C2' 99.017 -3.683 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.655 1 C4'-C3'-C2' 98.581 -4.119 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.02 1 C4'-C3'-C2' 98.58 -4.12 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.072 0 C4'-C3'-C2' 99.513 -3.187 . 0.698 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.537 -3.163 . 0.912 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.875 0 C4'-C3'-C2' 99.76 -2.94 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.429 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.377 3.177 . 0.845 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.429 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.862 3.662 . 0.624 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.368 -3.332 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.125 -3.575 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.04 0 N19-C1'-C2' 108.461 -3.087 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.485 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 2 C4'-C3'-O3' 121.535 4.206 . 0.328 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.485 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.415 -3.15 1 P-O3'-C3' 125.075 4.479 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -3.036 1 C4'-C3'-C2' 98.438 -4.262 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.422 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 O4'-C1'-N19 111.416 3.216 . 0.581 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.196 0 C4'-C3'-C2' 99.135 -3.565 . 0.641 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 O4'-C1'-N19 111.677 3.477 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.588 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.421 -2.625 0 C4'-C3'-C2' 99.109 -3.591 . 0.694 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.481 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C4'-C3'-C2' 98.926 -3.774 . 0.912 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.01 1 C4'-C3'-C2' 98.607 -4.093 . 0.833 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.552 0 C4'-C3'-C2' 99.481 -3.219 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 1 C4'-C3'-C2' 98.57 -4.13 . 0.883 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 98.88 -3.82 . 0.767 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.741 0 C4'-C3'-C2' 99.589 -3.111 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 C4'-C3'-C2' 99.896 -2.804 . 0.933 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.824 -2.876 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 1 O4'-C1'-N19 113.46 5.26 . 0.519 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.438 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.623 3.007 0 C5'-C4'-O4' 113.788 3.277 . 0.475 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.438 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.69 0 C5'-C4'-C3' 111.155 -2.897 . 0.744 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.218 0 C4'-C3'-C2' 99.001 -3.699 . 0.836 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.346 2 O4'-C1'-N19 112.419 4.219 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.402 " H2'" ' C6 ' ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 O4'-C1'-N19 110.815 2.615 . 0.404 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.473 ' OP1' ' HE3' ' A' ' 209' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.493 0 O4'-C1'-N19 111.335 3.135 . 0.778 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.401 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 99.023 -3.677 . 0.746 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.77 3.57 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 O4'-C1'-N19 111.145 2.945 . 0.855 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 C4'-C3'-C2' 98.954 -3.746 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.113 -3.587 . 0.627 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.986 0 C4'-C3'-C2' 99.119 -3.581 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.713 0 C4'-C3'-C2' 100.169 -2.531 . 0.866 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 99.828 -2.872 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.44 0 C4'-C3'-C2' 98.989 -3.711 . 0.528 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.456 0 C4'-C3'-C2' 99.06 -3.64 . 0.637 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 304' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.245 -3.455 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . 0.403 ' C6 ' " H2'" ' B' ' 303' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 O4'-C1'-N19 112.154 3.954 . 0.797 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C4'-C3'-C2' 99.531 -3.169 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.456 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 97.968 -4.732 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.456 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.353 0 O4'-C1'-N19 111.882 3.682 . 0.73 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 CA--C 1.529 0.257 0 CA-C-O 120.36 0.067 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.93 54.72 0.12 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.511 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.31 155.96 65.91 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.449 2.766 . . . . 0.0 111.142 -176.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.7 p -159.4 151.81 6.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 123.267 0.627 . . . . 0.0 109.348 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -160.85 162.66 22.33 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 122.834 0.454 . . . . 0.0 109.92 178.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.11 -39.61 79.55 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.246 2.63 . . . . 0.0 114.338 -178.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -55.23 -30.58 60.29 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.105 -0.372 . . . . 0.0 110.534 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -55.95 -66.94 0.34 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.144 0.578 . . . . 0.0 110.977 174.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -29.69 65.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 mp -69.45 -59.11 3.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -175.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.4 mtt -64.95 -44.79 88.27 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.301 0.64 . . . . 0.0 112.033 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -55.56 -47.24 76.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.623 0.369 . . . . 0.0 110.391 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 16' ' ' ILE . 35.9 tp -61.4 -44.73 96.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.794 175.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -55.81 -36.69 67.73 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.11 -60.42 2.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.372 1.069 . . . . 0.0 112.167 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 HD13 ' A' ' 66' ' ' LEU . 11.6 pt -60.7 -35.33 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 123.385 0.674 . . . . 0.0 112.402 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -44.94 102.1 0.28 Allowed Pre-proline 0 N--CA 1.453 -0.293 0 C-N-CA 126.721 2.009 . . . . 0.0 113.698 -175.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 59.2 Cg_endo -82.94 -11.83 9.9 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 121.796 1.664 . . . . 0.0 108.154 168.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.87 126.19 1.95 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.677 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -149.9 175.8 11.33 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.716 1.258 . . . . 0.0 111.602 -176.293 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.677 ' N ' HD22 ' A' ' 20' ' ' LEU . 26.6 mt-30 -133.39 134.6 43.89 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -104.41 134.63 47.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.4 ptp -135.31 143.39 46.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 120.822 0.344 . . . . 0.0 110.13 176.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.537 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -105.0 143.93 32.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.714 1.206 . . . . 0.0 109.105 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.537 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.4 mt -143.39 167.81 21.29 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -167.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.64 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 6.2 m 53.84 -108.22 0.41 Allowed 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 125.79 1.931 . . . . 0.0 108.95 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 75.16 71.2 0.09 Allowed 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.319 0.58 . . . . 0.0 109.798 176.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.95 157.11 25.87 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 162.84 -168.11 37.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.71 5.7 2.77 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.777 2.985 . . . . 0.0 112.666 177.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.0 t 75.35 5.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.314 1.046 . . . . 0.0 111.472 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -132.11 -6.75 3.46 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 121.765 -0.584 . . . . 0.0 109.74 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.08 57.83 13.89 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -71.65 136.62 28.5 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 124.495 3.463 . . . . 0.0 110.312 -174.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.69 112.46 25.54 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.83 0.824 . . . . 0.0 112.758 -174.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.415 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 16.7 m-85 -104.29 136.75 43.3 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.272 -174.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.64 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 20.2 t -121.85 104.64 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 C-N-CA 118.682 -1.207 . . . . 0.0 111.692 -175.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.468 ' HG2' HD23 ' A' ' 24' ' ' LEU . 10.7 mtp -99.23 132.65 44.4 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 58.6 p -128.03 135.91 50.52 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.467 HG23 HD23 ' A' ' 20' ' ' LEU . 11.4 p -117.7 136.23 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -170.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -118.06 121.65 41.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 124.749 1.281 . . . . 0.0 110.187 -172.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.7 t -135.78 130.85 49.87 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 C-N-CA 124.282 1.033 . . . . 0.0 109.007 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.1 t30 53.23 11.03 0.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.08 3.53 45.09 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.589 -0.694 . . . . 0.0 112.363 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -103.85 130.42 51.41 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.8 t -120.35 134.41 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 64.9 m-85 -129.96 135.19 48.03 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -111.81 135.93 51.76 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 123.762 0.663 . . . . 0.0 112.1 -167.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.0 136.45 8.83 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 108.869 -1.693 . . . . 0.0 108.869 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.434 ' HB2' HD11 ' A' ' 35' ' ' LEU . 42.6 p -126.11 108.08 11.01 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.013 0.525 . . . . 0.0 111.157 -172.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.88 160.42 27.07 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 116.474 -0.33 . . . . 0.0 112.33 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.16 135.52 32.13 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.221 1.947 . . . . 0.0 107.52 170.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.3 m 62.71 133.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.742 0.782 . . . . 0.0 110.854 -170.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.2 -18.31 65.2 Favored 'General case' 0 C--O 1.23 0.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -55.82 -66.38 0.43 Allowed 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.717 1.144 . . . . 0.0 111.606 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -55.73 -38.65 70.05 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.814 0.846 . . . . 0.0 112.336 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -57.53 11.73 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 122.082 0.153 . . . . 0.0 110.755 178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.579 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 1.5 pttm -60.76 -36.89 80.08 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 121.181 -0.208 . . . . 0.0 110.57 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -59.72 4.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.066 0.946 . . . . 0.0 110.48 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.424 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.2 t-80 -55.98 -44.6 78.69 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.74 -48.7 77.2 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.374 177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.29 77.52 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 123.357 0.663 . . . . 0.0 111.963 178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -55.75 -52.56 63.52 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.545 0.738 . . . . 0.0 110.774 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.424 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.6 mttt -56.48 -59.24 5.26 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.859 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.07 -38.73 71.04 Favored 'General case' 0 C--O 1.224 -0.264 0 O-C-N 123.752 0.657 . . . . 0.0 111.95 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 16' ' ' ILE . 4.5 tp -55.16 -66.38 0.42 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.0 mtt85 -60.68 -21.88 63.31 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 48.2 m -78.75 -68.44 0.65 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.718 0.294 . . . . 0.0 111.232 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -14.95 62.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 66' ' ' LEU . 6.0 m -54.75 -14.77 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.624 0 CA-C-N 120.857 1.662 . . . . 0.0 111.952 171.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -85.85 -14.21 45.66 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.832 0.287 . . . . 0.0 110.816 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -148.03 63.68 7.65 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.051 0.941 . . . . 0.0 110.997 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -69.88 -42.58 3.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 123.248 2.632 . . . . 0.0 110.712 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -173.25 -18.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.732 0.813 . . . . 0.0 110.637 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -153.83 -176.34 5.79 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.254 0.621 . . . . 0.0 110.93 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.3 p -67.84 20.12 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.715 1.606 . . . . 0.0 113.757 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.25 -14.45 11.09 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.607 0.64 . . . . 0.0 112.343 -177.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.07 -16.75 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.856 0.462 . . . . 0.0 111.71 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -75.37 -0.36 19.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.22 0.608 . . . . 0.0 111.332 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.2 mt -131.73 22.1 4.63 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.055 0.942 . . . . 0.0 109.657 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.73 -178.6 6.18 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.24 1.016 . . . . 0.0 110.3 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -58.97 165.19 2.53 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.218 0.533 . . . . 0.0 111.817 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -171.16 -173.13 37.98 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -56.46 158.01 4.68 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.642 0.777 . . . . 0.0 112.584 -178.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.8 m -149.65 152.94 36.23 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.205 1.002 . . . . 0.0 108.737 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.9 tp -152.63 137.71 17.31 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.5 t -155.55 7.66 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.274 0.358 . . . . 0.0 111.24 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.51 142.25 15.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.105 0 CA-C-O 120.944 0.402 . . . . 0.0 110.678 -177.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -151.24 17.62 0.74 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.344 0.658 . . . . 0.0 110.673 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.4 p -140.27 -179.56 6.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.506 1.122 . . . . 0.0 110.868 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -145.22 168.41 20.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.461 0.705 . . . . 0.0 109.815 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.51 159.11 10.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.27 0.557 . . . . 0.0 111.163 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.4 p -73.1 171.49 12.82 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.196 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.7 m -79.87 11.1 3.49 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.122 0.569 . . . . 0.0 111.835 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.56 167.92 2.41 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.356 1.063 . . . . 0.0 111.378 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -146.05 152.96 40.18 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.93 15.86 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -141.84 143.48 33.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.946 0.499 . . . . 0.0 110.126 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -157.48 165.79 17.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 122.949 0.5 . . . . 0.0 109.957 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.91 173.93 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 124.675 3.583 . . . . 0.0 115.19 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -130.86 17.19 5.18 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.95 0.9 . . . . 0.0 110.248 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 41.0 p -131.94 15.35 4.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.93 0.892 . . . . 0.0 109.93 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp -149.95 165.92 31.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.041 0.936 . . . . 0.0 108.918 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -150.27 166.79 28.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.624 0.25 . . . . 0.0 111.032 -176.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -152.67 -15.48 0.16 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 156.23 -1.6 0.15 Allowed Glycine 0 CA--C 1.528 0.868 0 O-C-N 121.645 -0.66 . . . . 0.0 112.996 -177.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -71.46 23.8 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.071 0.949 . . . . 0.0 112.415 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 60.35 6.35 1.02 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.123 0.969 . . . . 0.0 112.566 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.524 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 27.3 p -78.63 -13.65 0.21 Allowed Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 115.713 1.745 . . . . 0.0 115.713 175.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 109' ' ' THR . 55.6 Cg_exo -52.4 -14.73 3.19 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.093 2.529 . . . . 0.0 115.272 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.4 124.37 20.44 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.243 0.474 . . . . 0.0 110.782 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -159.04 174.36 15.04 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.591 0.756 . . . . 0.0 111.136 -178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.9 m -145.67 155.13 42.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.108 0.963 . . . . 0.0 109.122 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -147.92 156.69 44.12 Favored Pre-proline 0 N--CA 1.455 -0.207 0 C-N-CA 122.86 0.464 . . . . 0.0 110.284 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.91 166.84 27.72 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.367 2.711 . . . . 0.0 110.469 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.76 177.03 6.72 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.927 3.084 . . . . 0.0 111.325 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -143.1 22.2 1.9 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.582 0.353 . . . . 0.0 110.301 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -139.92 170.9 15.01 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.728 0.299 . . . . 0.0 110.275 -177.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.02 174.76 4.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 C-N-CA 122.925 0.49 . . . . 0.0 110.776 -176.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.14 -16.77 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 48.1 t -155.81 153.25 29.5 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.762 0.825 . . . . 0.0 109.35 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -156.53 -3.0 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.493 0.317 . . . . 0.0 111.367 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.09 29.26 0.04 OUTLIER Glycine 0 CA--C 1.527 0.792 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -142.31 10.75 1.91 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.895 0.478 . . . . 0.0 111.403 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.58 -179.93 1.52 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.107 0.48 . . . . 0.0 111.123 175.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.0 p -143.03 27.67 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.262 0.625 . . . . 0.0 110.82 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -114.53 5.01 15.37 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.2 p -152.49 172.32 16.73 Favored 'General case' 0 N--CA 1.458 -0.062 0 CA-C-O 121.068 0.461 . . . . 0.0 110.619 176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.6 m -147.03 -177.32 5.6 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 0.0 109.741 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 92.5 p -149.05 -178.94 6.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.363 0.601 . . . . 0.0 111.44 -177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -101.74 24.89 29.91 Favored Glycine 0 CA--C 1.53 1.003 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -136.52 26.14 3.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.628 0.771 . . . . 0.0 110.344 -177.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.7 p -136.46 20.13 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 122.942 0.497 . . . . 0.0 109.935 -177.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.0 m 53.83 31.26 12.8 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.794 0.838 . . . . 0.0 112.673 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 44.9 tp -52.3 144.54 12.65 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.222 0.609 . . . . 0.0 110.828 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.3 m -64.2 170.37 3.77 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.313 0.645 . . . . 0.0 111.58 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -150.87 170.02 20.31 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.198 0.599 . . . . 0.0 110.475 178.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -150.97 157.8 35.23 Favored Pre-proline 0 C--O 1.23 0.065 0 C-N-CA 123.181 0.592 . . . . 0.0 110.251 -178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.85 161.33 42.68 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.918 2.412 . . . . 0.0 111.297 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.411 ' HB ' ' HD2' ' A' ' 141' ' ' PRO . 15.5 m -145.82 161.28 40.92 Favored Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 124.02 0.928 . . . . 0.0 110.149 -176.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' HB ' ' A' ' 140' ' ' VAL . 61.0 Cg_endo -68.51 170.47 14.93 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.544 2.163 . . . . 0.0 110.532 175.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.04 170.36 17.31 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.108 0.48 . . . . 0.0 111.27 -178.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.4 t -151.31 -172.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.106 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.547 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.6 pt? -137.5 -177.69 4.9 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 2.5 m -136.74 18.21 3.07 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.936 0.494 . . . . 0.0 111.006 -175.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 85.7 mt-30 -138.81 39.43 0.38 Allowed Pre-proline 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 0.0 111.898 -178.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 92.2 Cg_endo -71.73 166.66 28.8 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.922 2.415 . . . . 0.0 110.183 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.79 165.52 29.41 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.268 2.645 . . . . 0.0 110.089 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.8 mp -62.23 147.47 91.08 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.16 170.77 19.03 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.767 2.978 . . . . 0.0 110.92 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.3 mm -139.25 131.6 15.35 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -51.06 152.86 9.88 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.964 3.11 . . . . 0.0 112.902 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 154' ' ' PRO . 73.2 Cg_endo -70.2 155.68 63.93 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.951 3.101 . . . . 0.0 110.902 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 153' ' ' PRO . 32.3 Cg_exo -58.82 -13.02 16.55 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.313 3.342 . . . . 0.0 113.984 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -155.28 154.25 28.23 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.03 0.532 . . . . 0.0 110.116 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.03 155.77 64.25 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.6 2.866 . . . . 0.0 110.892 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.44 158.37 54.26 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.493 2.795 . . . . 0.0 111.147 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -80.37 11.46 2.86 Favored 'Trans proline' 0 N--CA 1.454 -0.794 1 C-N-CA 125.508 4.138 . . . . 0.0 111.972 178.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 71.9 p -61.73 169.73 2.32 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.577 0.751 . . . . 0.0 112.575 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -170.07 -175.21 38.83 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -70.31 -11.18 60.73 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.891 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.558 ' HB3' ' HD2' ' A' ' 163' ' ' PRO . 72.1 m-20 60.5 168.66 0.08 OUTLIER Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.95 0.9 . . . . 0.0 110.999 -178.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' A' ' 162' ' ' ASN . 72.8 Cg_endo -74.97 -11.47 21.54 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.686 1.59 . . . . 0.0 111.061 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 81.0 t -61.94 -38.32 80.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 122.759 0.424 . . . . 0.0 110.837 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 91.7 mmm -84.74 -42.4 15.26 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 119.323 -0.37 . . . . 0.0 111.333 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.466 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.1 pt -59.96 -36.48 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.4 tt -66.0 -54.18 29.34 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 173.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -71.95 16.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.813 1.245 . . . . 0.0 113.002 -176.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -140.13 -9.64 1.14 Allowed 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.429 -0.794 . . . . 0.0 111.375 174.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.24 -44.14 6.69 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.058 1.299 . . . . 0.0 110.201 176.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 83.8 mmt-85 -152.12 72.89 7.78 Favored Pre-proline 0 C--O 1.233 0.2 0 C-N-CA 123.533 0.733 . . . . 0.0 109.678 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -59.26 -178.23 0.14 Allowed 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.911 3.074 . . . . 0.0 111.24 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 113.76 31.3 2.35 Favored Glycine 0 CA--C 1.538 1.486 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.832 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.42 -174.59 3.27 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 117.957 0.878 . . . . 0.0 110.463 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -148.02 157.96 43.8 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 177.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -130.8 152.15 50.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -132.29 165.5 24.03 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.78 0.675 . . . . 0.0 110.601 173.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -122.05 141.53 51.27 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -177.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -127.65 157.84 39.18 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.028 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.7 p -45.4 168.11 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.181 2.192 . . . . 0.0 116.21 -167.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.16 168.13 17.98 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.642 -176.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.0 t -163.04 164.04 25.7 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 114.67 175.12 18.6 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 123.445 0.466 . . . . 0.0 112.354 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.82 167.6 21.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.97 0.508 . . . . 0.0 110.115 175.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 43.3 m -61.62 -8.0 3.98 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -130.93 13.82 5.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 118.071 0.396 . . . . 0.0 110.626 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.91 20.42 1.13 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.06 157.86 9.53 Favored 'General case' 0 C--O 1.23 0.041 0 C-N-CA 124.933 1.293 . . . . 0.0 111.065 -177.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 67.5 m -145.6 155.98 43.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.122 0.969 . . . . 0.0 109.593 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -144.74 171.62 14.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.4 OUTLIER -147.2 157.81 9.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 121.738 0.78 . . . . 0.0 111.76 175.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.8 mmm -129.5 156.64 43.81 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 60.4 p -129.93 173.09 11.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 168.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.5 t -151.0 159.38 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -176.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 60.0 t -136.39 127.91 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 171.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 198' ' ' GLY . 3.2 p -148.34 132.81 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -176.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.24 1.49 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -175.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 113.16 -15.58 22.99 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -74.53 173.35 10.51 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.188 0.595 . . . . 0.0 109.652 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -139.0 138.93 37.68 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.37 162.68 31.93 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 115.421 -0.808 . . . . 0.0 112.157 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 42.7 tt0 -149.06 160.01 43.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -170.52 129.14 1.75 Allowed Glycine 0 C--N 1.335 0.514 0 O-C-N 121.576 -0.702 . . . . 0.0 111.458 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 77.6 p -99.26 175.94 5.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 122.425 -0.456 . . . . 0.0 110.601 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 178.47 171.7 42.05 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -80.11 -17.3 52.96 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.758 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -148.33 164.3 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -61.79 -31.13 71.33 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.4 -36.95 66.1 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.265 0.484 . . . . 0.0 110.417 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.69 -40.08 69.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.061 0.944 . . . . 0.0 109.821 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.69 98.19 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 19.1 tttp -71.23 -32.86 69.29 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.0 0.364 . . . . 0.0 110.867 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.49 -28.43 68.57 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.883 178.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -79.95 -52.73 7.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 117.867 0.303 . . . . 0.0 110.854 177.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -58.62 -34.86 71.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.9 -0.5 . . . . 0.0 111.63 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.6 -55.32 6.04 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -39.68 -41.79 1.12 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.851 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.6 m -71.75 -40.92 69.0 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.757 1.162 . . . . 0.0 110.917 178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.95 91.11 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.969 0.414 . . . . 0.0 110.746 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.453 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.1 tt -58.33 -57.76 11.48 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 122.569 0.347 . . . . 0.0 110.485 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -51.62 -54.48 27.36 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.511 0.196 . . . . 0.0 111.283 -174.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 63.3 m -67.6 -42.0 83.13 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.25 -24.0 9.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 O-C-N 120.951 -1.093 . . . . 0.0 111.259 -173.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -96.79 0.27 49.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -177.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 59.08 36.41 24.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.542 0.737 . . . . 0.0 111.267 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 94.3 mt -137.98 -166.79 2.03 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.543 1.137 . . . . 0.0 110.537 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 26.5 t-80 -147.97 -173.08 4.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.311 0.645 . . . . 0.0 109.361 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 11.9 tp -137.94 -2.5 1.89 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.7 tp -146.79 -6.21 0.52 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.43 -0.794 . . . . 0.0 112.304 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.64 6.18 3.46 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.971 0.508 . . . . 0.0 111.714 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -152.51 8.52 0.45 Allowed 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.885 0.374 . . . . 0.0 111.116 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -156.58 163.97 38.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -146.37 165.19 30.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.09 0.556 . . . . 0.0 110.762 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -149.19 6.58 0.68 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.979 0.419 . . . . 0.0 111.149 -178.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -146.31 11.75 1.18 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.251 0.62 . . . . 0.0 110.757 -177.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 74.4 t60 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 117.291 -1.338 . . . . 0.0 110.025 -177.932 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C4'-C3'-C2' 99.08 -3.62 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.391 0 C4'-C3'-C2' 98.935 -3.765 . 0.73 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.686 0 C4'-C3'-C2' 99.21 -3.49 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.349 -3.351 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 O4'-C1'-N19 112.139 3.939 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.562 0 C4'-C3'-C2' 98.867 -3.833 . 0.764 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 C4'-C3'-C2' 99.188 -3.512 . 0.688 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C4'-C3'-C2' 100.013 -2.687 . 0.712 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.803 0 C4'-C3'-C2' 99.046 -3.654 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.182 0 C4'-C3'-C2' 99.172 -3.528 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.826 0 C4'-C3'-C2' 98.737 -3.963 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.676 -3.024 . 0.71 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.1 0 C4'-C3'-C2' 99.545 -3.155 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.612 -3.088 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.694 0 C4'-C3'-C2' 98.724 -3.976 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.492 -3.208 . 0.617 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.711 3.511 . 0.805 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 C4'-C3'-C2' 99.625 -3.075 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 0 C4'-C3'-C2' 99.274 -3.426 . 0.842 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 99.406 -3.294 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.426 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.418 -2.89 0 C4'-C3'-C2' 100.045 -2.655 . 0.857 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.426 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 99.487 -3.213 . 0.907 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.468 1 O4'-C1'-N19 113.098 4.898 . 0.726 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 O4'-C1'-N19 111.277 3.077 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.834 0 C4'-C3'-C2' 98.816 -3.884 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.87 1 C4'-C3'-C2' 98.669 -4.031 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 C4'-C3'-C2' 99.503 -3.197 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 C4'-C3'-C2' 99.199 -3.501 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.437 0 C4'-C3'-C2' 100.06 -2.64 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 C4'-C3'-C2' 99.854 -2.846 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.445 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 99.45 -3.25 . 0.78 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C4'-C3'-C2' 100.005 -2.695 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.124 0 N19-C1'-C2' 108.76 -2.9 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C5'-C4'-C3' 109.357 -4.096 . 0.241 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.508 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.545 2.73 0 C4'-C3'-O3' 120.434 3.782 OUTLIER-EPSILON 0.088 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.564 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.824 2 P-O3'-C3' 125.998 5.248 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.563 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.914 1 C4'-C3'-C2' 98.105 -4.595 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.563 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 1 O4'--C4' 1.404 -4.057 1 N19-C1'-C2' 120.874 4.671 . 0.297 1a . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 P-O3'-C3' 123.061 2.801 . 0.424 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C4'-C3'-C2' 98.967 -3.733 . 0.846 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.579 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.565 1 C4'-C3'-C2' 98.675 -4.025 . 0.608 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.479 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.083 2.883 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 C4'-C3'-C2' 98.572 -4.128 . 0.821 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 C4'-C3'-C2' 98.873 -3.827 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C4'-C3'-C2' 99.287 -3.413 . 0.911 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C4'-C3'-C2' 99.304 -3.396 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C4'-C3'-C2' 99.906 -2.794 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 100.029 -2.671 . 0.928 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 C4'-C3'-C2' 99.93 -2.77 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.261 2 O4'-C1'-N19 113.233 5.033 . 0.578 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.405 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 111.489 3.289 . 0.464 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.405 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.438 -2.708 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.662 0 C4'-C3'-C2' 99.202 -3.498 . 0.858 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.116 -3.584 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C4'-C3'-C2' 99.816 -2.884 . 0.535 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.415 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 O4'-C1'-N19 111.578 3.378 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.415 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 C4'-C3'-C2' 99.625 -3.075 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 1 C4'-C3'-C2' 98.643 -4.057 . 0.747 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.158 -3.542 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 C4'-C3'-C2' 99.152 -3.548 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 98.839 -3.861 . 0.623 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.165 -3.535 . 0.533 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.93 0 C5'-C4'-C3' 111.191 -2.873 . 0.826 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 O4'-C1'-N19 111.069 2.869 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.474 0 C4'-C3'-C2' 99.185 -3.515 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C4'-C3'-C2' 98.787 -3.913 . 0.737 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.49 1 C4'-C3'-C2' 98.636 -4.064 . 0.76 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.144 3.944 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.457 -3.243 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.472 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.35 1 C4'-C3'-C2' 98.18 -4.52 . 0.774 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.472 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.759 3.559 . 0.751 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 CA--C 1.531 0.345 0 N-CA-C 113.028 0.357 . . . . 0.0 113.028 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.79 -173.26 44.68 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 -178.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.28 -6.97 19.78 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 124.195 3.263 . . . . 0.0 111.789 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m 44.75 33.05 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 125.191 1.396 . . . . 0.0 112.647 178.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -50.28 145.61 9.88 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 123.231 0.612 . . . . 0.0 111.968 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -79.53 -13.35 13.46 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.092 2.528 . . . . 0.0 112.329 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -46.32 -45.09 17.29 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.484 0.714 . . . . 0.0 111.238 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -55.05 -61.37 2.36 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.427 0.691 . . . . 0.0 112.264 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.54 66.73 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.413 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.7 OUTLIER -69.45 -55.78 9.31 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 123.678 0.611 . . . . 0.0 110.12 -175.363 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.4 mmt -62.86 -45.71 91.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -55.19 -54.26 45.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.288 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.6 tp -56.17 -45.91 79.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.942 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -55.43 -36.94 67.04 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.22 -53.16 15.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.295 0.638 . . . . 0.0 112.361 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.7 pt -70.71 -34.18 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -174.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 pttp -64.01 145.41 97.9 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 121.419 -0.801 . . . . 0.0 112.563 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -91.53 -18.02 1.02 Allowed 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 124.27 3.314 . . . . 0.0 113.247 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.52 43.33 0.03 OUTLIER Glycine 0 CA--C 1.532 1.153 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -171.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.76 -178.44 0.15 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -169.175 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.693 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.1 mt-30 -134.47 135.8 42.73 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.439 0.462 . . . . 0.0 111.292 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.434 ' CD1' HD21 ' A' ' 20' ' ' LEU . 23.2 m-85 -108.87 136.47 48.38 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 171.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -140.09 144.16 36.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.546 HD13 ' HG2' ' A' ' 38' ' ' MET . 61.4 tp -104.2 137.24 42.41 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.56 0.695 . . . . 0.0 112.79 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.56 ' C ' HG23 ' A' ' 37' ' ' VAL . 48.3 mt -116.56 177.73 4.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.977 170.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.512 ' CB ' HG22 ' A' ' 37' ' ' VAL . 17.1 t 48.05 -121.86 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.298 1.039 . . . . 0.0 109.4 -168.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.439 ' NE2' ' HA ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 77.0 67.37 0.05 OUTLIER 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 126.583 1.953 . . . . 0.0 108.197 -179.01 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.36 161.98 21.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.497 -1.229 . . . . 0.0 109.175 -171.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 135.25 -156.26 22.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.349 -1.9 . . . . 0.0 108.349 -174.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.67 160.65 45.92 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 122.415 2.076 . . . . 0.0 108.8 170.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 t -79.61 13.97 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.398 1.079 . . . . 0.0 111.505 -176.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -138.71 -3.02 1.69 Allowed 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.884 -0.51 . . . . 0.0 111.925 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.26 60.49 6.97 Favored Pre-proline 0 N--CA 1.452 -0.338 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.8 138.95 27.0 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 124.765 3.644 . . . . 0.0 111.115 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -105.88 125.81 51.43 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 122.227 -0.295 . . . . 0.0 110.851 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.26 139.49 46.61 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.56 HG23 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -129.04 101.43 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 C-N-CA 118.781 -1.168 . . . . 0.0 109.026 172.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.546 ' HG2' HD13 ' A' ' 24' ' ' LEU . 79.4 mtp -90.28 135.36 33.72 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -172.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 57.3 p -122.31 133.94 54.67 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' CG2' HD23 ' A' ' 20' ' ' LEU . 13.0 p -114.96 134.54 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -118.79 125.52 49.79 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.244 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 35.4 t -135.79 133.46 51.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 125.267 1.427 . . . . 0.0 108.657 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 39.8 t30 50.55 19.16 0.54 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 178.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.84 1.84 61.47 Favored Glycine 0 C--N 1.338 0.648 0 O-C-N 121.625 -0.672 . . . . 0.0 113.44 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.34 132.3 50.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 8.0 p -127.88 135.48 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 123.657 0.598 . . . . 0.0 110.543 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 39' ' ' SER . 80.4 m-85 -133.05 136.8 46.17 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.187 -175.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -112.8 137.39 51.2 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 123.595 0.559 . . . . 0.0 111.048 -168.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.38 135.61 7.98 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.425 ' HB3' HG12 ' A' ' 37' ' ' VAL . 98.1 p -104.86 136.03 45.12 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.047 0.939 . . . . 0.0 111.255 -176.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -165.57 159.08 32.19 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.66 135.54 26.28 Favored 'Trans proline' 0 N--CA 1.446 -1.268 0 C-N-CA 122.622 2.214 . . . . 0.0 106.843 168.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.4 t 54.64 168.66 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.897 0.748 . . . . 0.0 112.37 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -70.13 -22.9 62.96 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -170.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.43 -71.43 0.12 Allowed 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.729 0.695 . . . . 0.0 111.696 -170.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -55.93 -38.52 70.4 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 123.865 0.866 . . . . 0.0 111.951 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.44 -62.05 1.99 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.005 0.431 . . . . 0.0 111.104 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.501 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.9 tttm -55.78 -38.69 70.24 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.819 0.848 . . . . 0.0 112.329 175.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.419 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.2 tm? -55.6 -63.39 1.19 Allowed 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.233 0.613 . . . . 0.0 112.173 176.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -56.12 -43.47 78.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.035 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.1 76.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.97 -47.3 77.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.676 0.791 . . . . 0.0 111.301 178.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -56.16 -52.56 63.91 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.44 0.696 . . . . 0.0 111.214 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -55.76 -58.68 6.82 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.703 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.6 76.55 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.691 0.396 . . . . 0.0 110.685 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.33 -65.23 0.59 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -62.07 -26.0 68.02 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.134 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -80.13 -38.2 31.99 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -100.0 -12.25 19.9 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.312 -0.851 . . . . 0.0 112.758 -172.671 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.3 m -50.02 -15.25 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-N 120.413 1.461 . . . . 0.0 113.993 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -100.22 -0.23 39.08 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.605 0.639 . . . . 0.0 111.682 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -147.15 64.53 8.94 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 124.621 1.168 . . . . 0.0 110.294 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.26 -8.32 23.2 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.648 2.898 . . . . 0.0 112.098 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -159.22 171.71 19.37 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.714 0.806 . . . . 0.0 109.13 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.73 156.2 20.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 117.86 0.3 . . . . 0.0 110.378 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.5 m -147.19 172.49 13.73 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-O 120.918 0.389 . . . . 0.0 110.32 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -156.29 168.98 25.63 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.462 0.705 . . . . 0.0 109.343 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.63 166.1 34.42 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.629 0.252 . . . . 0.0 110.97 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.7 t-80 -146.66 11.3 1.1 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.437 0.695 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.38 19.2 9.74 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.896 1.278 . . . . 0.0 109.062 -177.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.26 -175.34 3.96 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.826 0.851 . . . . 0.0 110.095 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -140.58 173.27 11.66 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.126 0.571 . . . . 0.0 111.516 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.09 17.41 0.46 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -64.45 -11.13 30.26 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.662 0.731 . . . . 0.0 112.122 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 95.1 m -58.19 149.24 24.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.1 tp -148.76 165.78 30.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.423 0.689 . . . . 0.0 109.572 -179.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.9 m -142.27 173.49 11.48 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.45 0.7 . . . . 0.0 111.035 -177.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 90' ' ' THR . 16.1 t -61.43 166.8 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.036 0.934 . . . . 0.0 110.438 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -124.84 18.14 8.61 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.505 0.722 . . . . 0.0 111.842 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.4 ' H ' HG12 ' A' ' 88' ' ' VAL . 63.3 p -142.83 165.93 26.04 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -155.6 173.44 16.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.254 -0.279 . . . . 0.0 111.122 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -150.74 167.82 26.24 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.267 1.027 . . . . 0.0 108.843 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.8 t -62.76 161.52 12.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.999 0.428 . . . . 0.0 110.718 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.5 m -149.04 165.76 30.71 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.393 0.677 . . . . 0.0 109.979 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -156.66 173.86 16.33 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.175 0.59 . . . . 0.0 110.416 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.69 169.44 21.6 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 122.949 0.499 . . . . 0.0 110.358 178.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.88 164.83 37.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 110.238 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -157.82 170.25 22.77 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.005 0.922 . . . . 0.0 108.946 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -60.32 147.62 81.46 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 122.838 0.455 . . . . 0.0 110.32 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -72.5 169.25 22.23 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 123.492 2.795 . . . . 0.0 111.393 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -148.66 3.32 0.64 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.286 0.634 . . . . 0.0 110.038 178.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 40.1 p -71.47 177.45 3.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.334 0.654 . . . . 0.0 110.562 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 22.8 tp -142.49 18.03 2.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.294 0.638 . . . . 0.0 110.096 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -139.4 17.01 2.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.806 0.442 . . . . 0.0 111.308 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -77.39 12.39 1.57 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.275 0.63 . . . . 0.0 110.808 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.71 -173.99 24.19 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -136.65 3.12 2.73 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 117.246 0.523 . . . . 0.0 112.177 -174.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 47.27 -159.58 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.365 1.066 . . . . 0.0 113.082 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.7 p -62.75 159.42 44.48 Favored Pre-proline 0 C--O 1.235 0.299 0 C-N-CA 124.056 0.943 . . . . 0.0 111.736 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.13 -179.44 3.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.952 3.101 . . . . 0.0 111.152 177.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -136.39 12.15 3.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.114 0.566 . . . . 0.0 111.721 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -143.31 12.13 1.75 Allowed 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 123.525 0.73 . . . . 0.0 111.682 -178.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.4 m -144.33 7.64 1.35 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.25 0.62 . . . . 0.0 111.981 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.31 160.42 58.53 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.535 0.734 . . . . 0.0 110.717 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.432 ' N ' ' HD2' ' A' ' 116' ' ' PRO . 65.4 Cg_exo -50.34 -43.73 42.49 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 124.477 3.451 . . . . 0.0 115.634 177.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 115' ' ' PRO . 98.2 Cg_endo -74.27 -169.12 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.9 2.4 . . . . 0.0 111.286 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -133.4 145.88 50.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.286 0.565 . . . . 0.0 111.094 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -150.31 172.76 14.87 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.685 1.194 . . . . 0.0 109.719 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 14.5 p -153.16 154.92 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.289 0.636 . . . . 0.0 109.703 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 164.03 -15.77 0.11 Allowed Glycine 0 CA--C 1.528 0.879 0 CA-C-O 119.891 -0.394 . . . . 0.0 112.691 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 44.8 m -71.09 -1.64 12.96 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 117.529 0.664 . . . . 0.0 111.986 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -150.74 173.89 13.66 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.269 0.628 . . . . 0.0 110.361 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.6 21.66 0.16 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.37 172.27 3.33 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.361 0.664 . . . . 0.0 112.579 -178.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -152.92 177.57 10.62 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.477 0.711 . . . . 0.0 109.695 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 22.7 t -149.15 176.02 10.86 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -150.39 169.51 21.25 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.433 0.693 . . . . 0.0 110.133 -176.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 77.8 p -154.27 -179.77 8.24 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.711 0.405 . . . . 0.0 111.112 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 78.6 p -151.13 171.27 17.63 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.833 0.853 . . . . 0.0 109.786 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 48.2 m -73.59 -7.85 53.59 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.45 178.56 40.23 Favored Glycine 0 CA--C 1.527 0.824 0 O-C-N 122.16 -0.337 . . . . 0.0 112.533 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -151.12 163.37 38.96 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.572 0.749 . . . . 0.0 109.423 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 m 37.76 41.55 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.4 1.08 . . . . 0.0 112.718 -176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 67.7 m -128.97 19.37 6.01 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.108 0.563 . . . . 0.0 110.976 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.7 mt 54.09 28.19 8.56 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.896 0.878 . . . . 0.0 113.055 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 22.3 t -141.34 -3.98 1.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.318 -0.239 . . . . 0.0 111.543 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.69 169.89 14.81 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.1 p -160.53 160.2 25.84 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.158 178.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.18 162.31 3.0 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 124.069 3.179 . . . . 0.0 112.736 174.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 23.8 t -141.87 125.08 9.63 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.58 0.352 . . . . 0.0 110.313 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.76 -179.82 0.1 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 124.35 3.367 . . . . 0.0 113.418 173.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 54.44 18.25 1.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.547 1.139 . . . . 0.0 113.834 176.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 86.1 p -146.43 1.06 0.81 Allowed 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 118.057 0.389 . . . . 0.0 111.677 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 95.6 mt -142.87 3.13 1.4 Allowed 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.353 1.061 . . . . 0.0 110.18 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 15.1 t -159.64 175.46 13.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.857 0.863 . . . . 0.0 110.451 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -142.37 151.86 59.11 Favored Pre-proline 0 N--CA 1.456 -0.174 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.72 168.56 24.18 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 122.88 2.387 . . . . 0.0 111.961 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.53 169.81 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 124.986 3.79 . . . . 0.0 113.355 174.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -53.9 148.1 21.81 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.167 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.51 -1.05 11.08 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 124.031 3.154 . . . . 0.0 113.507 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 44.6 mm -61.89 133.63 93.88 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -177.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.17 170.88 18.77 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.896 3.064 . . . . 0.0 111.109 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -49.49 159.34 1.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.062 3.175 . . . . 0.0 112.728 175.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.52 152.87 11.52 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.761 2.974 . . . . 0.0 113.41 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.45 158.81 32.68 Favored Pre-proline 0 CA--C 1.533 0.315 0 C-N-CA 123.725 0.81 . . . . 0.0 109.051 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -48.08 115.56 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.843 3.029 . . . . 0.0 112.707 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -80.03 166.59 20.81 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 124.539 3.492 . . . . 0.0 111.049 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.57 166.55 29.06 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.331 2.688 . . . . 0.0 110.241 173.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.9 t -150.59 1.68 0.45 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 169.93 -6.89 0.04 OUTLIER Glycine 0 C--N 1.344 1.021 0 CA-C-N 118.266 0.484 . . . . 0.0 112.803 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -143.9 172.44 12.86 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.92 0.888 . . . . 0.0 109.115 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 50.8 p30 -144.22 155.72 57.98 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 122.854 0.462 . . . . 0.0 110.249 -178.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.77 -19.8 23.49 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.05 2.5 . . . . 0.0 111.454 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 61.5 t -63.86 -41.52 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 122.759 0.424 . . . . 0.0 110.725 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 62.0 tpp -76.68 -41.9 43.74 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.338 0.517 . . . . 0.0 111.795 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 75.4 mt -54.21 -48.88 65.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.92 -44.82 88.3 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.137 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -73.91 13.52 0.51 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -131.62 -26.44 2.02 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.938 -0.476 . . . . 0.0 110.466 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.449 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.5 OUTLIER -90.65 -32.96 16.01 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.63 0.65 . . . . 0.0 112.21 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -156.23 66.14 4.23 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.247 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.84 -175.56 0.79 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.979 2.453 . . . . 0.0 108.141 170.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 93.94 33.34 7.04 Favored Glycine 0 CA--C 1.527 0.839 0 O-C-N 121.108 -0.995 . . . . 0.0 111.213 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.93 -175.5 3.31 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 123.795 0.838 . . . . 0.0 109.014 -174.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -142.48 153.5 43.71 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 36.6 m-85 -131.72 148.72 52.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -138.73 118.53 13.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.98 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -75.01 148.56 39.77 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -128.45 156.18 43.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.933 0.873 . . . . 0.0 111.193 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 86.0 p -47.07 166.49 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 127.2 2.2 . . . . 0.0 116.806 -166.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.25 166.44 24.52 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 113.671 -1.604 . . . . 0.0 111.381 -174.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 89.4 p -163.86 156.14 17.36 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 123.577 0.751 . . . . 0.0 109.809 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 158.79 -163.63 33.24 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-O 121.335 0.408 . . . . 0.0 112.329 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -128.49 6.31 5.72 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.141 0.576 . . . . 0.0 111.402 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.9 m 102.86 -21.27 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 128.023 2.529 . . . . 0.0 111.885 173.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -111.12 4.83 19.66 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.95 0.795 . . . . 0.0 111.691 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.94 18.0 0.98 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 177.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -61.43 153.37 27.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.26 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 49.4 m -141.13 160.77 39.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.683 0.793 . . . . 0.0 109.436 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -144.95 170.26 16.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.7 OUTLIER -146.29 159.48 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.849 0.833 . . . . 0.0 110.664 173.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.0 tpt -144.49 148.25 34.29 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.2 p -134.87 173.63 11.49 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.5 t -150.44 165.2 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 CA-C-O 121.908 0.861 . . . . 0.0 110.381 -175.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 87.4 t -139.75 127.73 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 106.171 -1.788 . . . . 0.0 106.171 171.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.6 p -147.15 136.17 16.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 37.4 t70 52.72 14.83 0.45 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 98.65 -14.9 61.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 122.747 0.213 . . . . 0.0 112.675 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -77.26 172.79 12.71 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 123.043 0.537 . . . . 0.0 109.655 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -137.74 138.84 39.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.436 0.636 . . . . 0.0 110.828 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -137.04 162.22 33.93 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.383 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 34.8 tt0 -148.02 162.36 39.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -169.79 121.39 0.92 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 110.476 -1.05 . . . . 0.0 110.476 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 87.1 p -90.25 174.09 7.78 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 117.082 0.441 . . . . 0.0 110.25 175.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . 0.406 ' CA ' HD12 ' A' ' 210' ' ' LEU . . . 179.47 174.62 45.65 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.989 -0.445 . . . . 0.0 111.989 -176.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -81.75 -12.66 58.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.149 0.58 . . . . 0.0 111.877 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -155.36 166.24 34.15 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.95 -34.34 73.13 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.901 0.88 . . . . 0.0 112.553 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -69.34 -38.53 78.19 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 123.025 0.53 . . . . 0.0 110.894 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . 0.406 HD12 ' CA ' ' A' ' 205' ' ' GLY . 1.7 tm? -75.05 -37.02 61.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.529 0.732 . . . . 0.0 109.647 -175.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.28 77.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.792 175.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.2 tttp -67.67 -31.48 71.5 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.158 0.435 . . . . 0.0 110.058 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.47 66.68 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.129 0.422 . . . . 0.0 110.362 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -87.88 -45.31 10.38 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.934 0.334 . . . . 0.0 110.592 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.65 78.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.445 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -76.58 -53.48 8.0 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -42.51 -40.37 2.61 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 119.086 -0.483 . . . . 0.0 111.063 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 68.2 m -73.82 -38.9 64.42 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 111.407 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.95 -44.69 92.04 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.8 tt -59.21 -49.58 77.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -53.3 -59.96 3.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.6 m -65.93 -53.34 40.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 118.945 -0.55 . . . . 0.0 112.309 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 45.5 t -66.37 -23.14 31.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -174.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.449 ' CD2' HD13 ' A' ' 170' ' ' LEU . 2.3 m-30 -105.01 1.16 28.36 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.848 -175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.71 34.66 22.12 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.589 0.632 . . . . 0.0 111.157 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.42 -155.74 0.62 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.623 1.169 . . . . 0.0 109.068 -176.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -138.39 -55.34 0.63 Allowed 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 121.339 -0.851 . . . . 0.0 110.606 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 5.7 tp -168.4 23.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.402 0.681 . . . . 0.0 110.224 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.482 ' N ' HD12 ' A' ' 229' ' ' LEU . 6.0 mp 56.0 16.0 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.36 1.064 . . . . 0.0 111.742 -178.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 2.2 9.71 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.898 -0.501 . . . . 0.0 111.941 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -148.37 178.8 8.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.293 0.637 . . . . 0.0 110.332 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -140.65 31.69 1.85 Allowed 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 122.655 0.382 . . . . 0.0 110.982 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 64.3 m80 55.54 17.92 2.49 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.831 0.852 . . . . 0.0 112.206 -176.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -64.05 174.39 1.55 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.962 0.905 . . . . 0.0 111.008 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -151.59 165.82 33.11 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.554 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 80.8 t60 . . . . . 0 C--O 1.252 1.227 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.62 -177.845 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.173 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 O4'-C1'-N19 111.963 3.763 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.007 1 O4'-C1'-N19 112.225 4.025 . 0.765 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C4'-C3'-C2' 99.121 -3.579 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.854 1 O4'-C1'-N19 112.525 4.325 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C5'-C4'-O4' 113.251 2.894 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.839 -3.861 . 0.747 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.607 -3.093 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C4'-C3'-C2' 99.833 -2.867 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.163 2.963 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.308 0 C4'-C3'-C2' 99.111 -3.589 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C4'-C3'-C2' 99.092 -3.608 . 0.691 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.65 0 C4'-C3'-C2' 99.418 -3.282 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C4'-C3'-C2' 99.505 -3.195 . 0.754 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.637 -4.063 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 C4'-C3'-C2' 99.142 -3.558 . 0.657 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C4'-C3'-C2' 99.266 -3.434 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.015 0 C4'-C3'-C2' 98.965 -3.735 . 0.715 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 O4'-C1'-N19 111.134 2.934 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 C4'-C3'-C2' 99.143 -3.557 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.446 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.144 0 C4'-C3'-C2' 99.862 -2.838 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.446 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 98.809 -3.891 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 0 O4'-C1'-N19 112.157 3.957 . 0.681 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.496 0 C5'-C4'-C3' 110.549 -3.3 . 0.815 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.808 3.608 . 0.852 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 C4'-C3'-C2' 98.724 -3.976 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.284 1 C4'-C3'-C2' 98.584 -4.116 . 0.647 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.502 -3.198 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.482 -3.218 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.561 3.361 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 99.117 -3.583 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C4'-C3'-C2' 99.294 -3.406 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.837 0 C4'-C3'-C2' 98.991 -3.709 . 0.765 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 N19-C1'-C2' 108.367 -3.146 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.474 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.546 2.735 1 C4'-C3'-O3' 121.228 4.088 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.519 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.699 2 P-O3'-C3' 125.568 4.89 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.625 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.414 -3.241 1 C4'-C3'-C2' 98.601 -4.099 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.625 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.406 -3.895 2 N19-C1'-C2' 123.308 6.192 . 0.297 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 0 O4'-C1'-N19 111.032 2.832 . 0.372 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.623 0 C4'-C3'-C2' 98.815 -3.885 . 0.882 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.501 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.415 -3.146 0 C4'-C3'-C2' 99.111 -3.589 . 0.713 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.489 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-O4' 112.718 2.513 . 0.889 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C4'-C3'-C2' 99.242 -3.458 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C4'-C3'-C2' 99.24 -3.46 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.034 -3.666 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.082 0 C4'-C3'-C2' 98.839 -3.861 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.427 -3.273 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.831 1 C4'-C3'-C2' 98.432 -4.268 . 0.861 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-C3' 111.442 -2.705 . 0.848 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.191 1 O4'-C1'-N19 113.072 4.872 . 0.537 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.461 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 P--O5' 1.618 2.49 0 C5'-C4'-O4' 113.183 2.845 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.461 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 C4'-C3'-C2' 100.073 -2.627 . 0.789 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 O4'-C1'-N19 111.611 3.411 . 0.881 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 O4'-C1'-N19 112.087 3.887 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.562 0 O4'-C1'-N19 111.166 2.966 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.682 0 C4'-C3'-C2' 99.981 -2.719 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 C4'-C3'-C2' 99.793 -2.907 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 O4'-C1'-N19 111.902 3.702 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 O4'-C1'-N19 110.915 2.715 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.943 -3.757 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.374 0 C4'-C3'-C2' 99.251 -3.449 . 0.602 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.824 3.624 . 0.642 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 O4'-C1'-N19 111.097 2.897 . 0.849 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C4'-C3'-C2' 100.04 -2.66 . 0.64 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.274 -3.426 . 0.626 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.893 0 C4'-C3'-C2' 98.89 -3.81 . 0.727 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 1 C4'-C3'-C2' 97.836 -4.864 . 0.813 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 O4'-C1'-N19 112.177 3.977 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.783 0 C4'-C3'-C2' 99.114 -3.586 . 0.82 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.431 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.616 2.342 1 C4'-C3'-C2' 97.5 -5.2 . 0.708 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.431 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.628 0 O4'-C1'-N19 111.618 3.418 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.473 0.273 0 N-CA-C 112.148 0.018 . . . . 0.0 112.148 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.05 -169.77 42.73 Favored Glycine 0 C--N 1.34 0.8 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.84 1.74 0.06 OUTLIER 'Trans proline' 0 CA--C 1.53 0.311 1 C-N-CA 125.885 4.39 . . . . 0.0 114.849 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.0 t -121.43 -5.75 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 118.469 0.577 . . . . 0.0 110.147 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.7 tp -153.21 54.2 1.14 Allowed Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.347 0.659 . . . . 0.0 109.619 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.09 -14.77 18.73 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.28 2.653 . . . . 0.0 111.509 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -51.12 -34.98 33.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 122.824 0.449 . . . . 0.0 110.004 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -55.46 -63.76 1.06 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.708 0.403 . . . . 0.0 111.042 175.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.33 -34.23 70.39 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -56.19 8.47 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -173.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.9 ttm -64.87 -44.14 90.66 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.426 0.69 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -58.76 -47.0 86.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 123.335 0.397 . . . . 0.0 110.163 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.8 tp -57.83 -48.3 80.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 122.102 -0.374 . . . . 0.0 110.035 174.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -55.38 -32.85 62.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.195 0.521 . . . . 0.0 111.402 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.56 -55.58 6.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.959 0.504 . . . . 0.0 111.634 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.4 pt -64.49 -40.02 87.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.55 154.11 80.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -91.53 -22.3 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.401 3.401 . . . . 0.0 111.777 169.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.93 49.22 0.02 OUTLIER Glycine 0 CA--C 1.528 0.895 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.41 177.38 0.19 Allowed 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -171.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.672 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.4 mt-30 -134.23 135.05 42.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.026 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -104.48 135.08 46.57 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 171.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.33 147.76 49.25 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.728 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.9 tm? -106.86 143.32 35.12 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.471 0.708 . . . . 0.0 110.663 -172.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.599 ' H ' HD22 ' A' ' 24' ' ' LEU . 58.9 mt -142.22 177.56 8.16 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -175.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 24.2 t 47.39 -121.91 1.31 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.346 0.658 . . . . 0.0 110.701 -167.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.469 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.2 tp-100 73.82 83.8 0.11 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 127.053 2.141 . . . . 0.0 110.315 -174.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 t -166.78 163.67 16.49 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 157.08 -170.9 34.42 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.29 7.38 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 125.146 3.897 . . . . 0.0 113.521 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 31' ' ' VAL . 13.5 t 75.96 4.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 124.356 1.062 . . . . 0.0 112.162 175.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -137.99 -4.41 1.74 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.498 0.319 . . . . 0.0 110.968 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.19 63.06 17.28 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -75.0 141.83 27.13 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 124.438 3.425 . . . . 0.0 111.238 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.73 121.51 44.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.861 0.839 . . . . 0.0 110.656 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.469 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 48.6 m-85 -114.44 135.69 53.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -119.06 112.41 37.58 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 C-N-CA 119.184 -1.006 . . . . 0.0 108.709 173.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.728 ' HG2' HD23 ' A' ' 24' ' ' LEU . 32.7 mtp -100.54 135.16 42.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 31.3 p -122.55 135.48 54.65 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 106.573 -1.64 . . . . 0.0 106.573 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG2' HD23 ' A' ' 20' ' ' LEU . 11.3 p -116.86 140.28 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.284 -173.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -125.67 125.36 42.95 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.231 0.332 . . . . 0.0 110.296 -170.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.6 HG11 ' CE2' ' A' ' 69' ' ' PHE . 21.2 t -134.82 129.83 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 175.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 48.67 14.79 0.08 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 178.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 108.28 2.27 33.4 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 119.246 0.93 . . . . 0.0 112.411 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -104.5 128.02 52.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.2 t -121.67 134.74 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.2 m-85 -132.72 135.61 45.88 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -113.82 136.38 52.93 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 123.751 0.657 . . . . 0.0 111.508 -168.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.36 8.24 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -110.0 107.04 16.79 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 125.064 1.346 . . . . 0.0 110.958 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.98 163.55 25.05 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.342 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.15 136.9 20.71 Favored 'Trans proline' 0 N--CA 1.445 -1.332 0 N-CA-C 105.578 -2.509 . . . . 0.0 105.578 170.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p 65.49 167.68 0.19 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -176.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.03 -16.65 59.22 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 121.296 -0.878 . . . . 0.0 112.834 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -63.93 -72.38 0.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -56.92 -36.38 70.14 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.55 -59.71 4.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.621 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 6.9 pttm -61.67 -33.99 74.94 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 122.33 -0.231 . . . . 0.0 110.861 -177.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.52 -60.3 3.74 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 123.617 0.767 . . . . 0.0 109.925 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.53 ' CE1' ' HE2' ' A' ' 64' ' ' LYS . 6.7 t-80 -58.12 -42.29 85.46 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.165 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.41 -47.06 79.8 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.778 -0.192 . . . . 0.0 110.841 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.94 89.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.639 0.376 . . . . 0.0 111.644 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.5 -50.2 70.56 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.197 0.522 . . . . 0.0 111.158 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HE2' ' CE1' ' A' ' 60' ' ' HIS . 68.1 mttm -55.46 -59.85 4.24 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 178.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.55 -36.68 69.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.043 -179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.3 tp -55.97 -64.63 0.79 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.085 0.857 . . . . 0.0 109.637 172.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -57.52 -36.63 71.83 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.139 -172.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 56.3 m -69.06 -57.21 5.73 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.751 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.1 t80 -55.94 -26.93 50.1 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.878 1.271 . . . . 0.0 113.271 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.3 t -55.04 -18.52 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 119.122 -0.465 . . . . 0.0 111.358 174.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -91.23 -11.86 36.97 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.631 0.651 . . . . 0.0 111.767 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -152.26 53.76 1.14 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 118.388 0.54 . . . . 0.0 111.994 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.751 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 73.0 Cg_endo -68.45 -10.25 28.43 Favored 'Trans proline' 0 N--CA 1.452 -0.946 1 C-N-CA 125.544 4.163 . . . . 0.0 114.356 -175.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -160.74 -34.26 0.05 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -160.38 175.11 13.18 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.523 -0.736 . . . . 0.0 111.669 -175.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 m -70.77 21.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.449 1.5 . . . . 0.0 112.737 178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -71.56 18.54 0.07 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.974 0.909 . . . . 0.0 112.153 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -138.59 175.44 9.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.94 0.896 . . . . 0.0 109.929 179.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -146.47 166.96 24.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.728 0.411 . . . . 0.0 111.13 -175.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.86 171.41 17.8 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.999 0.52 . . . . 0.0 111.639 -178.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.28 -175.84 5.33 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.683 0.393 . . . . 0.0 110.399 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -145.39 172.5 13.1 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.363 0.665 . . . . 0.0 110.254 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -178.46 39.37 0.08 OUTLIER Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp180 -128.69 178.2 6.51 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.566 0.746 . . . . 0.0 110.823 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 72.9 p -72.68 26.16 0.06 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.86 1.264 . . . . 0.0 113.069 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 mp 55.66 29.22 13.28 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.232 0.613 . . . . 0.0 110.556 -174.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.4 t -144.32 175.39 10.13 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.228 0.611 . . . . 0.0 110.253 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.1 8.42 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.78 0.832 . . . . 0.0 111.099 -175.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -143.7 169.24 18.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.81 0.338 . . . . 0.0 111.431 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 48.7 p -142.81 175.0 10.16 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 125.159 1.384 . . . . 0.0 109.795 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -154.3 170.48 21.18 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.808 0.443 . . . . 0.0 110.164 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -151.54 176.97 10.8 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.809 0.444 . . . . 0.0 110.488 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.4 t -150.36 169.64 20.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.475 0.31 . . . . 0.0 110.591 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.3 p -153.96 178.26 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.14 0.576 . . . . 0.0 110.701 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.09 24.63 1.3 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.765 0.826 . . . . 0.0 110.496 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -144.68 178.41 8.0 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.136 0.574 . . . . 0.0 110.402 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -142.73 17.75 1.99 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.176 0.59 . . . . 0.0 110.992 -177.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -148.81 160.72 42.95 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 122.714 0.405 . . . . 0.0 109.924 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -87.87 155.7 52.78 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 122.833 0.453 . . . . 0.0 111.681 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -74.77 177.94 7.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.225 3.283 . . . . 0.0 111.553 175.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -147.97 171.08 16.36 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.928 0.491 . . . . 0.0 109.991 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -149.57 179.05 8.29 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 120.896 0.379 . . . . 0.0 110.917 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.1 tp -147.64 160.26 42.86 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -149.46 174.12 12.83 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.918 0.487 . . . . 0.0 110.742 -176.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -62.1 163.4 8.08 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.046 0.538 . . . . 0.0 111.608 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -174.72 179.65 45.89 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -146.34 171.75 14.53 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.945 0.498 . . . . 0.0 110.467 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -141.66 -177.15 5.04 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.6 0.76 . . . . 0.0 109.578 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 41.3 m -138.6 136.71 19.1 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.58 171.65 14.95 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.703 2.935 . . . . 0.0 111.531 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -153.5 174.82 13.91 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.408 0.683 . . . . 0.0 109.345 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.72 13.7 1.92 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -176.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.4 m -144.13 165.32 28.15 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.007 0.523 . . . . 0.0 110.407 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -159.51 161.63 26.79 Favored Pre-proline 0 N--CA 1.454 -0.252 0 C-N-CA 123.287 0.635 . . . . 0.0 110.094 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.66 166.05 3.05 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.467 2.778 . . . . 0.0 112.157 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.85 -32.57 30.19 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.636 2.89 . . . . 0.0 112.436 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -164.07 -44.37 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.658 0.783 . . . . 0.0 109.778 173.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.401 ' H ' ' H ' ' A' ' 119' ' ' VAL . 41.8 t80 -166.16 -20.76 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.733 0.813 . . . . 0.0 110.304 176.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.401 ' H ' ' H ' ' A' ' 118' ' ' TYR . 35.9 m -144.39 173.27 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 124.417 1.087 . . . . 0.0 109.861 -179.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -175.32 6.96 0.03 OUTLIER Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.505 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 17.8 t -155.5 176.5 12.51 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.071 0.935 . . . . 0.0 110.4 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -149.45 9.06 0.72 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.29 0.636 . . . . 0.0 111.559 -178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.7 174.32 46.79 Favored Glycine 0 CA--C 1.531 1.092 0 O-C-N 121.958 -0.464 . . . . 0.0 112.621 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -72.64 -0.05 11.94 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -151.3 156.35 40.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.6 m -151.47 175.12 12.6 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.776 0.831 . . . . 0.0 109.639 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -150.98 169.55 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.759 0.423 . . . . 0.0 110.254 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 84.4 p -149.56 4.96 0.6 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.8 p -155.09 171.26 20.07 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.131 0.572 . . . . 0.0 110.266 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.8 t -69.37 161.5 29.25 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.805 0.442 . . . . 0.0 111.185 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.59 -6.45 0.08 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.75 -0.472 . . . . 0.0 111.962 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.04 169.31 21.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.755 0.822 . . . . 0.0 108.821 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 5.2 t 59.59 4.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.693 1.197 . . . . 0.0 112.018 -176.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 83.1 p -69.77 8.8 0.61 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.351 1.06 . . . . 0.0 112.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 19.1 tp -138.24 10.39 2.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.897 0.879 . . . . 0.0 110.438 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.7 m -138.32 12.74 2.8 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.068 0.947 . . . . 0.0 111.26 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -143.0 8.94 1.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.069 0.548 . . . . 0.0 110.794 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 45.8 m -61.81 160.32 28.95 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.277 0.631 . . . . 0.0 111.834 -178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.07 158.64 1.27 Allowed 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.459 3.44 . . . . 0.0 114.7 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.414 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 48.1 t -55.45 -39.28 76.14 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 140' ' ' VAL . 72.0 Cg_exo -53.25 0.35 0.06 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 124.157 3.238 . . . . 0.0 115.481 172.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -128.13 -3.45 5.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.078 0.853 . . . . 0.0 111.777 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 50.7 m -77.0 7.64 4.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.839 0.456 . . . . 0.0 112.097 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.7 pt? -140.67 9.35 2.2 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 122.876 0.47 . . . . 0.0 112.188 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 11.7 t -147.93 -4.35 0.49 Allowed 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.047 -0.408 . . . . 0.0 111.312 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.465 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 57.1 tp60 -150.99 42.53 0.24 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.068 0.547 . . . . 0.0 110.835 177.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 146' ' ' GLN . 98.4 Cg_endo -71.85 169.67 20.66 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.908 2.405 . . . . 0.0 111.17 -178.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.68 166.39 0.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 124.53 3.487 . . . . 0.0 113.418 174.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.91 154.05 69.85 Favored Pre-proline 0 N--CA 1.455 -0.213 0 C-N-CA 122.613 0.365 . . . . 0.0 110.69 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.86 176.37 9.96 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.849 3.033 . . . . 0.0 111.02 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 37.3 mm -137.79 137.74 22.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.96 159.64 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.655 2.903 . . . . 0.0 112.747 176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.64 163.35 39.28 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.203 2.602 . . . . 0.0 110.852 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.83 166.21 30.21 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.424 2.749 . . . . 0.0 111.713 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -155.65 155.48 29.64 Favored Pre-proline 0 CA--C 1.532 0.25 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.75 147.3 39.61 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.796 2.331 . . . . 0.0 110.686 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.9 167.4 23.76 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.654 2.902 . . . . 0.0 110.839 176.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.02 161.52 6.43 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.355 2.703 . . . . 0.0 112.379 173.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 92.0 p -149.79 8.13 0.66 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 122.704 0.402 . . . . 0.0 111.976 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -178.12 17.37 0.03 OUTLIER Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.664 -0.52 . . . . 0.0 111.899 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -146.01 17.91 1.41 Allowed 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 117.708 0.754 . . . . 0.0 111.143 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -57.66 147.76 59.92 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 122.792 0.437 . . . . 0.0 111.014 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 166' ' ' ILE . 73.9 Cg_endo -73.15 -14.57 25.87 Favored 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 124.536 3.49 . . . . 0.0 111.287 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -60.09 -37.91 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 122.666 0.386 . . . . 0.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 56.4 mtp -84.52 -38.68 19.75 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.31 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 163' ' ' PRO . 47.2 mt -52.39 -50.58 37.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.174 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -63.83 -48.69 75.8 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.289 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -73.12 14.53 0.29 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.225 0.61 . . . . 0.0 112.014 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -133.27 -27.18 1.61 Allowed 'General case' 0 C--N 1.343 0.303 0 O-C-N 121.677 -0.64 . . . . 0.0 111.659 173.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.415 HD13 ' CD2' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -81.86 -38.09 25.96 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 176.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -158.73 75.88 3.42 Favored Pre-proline 0 N--CA 1.454 -0.226 0 O-C-N 123.196 0.31 . . . . 0.0 110.625 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.21 -176.15 1.51 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.911 2.408 . . . . 0.0 108.914 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 100.06 38.77 3.49 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 121.472 -0.394 . . . . 0.0 112.531 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 -174.18 3.15 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.233 0.613 . . . . 0.0 110.183 -175.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 47.1 mtmt -142.01 153.41 44.24 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.435 ' CD1' HG13 ' A' ' 194' ' ' VAL . 28.5 m-85 -130.36 156.6 44.44 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -136.14 153.27 51.33 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.727 172.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . 0.58 ' C ' HD22 ' A' ' 179' ' ' LEU . 7.0 t80 -104.53 136.43 44.09 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.58 HD22 ' C ' ' A' ' 178' ' ' PHE . 3.7 mm? -123.3 159.71 28.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -173.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 15.1 m -45.68 166.62 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.872 2.069 . . . . 0.0 116.423 -166.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.94 174.26 10.67 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.512 -173.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 34.8 t -153.08 143.47 22.53 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.275 0.63 . . . . 0.0 109.739 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.32 -170.78 17.24 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -131.79 -59.04 0.96 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 117.23 0.515 . . . . 0.0 110.507 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.1 p -172.36 -35.16 0.01 OUTLIER 'General case' 0 C--O 1.23 0.071 0 C-N-CA 122.789 0.436 . . . . 0.0 110.563 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -67.65 -19.42 65.2 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.343 175.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -159.53 147.8 17.53 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.708 -1.589 . . . . 0.0 106.708 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -160.52 156.71 26.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 117.699 0.227 . . . . 0.0 111.006 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 59.3 p -148.2 160.09 43.29 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.579 0.752 . . . . 0.0 109.075 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -147.88 174.37 11.93 Favored 'General case' 0 CA--C 1.514 -0.428 0 O-C-N 123.885 0.74 . . . . 0.0 109.021 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.13 156.74 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-O 121.755 0.788 . . . . 0.0 110.858 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 86.4 mmm -125.17 159.03 32.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 173.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 45.4 m -140.37 171.19 14.49 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.435 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.7 t -149.48 162.41 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 121.141 0.496 . . . . 0.0 109.742 -172.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 86.8 t -137.51 128.3 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.988 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' A' ' 198' ' ' GLY . 2.5 p -150.65 133.32 6.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -178.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.6 t70 56.52 -0.93 0.05 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 116.6 -17.86 13.52 Favored Glycine 0 C--N 1.343 0.954 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -74.25 172.29 12.08 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -135.92 138.38 42.33 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.625 0.25 . . . . 0.0 110.903 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -132.74 164.45 26.76 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 124.169 0.918 . . . . 0.0 111.652 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 31.9 tt0 -151.7 155.95 39.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.3 132.65 2.63 Favored Glycine 0 C--N 1.34 0.754 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 84.1 p -102.08 170.76 7.91 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.489 0.644 . . . . 0.0 112.443 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.29 174.87 46.63 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.48 -12.67 59.87 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.976 0.388 . . . . 0.0 111.36 178.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -150.53 166.86 28.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.65 -32.71 74.49 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . 0.403 ' HE3' ' P ' ' B' ' 292' ' ' ' C' . 55.3 mtpt -73.7 -35.4 65.15 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 118.42 0.555 . . . . 0.0 111.474 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -72.51 -37.63 68.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -63.63 -42.15 98.18 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.537 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -68.48 -32.86 73.16 Favored 'General case' 0 C--O 1.226 -0.171 0 O-C-N 121.728 -0.607 . . . . 0.0 110.546 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.65 -27.64 67.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.262 0.483 . . . . 0.0 110.1 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -82.63 -49.82 9.42 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.44 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.69 -32.8 72.02 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 117.579 0.172 . . . . 0.0 111.228 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -75.9 -56.65 4.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 13.9 tm0? -41.94 -36.81 1.17 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 170.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 66.5 m -72.41 -43.79 63.38 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.632 0.651 . . . . 0.0 110.626 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.25 98.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.413 HD23 ' C ' ' A' ' 220' ' ' LEU . 5.6 tt -61.16 -56.66 18.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 122.029 -0.419 . . . . 0.0 110.056 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.17 -47.59 71.85 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 60.2 m -77.46 -38.76 48.64 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 50.7 t -81.74 -26.99 9.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 118.987 0.812 . . . . 0.0 109.993 -173.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' A' ' 170' ' ' LEU . 3.4 m-30 -97.72 -3.09 39.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.602 -177.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 56.06 36.86 28.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.26 0.624 . . . . 0.0 111.84 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 81.8 mt -136.62 -165.73 1.78 Allowed 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.344 1.058 . . . . 0.0 110.401 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.603 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 36.8 t-80 -144.95 -168.78 3.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.427 0.691 . . . . 0.0 109.255 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.603 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.0 tp -123.43 17.65 9.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.743 0.417 . . . . 0.0 111.188 -176.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 231' ' ' HIS . 64.9 mt 51.73 29.59 5.93 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.868 1.267 . . . . 0.0 113.943 176.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.51 9.32 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.558 0.743 . . . . 0.0 111.985 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 229' ' ' LEU . 11.7 p80 -137.26 7.23 2.86 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.376 1.07 . . . . 0.0 111.097 -178.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -142.97 1.35 1.27 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.179 0.592 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -151.21 154.75 37.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -157.88 -174.77 5.01 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -142.01 13.74 2.06 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.021 0.529 . . . . 0.0 112.354 -177.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.697 -179.902 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.488 0 C4'-C3'-C2' 99.282 -3.418 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C4'-C3'-C2' 99.157 -3.543 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 0 C4'-C3'-C2' 98.829 -3.871 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.253 0 C4'-C3'-C2' 99.527 -3.173 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.742 1 O4'-C1'-N19 112.428 4.228 . 0.653 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 98.95 -3.75 . 0.748 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C4'-C3'-C2' 98.897 -3.803 . 0.577 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 99.335 -3.365 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.33 0 C4'-C3'-C2' 99.577 -3.123 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C4'-C3'-C2' 99.9 -2.8 . 0.315 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 O4'-C1'-N19 111.569 3.369 . 0.873 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.659 0 C4'-C3'-C2' 99.715 -2.985 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 C4'-C3'-C2' 99.382 -3.318 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.728 -2.972 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 99.384 -3.316 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.32 -3.38 . 0.706 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C4'-C3'-C2' 99.532 -3.168 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.584 0 C4'-C3'-C2' 98.919 -3.781 . 0.79 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C4'-C3'-C2' 100.229 -2.471 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.454 -3.246 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.458 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.736 0 C4'-C3'-C2' 99.52 -3.18 . 0.826 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.458 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.369 0 C4'-C3'-C2' 99.911 -2.789 . 0.8 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C4'-C3'-C2' 99.048 -3.652 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.69 -3.01 . 0.816 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 O4'-C1'-N19 111.033 2.833 . 0.869 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.272 -3.428 . 0.853 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.676 0 C4'-C3'-C2' 99.169 -3.531 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.245 -3.455 . 0.873 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.244 -3.456 . 0.734 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.285 3.085 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C5'-C4'-O4' 113.99 3.422 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.744 1 C4'-C3'-C2' 98.321 -4.379 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.694 1 C4'-C3'-C2' 98.636 -4.064 . 0.676 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . 0.448 " H1'" ' H61' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.39 0 N19-C1'-C2' 108.306 -3.184 . 0.718 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.405 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O5'--C5' 1.404 -2.269 1 C4'-C3'-O3' 121.357 4.137 . 0.346 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.437 ' C6 ' H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.414 -3.259 1 P-O3'-C3' 125.818 5.098 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.422 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 P--O5' 1.627 3.407 1 C4'-C3'-C2' 97.902 -4.798 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.448 ' H61' " H1'" ' B' ' 270' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C4'-C3'-C2' 99.541 -3.159 . 0.66 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C4'-C3'-C2' 99.028 -3.672 . 0.646 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 1 C4'-C3'-C2' 98.439 -4.261 . 0.746 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.621 H5'' ' HE3' ' A' ' 58' ' ' LYS . . . . . . . . 0 O4'--C4' 1.416 -3.091 0 O4'-C1'-N19 111.759 3.559 . 0.575 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.86 0 C4'-C3'-C2' 99.404 -3.296 . 0.916 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.889 1 C4'-C3'-C2' 98.497 -4.203 . 0.79 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.327 -3.373 . 0.753 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.808 -3.892 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.122 0 C4'-C3'-C2' 98.831 -3.869 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.984 0 C4'-C3'-C2' 100.005 -2.695 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 O4'-C1'-N19 111.669 3.469 . 0.901 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.051 0 O4'-C1'-N19 110.335 2.135 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 O4'-C1'-N19 113.049 4.849 . 0.565 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.984 0 C4'-C3'-C2' 99.495 -3.205 . 0.571 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C4'-C3'-C2' 100.341 -2.359 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C4'-C3'-C2' 99.35 -3.35 . 0.841 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.498 0 O4'-C1'-N19 111.481 3.281 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 2.297 0 O4'-C1'-N19 111.434 3.234 . 0.543 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.409 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 P--O5' 1.617 2.443 0 O4'-C1'-N19 110.712 2.512 . 0.6 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.409 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 O4'-C1'-N19 111.601 3.401 . 0.643 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.519 -4.181 . 0.681 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 C4'-C3'-C2' 99.198 -3.502 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.13 0 C4'-C3'-C2' 99.628 -3.072 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.416 0 C4'-C3'-C2' 98.933 -3.767 . 0.661 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C4'-C3'-C2' 99.371 -3.329 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.835 0 C4'-C3'-C2' 99.813 -2.887 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.522 0 C4'-C3'-C2' 100.254 -2.446 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.91 0 O4'-C1'-N19 111.48 3.28 . 0.615 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 O4'-C1'-N19 111.626 3.426 . 0.716 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.016 1 C4'-C3'-C2' 98.443 -4.257 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 O4'-C1'-N19 112.084 3.884 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C4'-C3'-C2' 99.478 -3.222 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.454 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 P--O5' 1.62 2.739 1 C4'-C3'-C2' 97.573 -5.127 . 0.747 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.454 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 112.157 3.957 . 0.721 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo . . . . . 0 C--O 1.23 0.098 0 CA-C-O 120.632 0.18 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.83 54.69 0.21 Allowed Glycine 0 CA--C 1.53 1.014 0 CA-C-O 119.159 -0.8 . . . . 0.0 111.888 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.41 172.48 14.1 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 124.141 3.227 . . . . 0.0 110.936 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -144.07 174.34 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.254 1.022 . . . . 0.0 109.929 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.403 ' N ' ' HD3' ' A' ' 6' ' ' PRO . 1.9 tt -144.89 62.93 9.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 C-N-CA 122.84 0.456 . . . . 0.0 109.909 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.403 ' HD3' ' N ' ' A' ' 5' ' ' LEU . 72.1 Cg_exo -52.17 -28.08 32.18 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.68 2.92 . . . . 0.0 114.17 -175.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -54.26 -32.32 55.84 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.169 -0.332 . . . . 0.0 110.96 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -56.39 -63.16 1.28 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.27 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.56 70.09 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 123.288 0.635 . . . . 0.0 111.855 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.414 HD23 " O2'" ' B' ' 277' ' ' ' G' . 0.6 OUTLIER -74.6 -52.71 11.01 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.269 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.4 -47.69 83.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 176.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -56.85 -44.35 82.06 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 122.144 -0.348 . . . . 0.0 110.435 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.493 HD12 HD11 ' A' ' 16' ' ' ILE . 47.5 tp -56.43 -51.95 66.47 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 174.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -55.51 -38.91 69.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.489 0.316 . . . . 0.0 111.273 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.23 -53.23 47.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 111.31 0.115 . . . . 0.0 111.31 176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 13' ' ' LEU . 1.9 pp -70.06 -19.0 22.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.456 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.1 ttmt -41.7 93.3 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.487 0 C-N-CA 127.487 2.315 . . . . 0.0 112.996 -177.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 34.7 Cg_endo -85.0 5.8 6.06 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.087 3.191 . . . . 0.0 110.468 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.2 26.84 6.44 Favored Glycine 0 C--N 1.337 0.62 0 N-CA-C 110.013 -1.235 . . . . 0.0 110.013 -173.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -61.19 178.5 0.26 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.08 1.352 . . . . 0.0 113.583 -179.852 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.621 ' N ' HD22 ' A' ' 20' ' ' LEU . 28.8 mt-30 -131.72 135.63 46.98 Favored 'General case' 0 C--N 1.345 0.38 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -104.49 134.96 46.81 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.023 172.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 19.0 ptp -135.23 148.13 49.52 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.067 0.461 . . . . 0.0 110.229 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.646 HD23 ' HG2' ' A' ' 38' ' ' MET . 3.1 tm? -105.92 141.47 37.27 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.798 0.839 . . . . 0.0 110.034 -177.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 24' ' ' LEU . 77.9 mt -140.72 -179.79 6.25 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.535 ' CB ' HG22 ' A' ' 37' ' ' VAL . 22.6 t 47.99 -119.92 1.16 Allowed 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 122.903 0.481 . . . . 0.0 111.4 -167.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.409 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.4 tp-100 71.04 82.37 0.15 Allowed 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 127.175 2.19 . . . . 0.0 109.833 -171.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.6 t -165.75 171.36 12.98 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.34 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 121.01 -172.04 15.03 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 108.946 -1.662 . . . . 0.0 108.946 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.77 166.34 29.18 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.276 1.984 . . . . 0.0 109.162 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.453 HG21 " H1'" ' B' ' 287' ' ' ' U' . 1.7 p -77.24 2.25 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -172.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -132.53 -4.53 3.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.614 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.35 59.0 11.4 Favored Pre-proline 0 C--O 1.235 0.32 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 168.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.73 138.33 23.59 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 124.269 3.312 . . . . 0.0 109.727 -178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.3 tm? -105.02 121.62 44.16 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.461 0.648 . . . . 0.0 110.859 -178.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.409 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 47.4 m-85 -115.71 136.87 52.64 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.535 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -121.71 112.0 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.816 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.176 175.157 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.646 ' HG2' HD23 ' A' ' 24' ' ' LEU . 17.6 mtp -98.65 133.05 43.53 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.2 p -126.31 135.24 51.26 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.558 HG23 HD23 ' A' ' 20' ' ' LEU . 9.0 p -109.22 150.27 12.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 -177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -133.93 117.73 17.09 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 -169.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.3 t -135.74 127.43 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 O-C-N 124.587 1.18 . . . . 0.0 109.248 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 53.32 2.86 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.85 -1.33 13.53 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 118.707 0.685 . . . . 0.0 111.772 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -103.62 130.72 51.11 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 45.0 t -122.24 134.21 66.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -177.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 55.5 m-85 -131.48 133.7 45.4 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -116.77 134.96 54.15 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.753 0.658 . . . . 0.0 111.23 -168.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 37' ' ' VAL . . . -124.96 134.89 9.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 55.4 p -112.27 105.07 13.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.917 1.287 . . . . 0.0 111.248 -170.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.88 158.32 25.65 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-N 116.146 -0.479 . . . . 0.0 113.337 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.64 136.27 25.44 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.016 2.478 . . . . 0.0 107.424 166.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 55' ' ' LYS . 16.7 m 64.8 143.86 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.187 0.994 . . . . 0.0 110.699 -172.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -63.66 -26.57 68.73 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.262 -0.899 . . . . 0.0 113.167 -172.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 53' ' ' THR . 88.0 tttt -56.38 -65.84 0.54 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.167 0.587 . . . . 0.0 112.522 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -55.05 -42.42 72.66 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.794 0.838 . . . . 0.0 112.203 -177.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.94 38.25 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.021 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -57.05 -39.34 74.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.542 -0.266 . . . . 0.0 111.436 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -58.35 8.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.483 0.713 . . . . 0.0 110.199 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.3 -45.33 76.25 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 177.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.98 -46.69 78.6 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.02 -53.85 51.96 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.752 0.821 . . . . 0.0 110.299 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.3 -56.12 21.62 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 123.491 0.716 . . . . 0.0 111.156 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -56.14 -61.63 2.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.01 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.85 -43.75 81.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.567 -177.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.1 tp -49.57 -69.45 0.12 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 71.5 mtt85 -61.12 -25.3 66.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.083 -173.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m -71.13 -64.71 0.86 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -76.96 -14.99 59.79 Favored 'General case' 0 C--N 1.348 0.531 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.807 -171.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 m -55.68 -14.49 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 121.53 1.968 . . . . 0.0 112.569 174.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -86.18 -14.01 45.29 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 123.111 0.564 . . . . 0.0 111.101 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -143.9 64.55 13.1 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 124.703 1.201 . . . . 0.0 110.075 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.37 4.03 4.23 Favored 'Trans proline' 0 N--CA 1.453 -0.896 1 C-N-CA 125.478 4.118 . . . . 0.0 112.931 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -145.95 167.92 22.13 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.229 0.612 . . . . 0.0 109.498 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.62 11.66 1.12 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.687 0.395 . . . . 0.0 111.877 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 48.8 m -61.26 167.08 3.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 117.999 0.363 . . . . 0.0 110.839 178.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -60.46 156.42 16.18 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 122.064 -0.398 . . . . 0.0 111.693 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.56 176.02 12.54 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.656 0.382 . . . . 0.0 110.745 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -148.34 7.44 0.78 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.56 0.744 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.45 169.49 10.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.442 0.697 . . . . 0.0 110.584 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.0 176.65 10.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.433 0.693 . . . . 0.0 109.767 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 72.0 mtm -144.79 172.23 13.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.376 0.67 . . . . 0.0 110.216 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -156.46 11.35 0.31 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -155.33 161.26 41.11 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -178.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.5 t -149.18 174.15 12.67 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.799 0.44 . . . . 0.0 110.455 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.0 tp -145.89 16.54 1.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.848 0.859 . . . . 0.0 109.354 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 m -142.22 162.35 35.69 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.472 0.709 . . . . 0.0 110.753 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -71.15 150.66 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 122.74 0.416 . . . . 0.0 111.279 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.0 p-10 -146.19 9.94 1.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.671 0.788 . . . . 0.0 111.594 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.9 p -144.96 -175.44 4.69 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.562 1.145 . . . . 0.0 109.286 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -146.11 172.67 13.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.483 0.659 . . . . 0.0 111.364 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -144.29 8.75 1.4 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.272 0.629 . . . . 0.0 111.242 -178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.3 m -59.48 158.62 9.39 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.973 0.909 . . . . 0.0 110.481 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 81.1 p -149.21 171.2 16.85 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.929 0.491 . . . . 0.0 109.822 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -62.04 161.06 11.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.141 0.496 . . . . 0.0 111.652 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -153.99 169.04 24.45 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.63 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -156.07 165.17 37.21 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.667 0.387 . . . . 0.0 110.521 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -77.66 174.51 10.86 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.7 0.286 . . . . 0.0 110.784 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -142.84 154.75 62.71 Favored Pre-proline 0 C--O 1.233 0.236 0 C-N-CA 123.499 0.72 . . . . 0.0 110.063 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.9 164.28 36.18 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.474 2.783 . . . . 0.0 111.675 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -150.27 7.94 0.61 Allowed 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.227 0.611 . . . . 0.0 111.437 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 42.3 p -143.32 174.37 10.79 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 124.052 0.941 . . . . 0.0 110.24 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.638 HD13 ' H ' ' A' ' 104' ' ' PHE . 0.1 OUTLIER -148.45 158.48 44.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.321 0.648 . . . . 0.0 109.585 179.385 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.638 ' H ' HD13 ' A' ' 103' ' ' LEU . 72.6 m-85 -70.9 -177.44 1.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.873 0.869 . . . . 0.0 110.42 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -138.23 170.38 16.14 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.529 0.732 . . . . 0.0 110.221 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.42 27.58 0.06 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -144.2 179.72 7.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.769 0.828 . . . . 0.0 109.941 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -143.22 169.05 18.35 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.393 0.616 . . . . 0.0 111.54 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.3 p -66.32 154.38 90.6 Favored Pre-proline 0 CA--C 1.53 0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.698 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -73.66 6.29 2.88 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.433 3.422 . . . . 0.0 111.908 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -148.06 178.22 8.72 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.671 0.388 . . . . 0.0 110.244 -178.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -146.97 154.95 41.86 Favored 'General case' 0 CA--C 1.526 0.055 0 C-N-CA 123.473 0.709 . . . . 0.0 109.214 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.4 p -148.97 12.27 0.85 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -177.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.429 ' N ' ' CD ' ' A' ' 115' ' ' PRO . 8.1 tp10 -140.04 47.02 1.1 Allowed Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 122.283 0.233 . . . . 0.0 111.444 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 114' ' ' GLU . 88.2 Cg_endo -71.77 168.65 23.2 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.149 1.9 . . . . 0.0 110.454 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.73 160.66 1.67 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 124.409 3.406 . . . . 0.0 112.842 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -154.15 174.4 14.79 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.716 0.406 . . . . 0.0 110.077 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -139.29 175.36 9.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 122.828 0.451 . . . . 0.0 111.127 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.8 m -136.14 19.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 C-N-CA 123.652 0.781 . . . . 0.0 111.693 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.44 -178.56 31.61 Favored Glycine 0 C--N 1.337 0.586 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 97.6 p -146.96 -175.28 4.75 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.687 0.795 . . . . 0.0 109.907 -178.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -138.83 1.71 2.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 172.69 171.85 37.86 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -151.23 3.99 0.45 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.73 0.412 . . . . 0.0 110.945 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -144.72 6.63 1.23 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.286 0.634 . . . . 0.0 110.877 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 86.1 p -155.26 165.89 35.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.281 0.632 . . . . 0.0 109.964 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -154.92 172.86 17.36 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.978 0.418 . . . . 0.0 111.076 -178.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 70.6 p -157.23 174.12 15.93 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.09 0.956 . . . . 0.0 110.116 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 49.3 m -63.18 162.62 11.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.733 0.413 . . . . 0.0 110.301 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.3 p -154.47 172.53 17.63 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.096 0.558 . . . . 0.0 110.964 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.73 10.52 0.02 OUTLIER Glycine 0 CA--C 1.531 1.054 0 CA-C-O 119.546 -0.585 . . . . 0.0 112.423 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -147.42 6.97 0.86 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.893 0.846 . . . . 0.0 111.403 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 135' ' ' LEU . 9.9 p -151.1 163.74 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 C-N-CA 123.107 0.563 . . . . 0.0 110.102 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -145.89 25.98 1.26 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 122.807 0.443 . . . . 0.0 111.218 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.404 ' H ' HG22 ' A' ' 133' ' ' VAL . 4.0 pp -59.72 -9.97 3.27 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.204 0.602 . . . . 0.0 112.488 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.6 m -74.45 13.3 0.62 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.807 0.843 . . . . 0.0 111.828 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -137.67 26.33 2.81 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.502 1.121 . . . . 0.0 110.253 -176.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 53.0 m -133.22 49.2 4.07 Favored Pre-proline 0 CA--C 1.534 0.33 0 C-N-CA 123.809 0.844 . . . . 0.0 111.203 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -70.62 174.34 10.4 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.737 2.958 . . . . 0.0 111.042 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 44.6 t -141.24 142.99 28.94 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.84 156.69 1.23 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 124.679 3.586 . . . . 0.0 113.559 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.33 20.85 1.21 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.913 0.485 . . . . 0.0 111.37 -176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.9 m -134.58 13.78 3.74 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 112.122 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 56.7 tp -73.57 -15.53 61.28 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.247 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p 44.45 22.67 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.938 1.695 . . . . 0.0 114.594 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -154.31 141.9 13.8 Favored Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 121.532 -0.73 . . . . 0.0 109.444 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.1 163.23 2.31 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.542 2.828 . . . . 0.0 111.978 174.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.44 166.58 27.96 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.794 2.996 . . . . 0.0 110.285 176.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.05 155.88 85.87 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 122.397 -0.189 . . . . 0.0 110.699 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.82 164.32 2.45 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.5 3.466 . . . . 0.0 112.489 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . 0.408 ' HA ' ' HD3' ' A' ' 152' ' ' PRO . 15.2 tt -152.82 140.31 13.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 151' ' ' ILE . 67.8 Cg_exo -54.73 164.99 2.78 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.812 3.008 . . . . 0.0 112.025 174.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -52.22 160.24 3.51 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.651 2.901 . . . . 0.0 111.964 175.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -71.76 1.83 5.33 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.825 3.017 . . . . 0.0 112.335 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -134.41 157.48 77.33 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 124.096 0.958 . . . . 0.0 109.642 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 74.7 Cg_exo -52.48 141.28 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.855 3.037 . . . . 0.0 113.061 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 156' ' ' PRO . 50.6 Cg_exo -54.26 159.9 7.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 124.283 3.322 . . . . 0.0 112.324 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -74.6 -11.63 22.3 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.026 3.151 . . . . 0.0 111.996 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 20.0 t -158.96 167.86 28.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.914 0.885 . . . . 0.0 109.629 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 176.73 -174.83 47.32 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 120.916 0.176 . . . . 0.0 112.675 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -149.8 174.75 12.29 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.802 1.641 . . . . 0.0 108.358 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -138.19 138.84 23.86 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -176.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.414 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 61.7 Cg_endo -83.16 -5.9 11.17 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.377 3.385 . . . . 0.0 111.612 176.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 85.4 t -60.79 -40.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.341 0.199 0 C-N-CA 123.075 0.55 . . . . 0.0 111.832 -177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 60.7 tpp -78.86 -47.82 15.84 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.995 -0.441 . . . . 0.0 110.358 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.414 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 8.9 pt -57.68 -38.47 64.93 Favored 'Isoleucine or valine' 0 C--N 1.343 0.315 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.344 -179.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.9 tt -66.59 -51.58 54.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 174.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.15 14.39 0.31 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -139.76 -4.01 1.43 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.636 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 166' ' ' ILE . 0.8 OUTLIER -99.71 -35.46 9.8 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.455 1.025 . . . . 0.0 109.54 173.276 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -157.52 70.29 4.29 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 110.705 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.03 -174.68 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.165 2.577 . . . . 0.0 109.905 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 98.99 38.1 3.94 Favored Glycine 0 C--N 1.34 0.79 0 O-C-N 121.877 -0.514 . . . . 0.0 112.204 -175.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.23 -176.1 3.7 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-O 121.69 0.757 . . . . 0.0 110.43 -177.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -142.49 154.44 44.52 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.482 ' CD1' HG13 ' A' ' 194' ' ' VAL . 31.1 m-85 -131.41 150.76 52.02 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -139.7 119.1 12.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.432 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -76.08 150.23 37.31 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -130.89 156.02 45.75 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.905 0.859 . . . . 0.0 109.736 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 21.6 m -47.42 175.35 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 127.769 2.428 . . . . 0.0 116.289 -169.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.83 168.52 14.33 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 111.52 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 33.8 t -154.55 162.3 41.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.157 0.583 . . . . 0.0 110.344 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 93.24 173.49 40.4 Favored Glycine 0 C--N 1.338 0.655 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.44 167.99 18.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.194 0.521 . . . . 0.0 109.762 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 26.3 m -66.7 -0.3 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -174.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -123.05 8.26 9.25 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.958 0.344 . . . . 0.0 110.988 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.05 22.53 1.22 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -61.52 158.98 13.8 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.766 1.226 . . . . 0.0 112.558 -171.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 52.3 m -146.31 159.72 42.97 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.885 0.874 . . . . 0.0 109.03 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -146.93 168.87 20.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.417 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.6 OUTLIER -146.67 158.64 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-O 122.093 0.949 . . . . 0.0 111.246 175.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.3 tpt -143.25 142.9 31.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -174.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 62.4 p -129.77 174.49 9.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.999 0.428 . . . . 0.0 110.806 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.482 HG13 ' CD1' ' A' ' 176' ' ' TYR . 1.5 t -151.19 161.14 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-O 121.631 0.729 . . . . 0.0 109.848 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.1 t -137.48 130.53 43.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 168.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.431 HG13 HG21 ' A' ' 223' ' ' VAL . 2.4 p -149.89 133.8 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.5 t70 54.95 -2.09 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.428 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 118.81 -18.35 10.66 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -70.9 169.5 14.62 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 109.209 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -137.91 135.53 36.18 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -134.28 162.89 30.92 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.435 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 37.9 tt0 -151.38 159.07 44.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -165.79 129.81 2.02 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 84.4 p -97.59 169.22 9.86 Favored 'General case' 0 C--N 1.338 0.088 0 O-C-N 122.215 -0.579 . . . . 0.0 111.28 175.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -174.02 170.7 43.85 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 112.351 -0.3 . . . . 0.0 112.351 -176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -73.75 -13.2 60.92 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 176.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -151.42 159.86 44.02 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -68.6 -21.31 64.51 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -69.75 -44.23 70.64 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.55 -0.719 . . . . 0.0 109.808 177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.17 -38.19 81.81 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.811 0.845 . . . . 0.0 109.136 -178.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -56.31 -46.15 79.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 123.919 0.762 . . . . 0.0 110.775 176.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -68.73 -36.46 78.44 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.457 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.44 -28.93 70.01 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.763 0.711 . . . . 0.0 110.136 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -82.92 -51.23 7.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.572 0.349 . . . . 0.0 110.181 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -60.83 -33.65 73.37 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 122.158 -0.339 . . . . 0.0 111.616 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -72.43 -56.4 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -38.31 -42.63 0.73 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 168.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 71.2 m -71.93 -40.19 68.92 Favored 'General case' 0 N--CA 1.461 0.101 0 CA-C-N 119.65 1.114 . . . . 0.0 110.656 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.38 -45.88 85.75 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.04 0.136 . . . . 0.0 110.676 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 -54.12 50.35 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 122.48 0.312 . . . . 0.0 110.579 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -55.9 -42.77 76.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.8 m -80.26 -38.49 30.78 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.431 HG21 HG13 ' A' ' 196' ' ' VAL . 25.0 t -92.1 -22.89 5.86 Favored 'Isoleucine or valine' 0 C--N 1.338 0.082 0 CA-C-N 119.476 1.034 . . . . 0.0 110.882 -170.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -93.93 -3.14 52.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 52.79 30.62 9.26 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.108 0.563 . . . . 0.0 111.457 -174.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 93.0 mt -140.11 93.1 2.6 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.631 1.172 . . . . 0.0 109.607 -176.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.66 140.1 42.5 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.521 0.513 . . . . 0.0 109.994 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 42.0 tp -63.69 145.37 55.86 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.49 0.316 . . . . 0.0 111.031 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -155.84 168.3 27.65 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.935 0.494 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -150.5 2.17 0.46 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.445 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -64.48 -6.57 7.63 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -63.05 -3.91 1.98 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.076 0.551 . . . . 0.0 112.401 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -142.02 22.68 2.08 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 121.094 0.473 . . . . 0.0 110.649 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -134.31 25.6 3.82 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.478 0.711 . . . . 0.0 110.832 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -129.95 8.44 5.23 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.963 0.505 . . . . 0.0 111.028 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 76.1 t60 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.371 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 C4'-C3'-C2' 99.229 -3.471 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.982 3.782 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C4'-C3'-C2' 99.338 -3.362 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.235 0 C4'-C3'-C2' 99.021 -3.679 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.808 1 O4'-C1'-N19 112.361 4.161 . 0.655 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.999 0 C4'-C3'-C2' 98.9 -3.8 . 0.751 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.011 0 C4'-C3'-C2' 98.946 -3.754 . 0.668 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 0 C4'-C3'-C2' 99.603 -3.097 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C4'-C3'-C2' 100.687 -2.013 . 0.827 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C4'-C3'-C2' 99.661 -3.039 . 0.493 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.484 0 O4'-C1'-N19 112.113 3.913 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.733 0 C4'-C3'-C2' 99.697 -3.003 . 0.672 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C4'-C3'-C2' 99.216 -3.484 . 0.841 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 C4'-C3'-C2' 99.979 -2.721 . 0.778 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.18 -3.52 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.58 1 C4'-C3'-C2' 98.385 -4.315 . 0.63 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C4'-C3'-C2' 99.363 -3.337 . 0.687 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C4'-C3'-C2' 99.55 -3.15 . 0.772 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.231 -3.469 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.795 0 C5'-C4'-O4' 113.702 3.216 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.546 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.959 0 C4'-C3'-C2' 99.075 -3.625 . 0.853 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.546 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 98.939 -3.761 . 0.838 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.402 -2.355 1 O4'-C1'-N19 112.844 4.644 . 0.82 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.303 0 C4'-C3'-C2' 99.186 -3.514 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.424 3.224 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.704 0 C4'-C3'-C2' 98.972 -3.728 . 0.829 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C4'-C3'-C2' 99.196 -3.504 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C4'-C3'-C2' 99.37 -3.33 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.682 0 C4'-C3'-C2' 99.061 -3.639 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 1 O4'-C1'-N19 112.216 4.016 . 0.591 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C4'-C3'-C2' 98.943 -3.757 . 0.686 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.081 0 C4'-C3'-C2' 98.736 -3.964 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C4'-C3'-C2' 99.144 -3.556 . 0.734 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 0 O4'-C1'-N19 111.037 2.837 . 0.669 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.499 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.176 1 C5'-C4'-C3' 109.335 -4.11 . 0.058 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.499 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.087 3 C3'-C2'-C1' 105.909 4.899 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.448 " H2'" ' C8 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.413 -3.355 1 C4'-C3'-C2' 98.347 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.448 ' C8 ' " H2'" ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.609 0 O4'-C1'-N19 111.786 3.586 . 0.632 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.514 0 C4'-C3'-C2' 99.595 -3.105 . 0.63 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.63 1 C4'-C3'-C2' 98.213 -4.487 . 0.733 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 O4'-C1'-N19 112.139 3.939 . 0.615 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.469 0 C5'-C4'-O4' 113.137 2.812 . 0.914 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.024 1 C4'-C3'-C2' 98.681 -4.019 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C4'-C3'-C2' 99.822 -2.878 . 0.743 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.864 0 C4'-C3'-C2' 99.139 -3.561 . 0.922 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.426 0 C4'-C3'-C2' 98.96 -3.74 . 0.823 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.587 0 C4'-C3'-C2' 99.881 -2.819 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.855 1 C4'-C3'-C2' 98.412 -4.288 . 0.898 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C5'-C4'-C3' 111.384 -2.744 . 0.875 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.519 1 O4'-C1'-N19 113.465 5.265 . 0.506 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.453 " H1'" HG21 ' A' ' 31' ' ' VAL . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.739 3.539 . 0.495 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.411 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.097 2.897 . 0.666 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 C4'-C3'-C2' 99.38 -3.32 . 0.852 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.417 0 O4'-C1'-N19 111.358 3.158 . 0.856 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.707 0 O4'-C1'-N19 111.777 3.577 . 0.558 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.05 0 C4'-C3'-C2' 99.066 -3.634 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.473 0 C4'-C3'-C2' 99.627 -3.073 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.179 0 O4'-C1'-N19 111.652 3.452 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.661 -3.039 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.154 0 C4'-C3'-C2' 99.133 -3.567 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.3 1 C4'-C3'-C2' 98.47 -4.23 . 0.637 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 111.288 3.088 . 0.562 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 O4'-C1'-N19 111.224 3.024 . 0.819 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . 0.415 " H2'" ' C6 ' ' B' ' 301' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 C4'-C3'-C2' 100.005 -2.695 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . 0.415 ' C6 ' " H2'" ' B' ' 300' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.689 1 C4'-C3'-C2' 98.614 -4.086 . 0.651 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C4'-C3'-C2' 98.917 -3.783 . 0.652 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.829 -3.871 . 0.785 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 O4'-C1'-N19 111.971 3.771 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.229 0 C4'-C3'-C2' 99.543 -3.157 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.473 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.564 1 C4'-C3'-C2' 97.41 -5.29 . 0.792 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.473 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.601 0 O4'-C1'-N19 111.504 3.304 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.484 0.148 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.01 -174.43 47.07 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.24 176.33 8.03 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.918 3.079 . . . . 0.0 110.707 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.63 1.58 0.87 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 123.017 0.527 . . . . 0.0 110.84 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.29 50.84 0.99 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.116 0.566 . . . . 0.0 112.185 176.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.5 ' O ' HD22 ' A' ' 10' ' ' LEU . 56.0 Cg_endo -66.24 -20.42 55.83 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.177 1.918 . . . . 0.0 110.412 -176.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 11' ' ' MET . 63.0 pttt -48.98 -30.49 6.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -55.4 -60.87 2.81 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.907 0.321 . . . . 0.0 110.544 171.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.98 66.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 117.914 0.325 . . . . 0.0 111.438 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 6' ' ' PRO . 0.4 OUTLIER -79.19 -49.62 12.27 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.533 -0.73 . . . . 0.0 110.646 -173.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 21.9 mmt -59.65 -46.02 90.26 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.198 0.453 . . . . 0.0 110.069 175.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 16' ' ' ILE . 58.6 tp60 -56.07 -49.23 74.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.502 HD11 ' HD2' ' A' ' 17' ' ' LYS . 64.4 tp -53.41 -48.85 68.34 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.649 0.38 . . . . 0.0 111.939 177.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.39 -47.94 75.09 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 122.048 -0.408 . . . . 0.0 111.048 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.51 -45.1 92.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.106 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 12' ' ' GLN . 8.5 pt -79.54 -17.85 12.89 Favored 'Isoleucine or valine' 0 C--N 1.346 0.448 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -178.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HD2' HD11 ' A' ' 13' ' ' LEU . 76.5 mttt -130.96 65.78 77.54 Favored Pre-proline 0 N--CA 1.446 -0.664 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -177.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.72 5.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.74 2.96 . . . . 0.0 113.88 166.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 17' ' ' LYS . . . 178.57 106.29 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -176.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -160.81 -176.66 5.66 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.926 0.89 . . . . 0.0 109.979 -177.565 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.705 ' N ' HD22 ' A' ' 20' ' ' LEU . 13.7 mt-30 -129.37 136.15 49.62 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.28 0.946 . . . . 0.0 113.548 177.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 58' ' ' LYS . 4.2 m-85 -111.67 135.35 52.39 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 172.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 20.0 ptp -135.77 148.8 48.92 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 124.086 0.866 . . . . 0.0 111.098 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.617 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.43 140.75 38.06 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.204 1.001 . . . . 0.0 109.367 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.617 ' H ' HD22 ' A' ' 24' ' ' LEU . 75.1 mt -142.01 -178.83 5.89 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -172.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.534 ' CB ' HG22 ' A' ' 37' ' ' VAL . 26.5 t 47.47 -118.12 0.89 Allowed 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 123.72 0.808 . . . . 0.0 110.742 -165.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 66.67 76.99 0.29 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 126.572 1.949 . . . . 0.0 110.293 -171.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.4 t -165.37 158.22 15.89 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 113.361 -1.745 . . . . 0.0 107.36 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 31' ' ' VAL . . . 160.24 -170.35 36.27 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.09 2.47 0.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 125.044 3.83 . . . . 0.0 115.133 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 29' ' ' GLY . 5.2 t 74.17 -7.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 125.648 1.579 . . . . 0.0 112.528 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -130.02 1.97 4.78 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.878 0.471 . . . . 0.0 109.93 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.15 58.57 13.02 Favored Pre-proline 0 N--CA 1.448 -0.531 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 168.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.12 136.41 26.97 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 124.509 3.473 . . . . 0.0 110.6 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 50' ' ' SER . 3.4 tm? -104.4 127.56 52.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.033 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -119.92 137.05 54.27 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.534 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -126.53 117.12 47.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 119.079 -1.048 . . . . 0.0 109.784 176.101 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.597 ' HG2' HD23 ' A' ' 24' ' ' LEU . 15.3 mtp -99.34 135.45 40.74 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 26.6 p -126.51 136.81 53.08 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.523 HG23 HD23 ' A' ' 20' ' ' LEU . 8.5 p -112.06 136.81 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.035 -176.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -116.58 126.52 53.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 124.681 1.238 . . . . 0.0 110.025 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.449 HG11 ' CZ ' ' A' ' 69' ' ' PHE . 4.9 t -142.19 134.61 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 124.96 1.304 . . . . 0.0 108.399 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 50.87 11.2 0.08 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 102.0 2.0 51.85 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 118.143 0.429 . . . . 0.0 112.257 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -104.25 135.17 46.22 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 176.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.8 t -126.83 134.64 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -175.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 39' ' ' SER . 54.6 m-85 -132.22 134.48 45.39 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -175.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -114.38 135.69 53.81 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.383 -168.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.4 135.82 8.63 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 110.548 -1.021 . . . . 0.0 110.548 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' HD21 ' A' ' 35' ' ' LEU . 88.2 p -110.57 120.81 43.62 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.508 0.723 . . . . 0.0 112.035 -170.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -136.79 156.8 23.39 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.505 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.83 -2.36 10.83 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.535 2.823 . . . . 0.0 110.647 174.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.98 155.62 39.46 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.43 -30.21 70.43 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mttt -57.5 -65.89 0.55 Allowed 'General case' 0 C--O 1.225 -0.218 0 CA-C-O 121.04 0.448 . . . . 0.0 110.858 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -55.24 -38.21 68.19 Favored 'General case' 0 CA--C 1.524 -0.047 0 C-N-CA 123.895 0.878 . . . . 0.0 110.91 -178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.76 -60.64 3.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.842 0.292 . . . . 0.0 111.246 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 38.7 tttt -58.32 -38.1 76.45 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.859 0.464 . . . . 0.0 111.869 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.425 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.3 tm? -56.47 -63.43 1.2 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.155 0.582 . . . . 0.0 111.694 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 16.6 t-160 -56.56 -38.85 72.49 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.213 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.93 -44.53 94.29 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.42 -49.42 72.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.026 0.53 . . . . 0.0 110.916 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.53 -56.72 16.93 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.379 0.671 . . . . 0.0 111.515 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.464 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 96.4 mttt -55.65 -58.84 6.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.481 0.658 . . . . 0.0 110.17 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.73 70.54 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.778 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tp -55.33 -61.74 2.13 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -64.05 -27.01 68.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -172.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.418 ' CB ' ' CZ ' ' A' ' 47' ' ' PHE . 61.7 m -78.35 -53.57 7.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.347 -0.541 . . . . 0.0 112.325 175.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.601 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 8.8 t80 -55.73 -35.42 66.12 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 126.534 1.933 . . . . 0.0 113.309 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.9 m -57.28 -14.63 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 119.104 0.865 . . . . 0.0 112.621 176.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -91.82 -15.95 27.48 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.705 0.684 . . . . 0.0 110.654 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -145.03 56.54 3.74 Favored Pre-proline 0 C--N 1.343 0.293 0 C-N-CA 122.854 0.462 . . . . 0.0 111.947 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.601 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 91.5 Cg_endo -75.85 -9.55 19.61 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 124.466 3.444 . . . . 0.0 111.865 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.0 p30 -147.67 5.49 0.79 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 45.69 34.66 1.84 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.924 0.89 . . . . 0.0 112.815 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.2 t -139.48 -179.7 6.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.301 0.64 . . . . 0.0 111.08 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -134.04 14.22 3.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.209 0.604 . . . . 0.0 110.772 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.98 5.54 1.55 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -141.05 174.93 10.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.832 0.853 . . . . 0.0 109.696 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.8 pt? -146.6 -178.31 6.1 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.98 0.512 . . . . 0.0 111.804 -176.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -144.03 -171.68 3.61 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 109.838 -177.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -132.94 176.74 8.22 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.526 0.33 . . . . 0.0 110.969 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.86 -171.73 37.87 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -146.67 169.86 18.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.3 p -136.57 -175.18 3.93 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.681 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.408 ' N ' HD22 ' A' ' 86' ' ' LEU . 3.6 mm? -63.85 -0.93 1.19 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.632 0.773 . . . . 0.0 112.262 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 94.9 p -65.65 -9.32 26.33 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.928 0.786 . . . . 0.0 111.979 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 97.3 t -141.28 130.48 24.44 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.052 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -163.82 -175.13 3.94 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.923 0.489 . . . . 0.0 111.6 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.3 p -134.98 -178.86 5.28 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.796 1.238 . . . . 0.0 108.246 176.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -147.65 145.45 28.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.682 0.753 . . . . 0.0 112.137 -176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -159.95 149.31 17.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.087 1.355 . . . . 0.0 108.579 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.0 p -151.27 -178.55 6.71 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.884 0.473 . . . . 0.0 111.606 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 48.0 m -139.69 167.1 22.87 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.822 1.249 . . . . 0.0 109.016 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -147.49 8.44 0.9 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 172.32 15.13 Favored 'General case' 0 C--N 1.342 0.245 0 O-C-N 121.667 -0.646 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -148.17 5.77 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.644 0.778 . . . . 0.0 110.637 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -146.81 166.87 25.37 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.063 0.945 . . . . 0.0 109.466 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -153.48 144.27 15.96 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -51.74 168.7 0.3 Allowed 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 124.076 3.184 . . . . 0.0 113.764 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -147.44 164.94 31.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.768 0.427 . . . . 0.0 110.525 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -149.19 -171.54 3.91 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.844 0.858 . . . . 0.0 110.193 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.549 ' H ' HD23 ' A' ' 103' ' ' LEU . 2.0 pt? -138.59 178.09 7.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.035 0.934 . . . . 0.0 110.488 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -141.18 27.16 1.96 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.645 0.378 . . . . 0.0 110.827 -173.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -138.35 10.2 2.74 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.015 0.526 . . . . 0.0 111.547 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 172.56 178.55 42.76 Favored Glycine 0 C--N 1.336 0.552 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -152.31 -11.98 0.18 Allowed 'General case' 0 CA--C 1.528 0.097 0 O-C-N 122.562 -0.375 . . . . 0.0 110.805 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -160.63 163.31 32.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.327 1.051 . . . . 0.0 109.398 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.514 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 76.0 p -144.32 26.98 0.06 OUTLIER Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 109' ' ' THR . 98.5 Cg_endo -73.26 -5.36 17.02 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.861 1.707 . . . . 0.0 112.293 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -151.74 15.98 0.67 Allowed 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.094 0.558 . . . . 0.0 110.689 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -141.69 162.5 35.32 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.057 0.543 . . . . 0.0 110.593 -175.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.0 m -147.04 -0.65 0.69 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.199 0.6 . . . . 0.0 111.84 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.99 155.3 47.43 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.424 0.689 . . . . 0.0 109.446 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.41 166.39 29.56 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.792 2.994 . . . . 0.0 111.485 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.69 174.85 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 124.985 3.79 . . . . 0.0 113.293 174.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -144.9 166.58 24.86 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.296 0.638 . . . . 0.0 110.619 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -148.9 171.57 16.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.522 0.729 . . . . 0.0 110.548 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 12.4 p -154.1 158.17 3.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 C-N-CA 123.19 0.596 . . . . 0.0 109.46 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -176.28 -178.41 46.04 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 112.226 -0.35 . . . . 0.0 112.226 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 41.7 m -68.99 4.9 1.31 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.832 0.853 . . . . 0.0 112.009 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -148.15 166.75 26.92 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.88 -0.512 . . . . 0.0 109.908 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.75 -176.39 40.68 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.524 -0.631 . . . . 0.0 111.524 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -149.62 11.97 0.78 Allowed 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -149.82 165.18 33.29 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.819 0.447 . . . . 0.0 109.911 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.6 p -149.77 174.55 12.49 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.73 0.412 . . . . 0.0 111.038 -178.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.97 161.22 21.87 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.004 0.922 . . . . 0.0 110.673 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 80.3 p -154.33 171.06 19.89 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.773 0.429 . . . . 0.0 110.345 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 86.4 p -151.86 172.88 15.5 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 122.166 -0.334 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.5 m 52.85 18.58 1.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.43 1.092 . . . . 0.0 113.188 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 174.78 178.15 44.44 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -148.93 -13.67 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.903 0.352 . . . . 0.0 111.141 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -148.5 173.66 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.705 0.802 . . . . 0.0 110.002 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.0 p -151.02 164.35 36.63 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.27 0.628 . . . . 0.0 109.669 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.0 mp 49.44 20.99 0.52 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.328 1.051 . . . . 0.0 111.497 -177.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.8 p -65.07 168.94 5.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 112.303 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -152.51 174.67 13.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.933 0.893 . . . . 0.0 109.584 179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 27.0 p -58.1 155.3 25.73 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.047 0.539 . . . . 0.0 110.322 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -73.93 -0.1 9.03 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.783 2.989 . . . . 0.0 112.519 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.64 153.86 58.8 Favored Pre-proline 0 C--N 1.341 0.227 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.32 175.41 9.38 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 123.375 2.717 . . . . 0.0 111.212 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.67 174.06 12.56 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 79.1 p -151.62 19.96 0.72 Allowed 'General case' 0 C--O 1.233 0.195 0 C-N-CA 122.99 0.516 . . . . 0.0 111.727 -176.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 24.3 tp -136.93 -8.55 1.82 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.197 0.453 . . . . 0.0 112.061 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.3 p -145.33 -12.76 0.53 Allowed 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.489 -0.757 . . . . 0.0 111.602 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -161.59 157.48 21.26 Favored Pre-proline 0 CA--C 1.531 0.217 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 149' ' ' LEU . 71.9 Cg_endo -71.91 171.1 17.28 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 122.972 2.448 . . . . 0.0 110.756 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.54 6.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 124.903 3.736 . . . . 0.0 114.647 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.428 ' H ' ' C ' ' A' ' 147' ' ' PRO . 85.3 mt -133.69 160.9 66.78 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.353 0.661 . . . . 0.0 110.395 -175.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.18 168.86 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.333 3.355 . . . . 0.0 114.531 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 34.4 pt -145.03 159.44 49.76 Favored Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 124.407 1.083 . . . . 0.0 108.721 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.44 160.04 51.32 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 122.719 2.279 . . . . 0.0 111.112 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.63 160.55 5.25 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.544 3.496 . . . . 0.0 113.65 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -7.29 1.05 Allowed 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 124.39 3.394 . . . . 0.0 114.639 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -142.92 71.18 19.02 Favored Pre-proline 0 C--O 1.233 0.209 0 C-N-CA 123.865 0.866 . . . . 0.0 110.282 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 73.5 Cg_exo -50.35 152.25 8.7 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.841 3.027 . . . . 0.0 113.586 -178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 156' ' ' PRO . 66.6 Cg_exo -52.26 158.09 5.77 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.538 2.825 . . . . 0.0 112.581 176.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.62 174.56 12.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 124.583 3.522 . . . . 0.0 110.695 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 24.8 t -151.7 172.14 16.58 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.924 0.49 . . . . 0.0 110.637 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 178.12 28.06 0.04 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -176.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -136.53 -159.17 0.93 Allowed 'General case' 0 C--O 1.231 0.117 0 C-N-CA 124.772 1.229 . . . . 0.0 108.903 -175.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -129.96 70.21 82.01 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 121.791 0.805 . . . . 0.0 111.344 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.452 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 97.2 Cg_endo -83.65 -9.31 10.09 Favored 'Trans proline' 0 N--CA 1.444 -1.427 1 C-N-CA 125.479 4.119 . . . . 0.0 110.597 -176.484 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 46.7 t -65.37 -35.87 76.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.309 0 C-N-CA 122.875 0.47 . . . . 0.0 110.064 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . 0.453 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 63.1 tpp -82.58 -48.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.69 0.223 . . . . 0.0 111.174 -176.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.452 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.9 pt -55.62 -40.38 59.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.044 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.0 tt -63.63 -51.07 66.81 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -73.31 18.53 0.11 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.374 0.669 . . . . 0.0 112.226 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -138.06 -2.53 1.86 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.74 -0.6 . . . . 0.0 110.153 174.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.58 -29.02 5.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 118.409 0.55 . . . . 0.0 110.955 176.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -154.23 67.25 5.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.61 178.88 3.46 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 123.274 2.65 . . . . 0.0 108.703 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 99.37 36.4 4.38 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-O 119.676 -0.513 . . . . 0.0 111.823 -176.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.87 -177.79 3.95 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 117.82 0.81 . . . . 0.0 109.883 -176.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.56 154.15 47.57 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.47 ' CG ' HG13 ' A' ' 194' ' ' VAL . 33.0 m-85 -128.99 151.47 49.65 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -131.79 166.87 20.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.938 172.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -123.69 139.47 53.96 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -125.75 158.74 34.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.91 0.862 . . . . 0.0 109.726 -173.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.9 p -46.5 168.7 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.468 2.307 . . . . 0.0 115.962 -166.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.53 166.8 22.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.317 -1.311 . . . . 0.0 111.261 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 82.0 p -160.89 166.83 27.8 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.092 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.82 173.09 24.57 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 176.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -75.6 171.39 14.39 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.98 0.512 . . . . 0.0 110.304 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 39.6 m -66.26 -3.66 6.26 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 36.6 p-80 -129.28 11.31 5.89 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.55 0.34 . . . . 0.0 110.929 -177.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.14 19.13 1.24 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 37.4 tptt -59.23 156.51 12.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.585 1.154 . . . . 0.0 111.789 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 70.6 m -143.88 154.03 42.94 Favored 'General case' 0 N--CA 1.457 -0.077 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -145.05 171.44 14.48 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.58 160.28 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 118.544 0.611 . . . . 0.0 110.714 176.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 93.6 mmm -131.22 157.65 42.66 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 85.8 p -129.5 172.18 11.81 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 167.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.47 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.53 164.51 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 91.6 t -135.72 123.67 36.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.73 -1.952 . . . . 0.0 105.73 170.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 22.6 t -141.46 123.65 14.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -172.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.1 t70 56.47 7.13 0.32 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 112.92 -15.92 23.39 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -78.1 178.27 7.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 117.529 0.664 . . . . 0.0 109.832 178.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.82 139.8 32.81 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -135.8 167.58 20.89 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.812 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 39.0 tt0 -151.95 159.83 43.67 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -171.94 135.97 3.63 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 122.014 -0.429 . . . . 0.0 112.07 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 90.2 p -115.66 153.14 31.84 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.215 0.531 . . . . 0.0 112.262 -177.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -163.9 171.4 39.49 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.734 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 -68.46 -11.83 60.33 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -149.93 160.52 43.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -26.08 68.16 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -71.7 -41.13 68.98 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.419 0.687 . . . . 0.0 111.052 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -75.26 -38.61 60.43 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.51 92.47 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.924 0.49 . . . . 0.0 110.885 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -71.55 -36.23 70.9 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.1 -0.375 . . . . 0.0 110.993 177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -65.53 -18.12 65.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.354 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -94.0 -49.77 5.63 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.231 0.612 . . . . 0.0 110.798 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -57.77 -33.7 68.8 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.16 0.184 . . . . 0.0 110.969 174.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.28 -47.58 15.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 14.5 tm0? -46.25 -40.41 11.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.2 170.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 67.1 m -74.69 -39.33 62.03 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 118.57 0.623 . . . . 0.0 111.671 178.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.13 -42.23 99.46 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.519 0.328 . . . . 0.0 111.164 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.2 tt -64.52 -55.05 23.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.02 47.7 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 119.632 -0.223 . . . . 0.0 111.2 -174.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 55.7 m -65.79 -49.26 68.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 -177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 56.3 t -73.99 -26.12 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 O-C-N 121.171 -0.955 . . . . 0.0 111.766 -174.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -96.44 -0.98 48.37 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.707 -0.621 . . . . 0.0 110.392 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 56.64 35.28 25.88 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 88.9 mt -138.12 -168.92 2.46 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.347 1.059 . . . . 0.0 109.409 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.466 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 17.0 t-80 -143.14 -169.2 2.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 122.065 -0.397 . . . . 0.0 110.569 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.466 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 12.3 tp -132.27 10.88 4.53 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.208 0.603 . . . . 0.0 112.429 -175.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 92.2 mt -132.28 29.0 4.35 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.623 0.769 . . . . 0.0 109.674 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -134.91 23.64 3.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.853 0.861 . . . . 0.0 110.066 -178.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -134.46 13.31 3.8 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.546 0.738 . . . . 0.0 110.618 -176.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -67.84 3.26 1.55 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.527 1.131 . . . . 0.0 112.793 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -67.4 18.98 0.03 OUTLIER 'General case' 0 C--N 1.342 0.248 0 C-N-CA 124.51 1.124 . . . . 0.0 113.148 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -131.49 3.46 4.23 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.122 0.419 . . . . 0.0 111.669 -176.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -147.24 10.92 1.01 Allowed 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.763 -0.586 . . . . 0.0 110.979 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.606 179.294 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 C5'-C4'-O4' 114.198 3.57 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.151 0 C4'-C3'-C2' 99.047 -3.653 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 O4'-C1'-N19 111.605 3.405 . 0.786 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.754 0 C4'-C3'-C2' 99.153 -3.547 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.031 1 O4'-C1'-N19 112.892 4.692 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C4'-C3'-C2' 99.24 -3.46 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.882 0 C4'-C3'-C2' 99.263 -3.437 . 0.675 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C4'-C3'-C2' 99.512 -3.188 . 0.711 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.699 0 C4'-C3'-C2' 99.597 -3.103 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.215 0 C4'-C3'-C2' 99.369 -3.331 . 0.59 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.055 0 C4'-C3'-C2' 98.775 -3.925 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 O4'-C1'-N19 111.945 3.745 . 0.744 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.702 0 C4'-C3'-C2' 99.501 -3.199 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.824 0 C4'-C3'-C2' 99.551 -3.149 . 0.729 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.016 0 C4'-C3'-C2' 99.302 -3.398 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 0 C4'-C3'-C2' 98.969 -3.731 . 0.629 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.66 0 C4'-C3'-C2' 99.423 -3.277 . 0.781 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C4'-C3'-C2' 99.622 -3.078 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 C4'-C3'-C2' 99.142 -3.558 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 C4'-C3'-C2' 99.594 -3.106 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.46 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.415 -3.187 0 C4'-C3'-C2' 99.703 -2.997 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.46 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C4'-C3'-C2' 99.121 -3.579 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.348 0 C4'-C3'-C2' 98.864 -3.836 . 0.776 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.749 0 C5'-C4'-C3' 110.323 -3.452 . 0.796 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 O4'-C1'-N19 111.102 2.902 . 0.879 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 99.034 -3.666 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.53 0 C4'-C3'-C2' 98.718 -3.982 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.983 0 C4'-C3'-C2' 99.121 -3.579 . 0.884 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.18 -3.52 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 O4'-C1'-N19 111.163 2.963 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.755 0 C4'-C3'-C2' 99.748 -2.952 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.01 0 C4'-C3'-C2' 98.79 -3.91 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C4'-C3'-C2' 99.106 -3.594 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.433 0 N19-C1'-C2' 110.18 -2.012 . 0.7 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.555 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.183 1 C5'-C4'-C3' 107.895 -5.07 OUTLIER-EPSILON 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.555 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.413 -3.374 2 C5'-C4'-C3' 108.572 -4.619 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.656 0 C4'-C3'-C2' 100.27 -2.43 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C4'-C3'-C2' 99.942 -2.758 . 0.8 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.756 0 C4'-C3'-C2' 99.078 -3.622 . 0.697 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 1 C4'-C3'-C2' 98.536 -4.164 . 0.798 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.422 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.963 0 N19-C1'-C2' 108.374 -3.141 . 0.734 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.422 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.475 0 C4'-C3'-C2' 99.488 -3.212 . 0.89 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.896 0 C4'-C3'-C2' 98.744 -3.956 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.225 -3.475 . 0.742 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.677 0 C4'-C3'-C2' 98.856 -3.844 . 0.895 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.719 1 C4'-C3'-C2' 98.496 -4.204 . 0.808 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 C4'-C3'-C2' 99.479 -3.221 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.869 0 C4'-C3'-C2' 99.466 -3.234 . 0.874 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.7 0 C4'-C3'-C2' 99.755 -2.945 . 0.859 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.13 2 O4'-C1'-N19 113.177 4.977 . 0.802 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 C4'-C3'-C2' 99.819 -2.881 . 0.488 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.29 0 C5'-C4'-C3' 110.987 -3.008 . 0.726 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.497 0 C4'-C3'-C2' 99.377 -3.323 . 0.812 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.407 -2.066 0 O4'-C1'-N19 111.98 3.78 . 0.898 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.453 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.46 0 O4'-C1'-N19 111.802 3.602 . 0.511 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C4'-C3'-C2' 99.328 -3.372 . 0.658 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C4'-C3'-C2' 99.452 -3.248 . 0.653 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.034 0 C4'-C3'-C2' 99.316 -3.384 . 0.798 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 112.018 3.818 . 0.844 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C4'-C3'-C2' 99.219 -3.481 . 0.838 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.82 0 C4'-C3'-C2' 98.919 -3.781 . 0.622 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.405 0 C4'-C3'-C2' 99.605 -3.095 . 0.558 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.885 0 C4'-C3'-C2' 99.721 -2.979 . 0.87 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C4'-C3'-C2' 99.482 -3.218 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.243 -3.457 . 0.674 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C4'-C3'-C2' 99.058 -3.642 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.883 1 C4'-C3'-C2' 98.285 -4.415 . 0.791 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.781 1 O4'-C1'-N19 112.397 4.197 . 0.822 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C4'-C3'-C2' 99.517 -3.183 . 0.806 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.439 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.058 1 C4'-C3'-C2' 97.644 -5.056 . 0.697 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.439 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.416 -3.044 1 O4'-C1'-N19 112.325 4.125 . 0.743 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo . . . . . 0 N--CA 1.472 0.259 0 N-CA-C 113.01 0.35 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.01 -64.85 0.08 OUTLIER Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.85 177.56 7.5 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.715 2.943 . . . . 0.0 110.209 175.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -130.82 16.33 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 123.666 0.786 . . . . 0.0 111.022 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 29.3 tp 44.73 56.78 14.47 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 124.058 0.943 . . . . 0.0 111.921 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.63 -11.15 24.09 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.6 2.2 . . . . 0.0 111.706 -177.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.0 -35.14 45.74 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 122.374 0.27 . . . . 0.0 110.332 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -55.29 -64.09 0.95 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.751 0.82 . . . . 0.0 110.88 175.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.54 -27.91 63.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.753 0.421 . . . . 0.0 111.453 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.8 -52.79 9.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.163 0.185 . . . . 0.0 110.65 -176.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 32.4 mmt -58.19 -54.28 48.78 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -56.84 -47.15 81.0 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 123.652 0.781 . . . . 0.0 110.428 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.2 tp -55.65 -54.15 47.78 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -53.43 -38.77 63.83 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 119.753 -0.165 . . . . 0.0 110.773 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -61.73 -54.54 41.15 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 123.531 0.52 . . . . 0.0 111.494 174.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.1 pt -76.05 -6.22 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -178.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' CD1' ' A' ' 20' ' ' LEU . 35.7 ttpt -93.86 54.84 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 126.817 2.047 . . . . 0.0 116.269 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -79.46 0.45 10.0 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 CA-C-N 122.399 1.892 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.76 119.06 0.46 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -172.19 -174.09 1.2 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.966 0.506 . . . . 0.0 111.647 -173.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.694 ' N ' HD22 ' A' ' 20' ' ' LEU . 32.4 mt-30 -133.62 135.62 44.31 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -110.52 135.44 51.17 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 169.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -135.8 140.4 44.23 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.898 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.609 HD23 ' HG2' ' A' ' 38' ' ' MET . 2.7 tm? -105.11 120.46 41.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 122.288 1.042 . . . . 0.0 110.161 -175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.9 mt -110.53 -177.59 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.023 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.574 ' CB ' HG22 ' A' ' 37' ' ' VAL . 27.2 t 47.13 -120.92 1.16 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.58 0.752 . . . . 0.0 110.765 -167.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.48 ' NE2' ' CZ ' ' A' ' 36' ' ' PHE . 1.6 tp-100 69.46 83.75 0.15 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.321 2.648 . . . . 0.0 109.841 -173.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 t -165.39 162.74 19.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.911 -1.495 . . . . 0.0 107.731 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 159.11 -170.88 35.56 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.374 -0.691 . . . . 0.0 111.374 -178.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.6 8.85 1.75 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 125.161 3.907 . . . . 0.0 113.615 176.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.1 t 74.92 5.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.537 1.135 . . . . 0.0 111.915 175.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -137.11 -5.96 1.85 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.329 0.652 . . . . 0.0 110.183 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.07 59.91 16.37 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 123.777 0.831 . . . . 0.0 109.301 171.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.38 135.55 20.5 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 124.696 3.597 . . . . 0.0 111.419 -175.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -105.27 122.08 45.19 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.48 ' CZ ' ' NE2' ' A' ' 27' ' ' GLN . 34.7 m-85 -111.34 141.18 45.21 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.574 HG22 ' CB ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -126.83 104.65 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.162 172.109 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.609 ' HG2' HD23 ' A' ' 24' ' ' LEU . 28.6 mtp -94.04 135.19 35.66 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 54.8 p -127.81 135.13 49.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG23 HD23 ' A' ' 20' ' ' LEU . 8.8 p -112.11 134.03 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.869 -176.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -115.28 123.96 50.11 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.724 0.64 . . . . 0.0 111.042 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 42.3 t -135.77 134.89 51.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 125.73 1.612 . . . . 0.0 107.516 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 t30 51.39 19.37 0.78 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.75 4.01 70.34 Favored Glycine 0 C--N 1.338 0.681 0 O-C-N 121.613 -0.68 . . . . 0.0 112.566 178.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -104.7 131.22 52.4 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 174.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.45 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 11.7 p -122.97 135.66 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -177.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 59.8 m-85 -131.31 135.1 46.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 -176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -114.44 138.57 50.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.897 -168.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -135.31 135.58 7.97 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' CG1' ' A' ' 37' ' ' VAL . 83.3 p -109.15 126.11 52.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.671 0.788 . . . . 0.0 110.802 -174.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -150.75 157.69 27.31 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.968 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.85 133.04 21.05 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 122.232 1.955 . . . . 0.0 107.03 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.4 m 57.67 161.14 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.886 0.851 . . . . 0.0 111.378 -170.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -67.85 -26.39 66.02 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -58.78 -65.4 0.67 Allowed 'General case' 0 C--O 1.226 -0.166 0 CA-C-N 118.739 0.699 . . . . 0.0 111.924 -171.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.07 -39.33 71.93 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.095 0.558 . . . . 0.0 111.187 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.46 -61.82 2.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.051 0.387 . . . . 0.0 111.277 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.6 tttm -56.92 -39.88 75.3 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.776 0.43 . . . . 0.0 111.941 175.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.37 -60.19 3.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.205 0.602 . . . . 0.0 110.943 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 15.8 t-160 -56.13 -43.41 78.16 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.141 0.576 . . . . 0.0 110.774 178.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.4 -44.71 89.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.072 -0.393 . . . . 0.0 111.247 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.86 -49.58 75.04 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.475 0.71 . . . . 0.0 110.832 177.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.47 -51.43 66.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.571 0.701 . . . . 0.0 111.793 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 95.2 mttt -56.57 -59.27 5.23 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.1 -37.34 69.25 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.727 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.17 -68.22 0.21 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -55.69 -31.86 62.78 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.242 -0.286 . . . . 0.0 110.417 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.4 m -76.18 -68.09 0.62 Allowed 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -14.44 62.55 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 117.285 -1.341 . . . . 0.0 114.095 -173.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.32 -14.7 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-N 121.021 1.737 . . . . 0.0 111.615 171.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -78.96 -15.77 57.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.249 0.62 . . . . 0.0 110.838 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -148.98 59.33 4.04 Favored Pre-proline 0 CA--C 1.531 0.23 0 C-N-CA 124.149 0.98 . . . . 0.0 111.861 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -79.95 -13.89 12.63 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 124.834 3.69 . . . . 0.0 111.673 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 52.04 10.87 0.13 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.952 1.701 . . . . 0.0 113.684 -175.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -155.98 11.77 0.3 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.568 0.347 . . . . 0.0 111.894 -178.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.3 t -151.09 178.91 8.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 122.066 -0.396 . . . . 0.0 110.15 -175.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -142.3 21.38 2.06 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.983 1.313 . . . . 0.0 110.316 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.17 6.26 1.01 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -62.02 167.15 4.06 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.428 0.632 . . . . 0.0 111.806 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.441 ' C ' ' H ' ' A' ' 82' ' ' MET . 2.4 pt? -149.85 15.51 0.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.69 0.796 . . . . 0.0 112.14 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.45 19.49 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.409 1.084 . . . . 0.0 112.708 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . 0.441 ' H ' ' C ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -138.78 15.22 2.7 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.284 1.434 . . . . 0.0 110.812 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -157.3 -169.75 21.44 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -176.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.7 mtp-105 -63.03 169.68 3.22 Favored 'General case' 0 C--N 1.339 0.114 0 CA-C-O 121.218 0.532 . . . . 0.0 111.156 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -137.73 -174.31 3.74 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 109.503 -177.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.21 152.93 45.01 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.1 p -156.9 178.64 10.13 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.67 0.788 . . . . 0.0 110.131 179.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -68.58 172.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.672 0.789 . . . . 0.0 111.77 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -142.96 22.45 1.92 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.052 0.541 . . . . 0.0 110.934 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -140.96 9.54 2.14 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 122.792 0.437 . . . . 0.0 111.568 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -69.49 -18.26 63.68 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.877 -0.514 . . . . 0.0 111.633 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -67.45 157.97 32.92 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.634 0.374 . . . . 0.0 111.11 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.5 t -157.16 170.14 23.19 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.744 0.418 . . . . 0.0 110.415 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.5 p -69.08 172.44 6.76 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.879 0.872 . . . . 0.0 112.163 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -143.41 19.1 1.88 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.419 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -143.97 157.72 44.16 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.338 0.655 . . . . 0.0 109.568 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.38 167.95 25.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.55 0.34 . . . . 0.0 110.488 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -152.62 20.72 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.415 0.686 . . . . 0.0 110.147 -178.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -56.77 153.31 22.74 Favored Pre-proline 0 CA--C 1.535 0.393 0 O-C-N 121.893 -0.505 . . . . 0.0 111.038 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.4 158.14 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 124.023 3.149 . . . . 0.0 113.7 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -147.51 11.27 0.99 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.948 0.899 . . . . 0.0 109.746 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.0 t -151.13 174.86 12.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.991 0.916 . . . . 0.0 109.268 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 54.6 tp -149.95 156.55 41.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -151.88 162.2 41.43 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.159 0.584 . . . . 0.0 109.74 177.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -89.8 -10.41 45.57 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 73.48 -173.6 49.05 Favored Glycine 0 CA--C 1.531 1.08 0 O-C-N 121.84 -0.538 . . . . 0.0 111.95 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -157.82 169.55 24.36 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.886 0.874 . . . . 0.0 109.828 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -152.49 -22.51 0.17 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.463 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 67.2 p -144.4 37.15 0.22 Allowed Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 109' ' ' THR . 93.2 Cg_endo -71.1 146.97 53.3 Favored 'Trans proline' 0 N--CA 1.449 -1.091 0 C-N-CA 122.665 2.243 . . . . 0.0 110.729 -176.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -165.1 -37.42 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.03 0.532 . . . . 0.0 111.093 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -148.65 169.94 19.26 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.887 0.875 . . . . 0.0 108.647 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.6 m -146.01 9.52 1.13 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.561 0.344 . . . . 0.0 111.095 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -155.62 136.73 9.2 Favored Pre-proline 0 CA--C 1.533 0.295 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.476 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 68.9 Cg_endo -70.77 144.18 47.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.213 1.942 . . . . 0.0 111.967 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 115' ' ' PRO . 31.6 Cg_exo -60.47 13.72 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.7 1 C-N-CA 125.357 4.038 . . . . 0.0 115.301 174.335 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -135.58 166.41 23.28 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.321 -0.862 . . . . 0.0 111.499 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.24 169.68 5.42 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.826 0.85 . . . . 0.0 112.416 -177.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -140.71 -16.18 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 123.625 0.77 . . . . 0.0 110.348 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 160.77 -0.18 0.07 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.898 -0.39 . . . . 0.0 112.29 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 98.2 p -152.64 -171.08 3.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 117.705 0.752 . . . . 0.0 110.498 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -129.86 26.11 5.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.622 0.769 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -137.85 26.75 2.85 Favored Glycine 0 C--N 1.34 0.753 0 C-N-CA 124.56 1.076 . . . . 0.0 110.692 179.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.25 16.71 0.07 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.684 1.593 . . . . 0.0 111.893 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -138.84 164.64 29.12 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.488 0.715 . . . . 0.0 109.976 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.9 p -146.73 -177.84 5.86 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 122.511 0.324 . . . . 0.0 111.362 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -55.37 156.25 4.55 Favored 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.704 0.801 . . . . 0.0 112.251 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 79.4 p -156.83 174.57 15.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.79 0.836 . . . . 0.0 110.048 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 22.5 t -152.27 172.54 16.27 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 177.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 50.2 m -141.7 17.54 2.17 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.753 0.821 . . . . 0.0 111.626 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.19 174.9 34.74 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -64.16 -6.14 6.09 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.338 0.655 . . . . 0.0 112.081 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 p -64.05 -6.22 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 123.67 0.788 . . . . 0.0 111.612 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.2 m -142.73 13.72 1.92 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.556 0.616 . . . . 0.0 112.242 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.6 mp -134.54 164.53 27.28 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.038 -0.414 . . . . 0.0 110.612 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 20.9 m -72.06 0.74 8.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 112.46 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 52.08 23.18 2.14 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.24 1.016 . . . . 0.0 112.633 -178.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t -56.78 142.64 71.75 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.435 0.694 . . . . 0.0 111.243 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.33 -5.9 18.03 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.977 3.118 . . . . 0.0 112.271 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.3 136.84 88.68 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -68.77 170.03 16.27 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.402 2.734 . . . . 0.0 111.862 -178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -143.75 17.27 1.81 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.499 -178.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 33.8 t -150.82 153.69 35.87 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.846 0.458 . . . . 0.0 110.667 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 54.1 tp -159.34 157.63 30.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.065 0.946 . . . . 0.0 108.747 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 41.2 p -142.48 131.35 22.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -152.99 156.13 32.53 Favored Pre-proline 0 CA--C 1.529 0.141 0 C-N-CA 124.66 1.184 . . . . 0.0 109.168 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.97 165.98 30.58 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.657 2.238 . . . . 0.0 110.11 175.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.39 157.49 4.7 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.365 2.71 . . . . 0.0 112.642 175.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.92 50.86 4.65 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 123.508 0.723 . . . . 0.0 110.936 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -68.51 172.04 12.04 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.272 2.648 . . . . 0.0 111.111 -178.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.87 165.4 31.21 Favored Pre-proline 0 C--O 1.233 0.229 0 C-N-CA 123.621 0.768 . . . . 0.0 109.429 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.92 160.34 1.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.466 2.778 . . . . 0.0 113.7 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 158.02 5.39 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.965 3.11 . . . . 0.0 113.747 -177.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.0 171.54 0.11 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 124.89 3.726 . . . . 0.0 113.381 174.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -48.01 134.89 11.61 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 123.318 0.647 . . . . 0.0 110.378 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.88 168.79 23.5 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.983 3.122 . . . . 0.0 112.184 -174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -51.83 157.76 5.34 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.982 3.121 . . . . 0.0 112.713 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.66 39.49 0.64 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.604 3.536 . . . . 0.0 110.927 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.0 m -123.11 23.41 9.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.58 0.752 . . . . 0.0 111.134 -173.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -145.58 164.73 28.06 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.55 163.24 24.0 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.141 0.577 . . . . 0.0 111.519 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -67.9 135.12 92.01 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.454 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.407 ' HA ' ' CG1' ' A' ' 166' ' ' ILE . 56.3 Cg_endo -73.56 -13.31 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.976 2.451 . . . . 0.0 111.542 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.64 -36.69 75.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . 0.41 ' CE ' " H1'" ' B' ' 291' ' ' ' C' . 60.4 tpp -87.28 -47.75 8.57 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.914 -175.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 163' ' ' PRO . 4.3 pt -55.8 -38.79 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.197 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.1 tt -65.04 -47.04 78.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -75.01 17.07 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.929 0.492 . . . . 0.0 112.209 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.73 -6.65 2.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.409 0.284 . . . . 0.0 110.732 172.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.91 -38.22 4.28 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 121.972 -0.455 . . . . 0.0 111.997 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 82.2 mmt-85 -148.61 66.3 8.95 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 118.377 0.535 . . . . 0.0 111.542 -176.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.75 -178.62 1.31 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.549 2.166 . . . . 0.0 109.043 171.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 94.97 36.93 5.35 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.54 0.609 . . . . 0.0 112.019 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.2 -174.23 3.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.487 0.715 . . . . 0.0 109.904 -175.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 37.8 mtmt -141.49 145.46 35.23 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.501 ' CG ' HG13 ' A' ' 194' ' ' VAL . 28.4 m-85 -126.05 149.81 48.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -130.09 167.02 18.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.85 173.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -128.53 135.9 50.03 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -121.08 158.72 27.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 122.004 0.907 . . . . 0.0 111.233 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 98.8 p -46.31 160.44 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 127.221 2.208 . . . . 0.0 116.638 -165.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.488 ' OE1' ' HE2' ' A' ' 188' ' ' LYS . 11.0 pt-20 -122.14 159.0 28.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 112.531 -2.122 . . . . 0.0 111.921 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 49.7 m -149.21 160.93 42.95 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.916 0.886 . . . . 0.0 109.713 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 116.32 176.9 18.13 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -79.59 -77.65 0.18 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 18.1 t -165.8 -31.19 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.348 0.659 . . . . 0.0 109.989 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -84.9 2.42 42.77 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -148.8 22.0 1.0 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.775 0.322 . . . . 0.0 110.267 -177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . 0.488 ' HE2' ' OE1' ' A' ' 181' ' ' GLU . 31.8 tptt -58.13 161.77 3.92 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.706 0.803 . . . . 0.0 110.884 -175.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 76.2 p -147.2 157.74 43.7 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.595 0.758 . . . . 0.0 109.517 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -147.64 168.43 22.06 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.766 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -147.46 160.26 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 O-C-N 121.48 -0.762 . . . . 0.0 110.895 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 88.9 mmm -131.93 154.02 49.68 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 59.7 p -128.08 170.17 13.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.198 0.523 . . . . 0.0 109.99 166.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.501 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.4 t -149.3 164.65 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 O-C-N 121.663 -0.648 . . . . 0.0 109.43 -177.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.33 125.28 37.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 170.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.2 t -140.91 122.66 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -174.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.7 t70 56.79 8.29 0.47 Allowed 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 111.35 -15.7 27.38 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.304 -0.718 . . . . 0.0 111.304 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -74.06 171.28 13.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -138.88 136.26 35.35 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' A' ' 219' ' ' ALA . 71.2 m-85 -136.48 165.27 26.23 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -151.79 159.95 43.74 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -168.93 139.55 5.7 Favored Glycine 0 CA--C 1.532 1.103 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.8 p -120.46 152.0 38.57 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 121.651 0.739 . . . . 0.0 112.747 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . 0.418 ' HA3' ' HB2' ' A' ' 210' ' ' LEU . . . -155.84 173.23 33.88 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.427 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -69.11 -12.41 61.65 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.719 0.808 . . . . 0.0 110.155 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -152.83 168.21 26.49 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.94 0.896 . . . . 0.0 109.048 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -64.55 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -72.18 -45.74 59.14 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.177 -0.327 . . . . 0.0 110.698 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . 0.418 ' HB2' ' HA3' ' A' ' 205' ' ' GLY . 0.5 OUTLIER -68.44 -38.7 81.39 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.98 -48.34 80.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.554 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -71.91 -26.88 62.49 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 122.048 -0.407 . . . . 0.0 110.34 179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -69.63 -33.83 73.19 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 118.922 -0.561 . . . . 0.0 111.1 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.5 -38.18 34.98 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.136 0.88 . . . . 0.0 109.885 176.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.81 76.28 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.319 -0.238 . . . . 0.0 110.976 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.46 -20.68 26.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 111.154 178.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 10.0 tm0? -73.07 -40.37 65.09 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 69.0 m -73.58 -38.57 65.11 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 117.499 0.136 . . . . 0.0 110.975 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.407 ' HA ' ' CE2' ' A' ' 201' ' ' PHE . . . -63.43 -49.02 75.38 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 123.025 0.203 . . . . 0.0 110.584 178.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.402 HD23 ' C ' ' A' ' 220' ' ' LEU . 7.3 tt -58.63 -54.51 46.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 121.992 0.117 . . . . 0.0 110.696 179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -56.61 -59.95 4.26 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 122.327 -0.233 . . . . 0.0 110.841 -172.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 53.0 m -55.48 -60.1 3.9 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.8 -26.49 30.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -92.29 -0.32 57.4 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 118.059 0.39 . . . . 0.0 110.201 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 56.76 33.09 22.4 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 123.423 0.689 . . . . 0.0 111.065 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.8 mt -138.14 -161.56 1.19 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.923 1.289 . . . . 0.0 110.143 -174.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . 0.645 ' CG ' ' H ' ' A' ' 228' ' ' LEU . 13.2 t-80 -144.93 -164.57 1.96 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.367 0.667 . . . . 0.0 109.679 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.645 ' H ' ' CG ' ' A' ' 227' ' ' HIS . 24.2 tp -127.96 33.8 4.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 34.4 tp -136.08 164.73 27.35 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -147.33 -171.39 3.78 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.927 0.491 . . . . 0.0 110.566 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -140.11 172.43 12.77 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.446 0.698 . . . . 0.0 110.63 -175.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -120.79 -2.67 9.79 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 122.587 0.355 . . . . 0.0 110.873 -177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 54.54 12.26 0.52 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.079 1.352 . . . . 0.0 114.127 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -155.9 -0.57 0.14 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.703 0.401 . . . . 0.0 111.54 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -156.77 172.88 17.83 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 121.606 -0.684 . . . . 0.0 109.589 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 116.617 -1.658 . . . . 0.0 110.276 -178.761 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.419 0 C5'-C4'-O4' 113.929 3.378 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.038 0 O4'-C1'-N19 111.537 3.337 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.445 3.245 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.739 0 C4'-C3'-C2' 99.652 -3.048 . 0.709 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 O4'-C1'-N19 111.637 3.437 . 0.77 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.325 0 C4'-C3'-C2' 98.795 -3.905 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -3.249 0 C4'-C3'-C2' 99.241 -3.459 . 0.613 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.818 0 C4'-C3'-C2' 99.141 -3.559 . 0.777 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.952 0 C4'-C3'-C2' 100.016 -2.684 . 0.769 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.541 0 C4'-C3'-C2' 99.033 -3.667 . 0.612 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 C4'-C3'-C2' 98.877 -3.823 . 0.817 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.476 0 C4'-C3'-C2' 99.361 -3.339 . 0.685 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.453 0 C4'-C3'-C2' 99.418 -3.282 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 C4'-C3'-C2' 98.856 -3.844 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.83 0 C4'-C3'-C2' 98.972 -3.728 . 0.779 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 C4'-C3'-C2' 98.94 -3.76 . 0.684 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C4'-C3'-C2' 99.14 -3.56 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.1 0 C4'-C3'-C2' 98.95 -3.75 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.092 0 C4'-C3'-C2' 99.591 -3.109 . 0.702 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C4'-C3'-C2' 99.565 -3.135 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.444 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.333 0 C4'-C3'-C2' 99.379 -3.321 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.444 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.883 0 C4'-C3'-C2' 99.187 -3.513 . 0.83 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.108 1 O4'-C1'-N19 113.086 4.886 . 0.68 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C4'-C3'-C2' 99.791 -2.909 . 0.811 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.499 -3.201 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.083 0 C4'-C3'-C2' 98.859 -3.841 . 0.81 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.654 0 C4'-C3'-C2' 99.118 -3.582 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.812 0 O4'-C1'-N19 110.774 2.574 . 0.907 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C4'-C3'-C2' 99.288 -3.412 . 0.802 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 O4'-C1'-N19 111.629 3.429 . 0.587 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 C4'-C3'-C2' 99.813 -2.887 . 0.69 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.482 1 C4'-C3'-C2' 98.617 -4.083 . 0.757 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C4'-C3'-C2' 99.459 -3.241 . 0.733 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . 0.467 " H1'" ' N6 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C5'-C4'-C3' 112.006 -2.33 . 0.642 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.522 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.094 1 C5'-C4'-C3' 109.343 -4.105 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.522 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.41 -3.558 2 C3'-C2'-C1' 105.668 4.631 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.53 0 C5'-C4'-C3' 112.545 -1.97 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.467 ' N6 ' " H1'" ' B' ' 270' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.414 -3.227 0 C4'-C3'-C2' 99.863 -2.837 . 0.841 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 C4'-C3'-C2' 98.973 -3.727 . 0.667 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.583 0 C4'-C3'-C2' 99.275 -3.425 . 0.619 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.417 0 O4'-C1'-N19 111.951 3.751 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 C4'-C3'-C2' 99.858 -2.842 . 0.914 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.965 -3.735 . 0.844 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 98.863 -3.837 . 0.824 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.934 -3.766 . 0.871 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.114 0 C4'-C3'-C2' 99.594 -3.106 . 0.834 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.903 0 C4'-C3'-C2' 99.253 -3.447 . 0.85 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.962 0 C4'-C3'-C2' 99.636 -3.064 . 0.845 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.996 0 C5'-C4'-C3' 111.297 -2.802 . 0.896 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.672 1 O4'-C1'-N19 112.503 4.303 . 0.529 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 0 O4'-C1'-N19 112.011 3.811 . 0.507 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 C4'-C3'-C2' 100.263 -2.437 . 0.831 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 111.542 3.342 . 0.837 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 C4'-C3'-C2' 98.825 -3.875 . 0.882 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . 0.41 " H1'" ' CE ' ' A' ' 165' ' ' MET . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 O4'-C1'-N19 111.911 3.711 . 0.421 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.476 1 C4'-C3'-C2' 98.644 -4.056 . 0.732 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.168 0 C4'-C3'-C2' 99.951 -2.749 . 0.562 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.449 0 C4'-C3'-C2' 99.415 -3.285 . 0.67 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 110.916 2.716 . 0.87 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.635 3.435 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.164 0 C4'-C3'-C2' 99.053 -3.647 . 0.662 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.746 0 C4'-C3'-C2' 99.534 -3.166 . 0.595 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C5'-C4'-C3' 111.568 -2.621 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C4'-C3'-C2' 99.13 -3.57 . 0.75 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.886 0 C4'-C3'-C2' 98.748 -3.952 . 0.647 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.337 0 C4'-C3'-C2' 98.848 -3.852 . 0.649 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.292 0 C4'-C3'-C2' 99.075 -3.625 . 0.782 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 1 O4'-C1'-N19 112.266 4.066 . 0.851 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C4'-C3'-C2' 99.022 -3.678 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.462 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 C4'-C3'-C2' 97.329 -5.371 . 0.685 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.462 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.708 1 O4'-C1'-N19 112.445 4.245 . 0.765 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.52 -0.221 0 CA-C-O 120.961 0.317 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.81 178.52 48.51 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.45 123.75 10.85 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.573 3.516 . . . . 0.0 111.868 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.4 p -154.28 11.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.033 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -140.23 156.35 70.0 Favored Pre-proline 0 C--O 1.23 0.059 0 C-N-CA 124.026 0.93 . . . . 0.0 110.068 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.02 -39.7 7.55 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.558 2.172 . . . . 0.0 108.986 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -52.36 -40.86 62.53 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -56.56 -61.7 2.24 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.06 0.544 . . . . 0.0 110.915 177.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.1 -32.28 67.94 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 118.588 0.631 . . . . 0.0 111.851 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 mp -73.39 -55.14 6.77 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -173.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -42.49 99.79 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.754 0.421 . . . . 0.0 111.14 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -57.75 -51.56 69.07 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 122.695 0.398 . . . . 0.0 111.166 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.42 -45.49 84.55 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 117.776 0.262 . . . . 0.0 110.452 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -55.37 -36.19 66.07 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 123.25 0.344 . . . . 0.0 110.55 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.49 -56.45 7.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 112.596 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.8 pt -70.91 -33.04 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HD2' HD12 ' A' ' 20' ' ' LEU . 10.7 pttp -61.84 144.71 93.23 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 119.589 1.086 . . . . 0.0 111.274 -176.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -89.35 -5.36 5.6 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 124.293 3.328 . . . . 0.0 109.972 168.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 135.34 138.96 3.95 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 104.755 -3.338 . . . . 0.0 104.755 -169.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -155.57 -179.48 8.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.592 1.696 . . . . 0.0 113.76 -172.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.6 ' N ' HD22 ' A' ' 20' ' ' LEU . 33.9 mt-30 -130.84 135.62 47.89 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.978 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -107.71 134.63 50.4 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 171.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.2 ptp -134.7 142.54 46.83 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 176.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.586 HD22 ' H ' ' A' ' 25' ' ' LEU . 2.9 tm? -106.24 142.49 35.84 Favored 'General case' 0 C--O 1.228 -0.056 0 C-N-CA 124.258 1.023 . . . . 0.0 109.547 -174.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.586 ' H ' HD22 ' A' ' 24' ' ' LEU . 96.1 mt -140.61 162.68 34.8 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 -168.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.628 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.7 m 64.83 -110.1 0.22 Allowed 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 125.623 1.827 . . . . 0.0 107.312 174.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER 74.73 69.11 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.21 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 t -167.05 165.03 15.94 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -171.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.74 -159.33 31.27 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.88 5.98 3.15 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 123.579 2.853 . . . . 0.0 112.498 176.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 t 75.57 -1.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 125.082 1.353 . . . . 0.0 112.486 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -125.53 1.12 7.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.034 0.534 . . . . 0.0 110.327 175.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.473 ' N ' ' HD3' ' A' ' 34' ' ' PRO . . . -140.56 59.17 11.3 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 167.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 33' ' ' ALA . 73.1 Cg_exo -53.66 135.85 63.18 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.661 2.907 . . . . 0.0 112.116 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.2 tm? -113.35 110.64 20.66 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.921 0.867 . . . . 0.0 112.857 178.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.402 ' CD2' ' HG2' ' A' ' 27' ' ' GLN . 15.8 m-85 -104.84 139.86 38.97 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 114.222 -1.354 . . . . 0.0 107.696 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.628 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 17.7 t -125.74 104.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.372 -175.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG2' HD23 ' A' ' 24' ' ' LEU . 22.0 mtp -100.42 129.7 46.42 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -176.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 56.0 p -121.95 135.32 54.85 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.447 ' CG2' HD23 ' A' ' 20' ' ' LEU . 14.6 p -113.99 135.54 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -173.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -117.1 122.01 42.92 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 124.081 0.863 . . . . 0.0 110.676 -175.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.433 HG21 ' CE2' ' A' ' 69' ' ' PHE . 19.9 t -135.48 133.72 52.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 O-C-N 124.646 1.217 . . . . 0.0 108.274 175.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.0 t30 50.67 15.46 0.23 Allowed 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.17 5.67 59.31 Favored Glycine 0 C--N 1.342 0.913 0 O-C-N 121.626 -0.672 . . . . 0.0 113.103 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -104.62 127.12 52.27 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 17.0 t -118.65 132.77 67.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -176.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.439 ' O ' ' HA ' ' A' ' 39' ' ' SER . 69.5 m-85 -130.11 135.66 48.46 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -110.65 138.34 47.17 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.593 -167.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -134.62 135.67 8.1 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 p -126.05 117.19 22.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.073 0.464 . . . . 0.0 110.618 -173.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.0 171.01 33.82 Favored Glycine 0 CA--C 1.526 0.768 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.17 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.11 139.0 45.25 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.653 2.902 . . . . 0.0 108.142 170.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.261 8.8 t 58.2 153.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 O-C-N 124.428 1.08 . . . . 0.0 113.8 -175.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -67.03 -26.53 66.81 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.435 0.694 . . . . 0.0 112.314 -173.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -60.59 -65.19 0.73 Allowed 'General case' 0 N--CA 1.459 -0.019 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.95 -41.14 74.23 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.296 0.639 . . . . 0.0 112.085 -177.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.83 -59.18 5.41 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 117.741 0.246 . . . . 0.0 111.55 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -59.41 -36.65 76.25 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -178.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.05 -63.83 1.05 Allowed 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 123.34 0.656 . . . . 0.0 110.898 -179.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -57.35 -38.74 74.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.282 0.233 . . . . 0.0 111.251 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.71 82.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.492 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.53 -44.22 84.94 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 123.082 0.553 . . . . 0.0 111.784 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.29 -53.19 60.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.175 0.59 . . . . 0.0 110.862 178.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -55.58 -56.29 22.01 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.998 178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.69 -45.62 77.79 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.086 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tp -51.06 -62.61 1.51 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.62 -28.01 66.82 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.262 -175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.1 t -76.09 -78.29 0.12 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 175.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.433 ' CE2' HG21 ' A' ' 42' ' ' VAL . 1.2 p90 -61.7 -7.04 2.99 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -49.94 -22.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 120.262 1.392 . . . . 0.0 112.477 173.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -83.65 -11.16 57.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.89 0.768 . . . . 0.0 112.027 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -146.02 64.25 9.85 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 123.988 0.915 . . . . 0.0 110.274 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.5 4.98 2.17 Favored 'Trans proline' 0 CA--C 1.536 0.607 1 C-N-CA 125.364 4.043 . . . . 0.0 112.531 -177.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -144.36 -176.58 5.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.233 0.613 . . . . 0.0 110.385 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -142.76 174.81 10.32 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.184 0.594 . . . . 0.0 110.033 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.3 p -149.79 12.56 0.79 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.434 0.294 . . . . 0.0 111.629 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -147.86 162.34 39.47 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 178.01 10.05 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.059 0.944 . . . . 0.0 109.91 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -146.75 175.08 10.89 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.201 0.6 . . . . 0.0 110.148 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.2 mt -140.3 13.78 2.39 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.703 0.801 . . . . 0.0 110.24 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -149.87 159.41 44.4 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 122.567 0.347 . . . . 0.0 110.925 -178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 24.3 ptp -160.73 -178.09 6.61 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 122.986 0.514 . . . . 0.0 110.387 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -170.54 171.64 43.76 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 ttm180 -156.9 164.7 37.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.202 0.601 . . . . 0.0 110.317 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.3 m -71.43 -5.26 31.49 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.693 0.797 . . . . 0.0 111.932 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 89.2 mt 49.41 32.48 4.66 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.549 0.74 . . . . 0.0 112.399 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.0 t -130.69 14.65 5.39 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.512 0.725 . . . . 0.0 109.402 178.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 8.3 p -147.65 27.85 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.962 1.305 . . . . 0.0 108.919 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -131.9 8.55 4.47 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.412 -176.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.2 m 48.97 26.56 1.38 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.774 1.23 . . . . 0.0 112.919 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -65.59 -16.78 64.04 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.886 -0.509 . . . . 0.0 110.461 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -158.71 178.26 10.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.251 1.02 . . . . 0.0 108.811 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 81.8 p -139.21 178.45 7.17 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 122.62 0.368 . . . . 0.0 110.918 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.8 p -139.47 13.24 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.274 0.63 . . . . 0.0 111.431 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 55.41 -175.62 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.624 1.17 . . . . 0.0 113.26 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -152.31 152.02 31.6 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.606 0.762 . . . . 0.0 109.396 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.15 7.5 0.39 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 122.555 0.342 . . . . 0.0 111.18 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -149.6 173.55 13.52 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -143.9 155.01 59.34 Favored Pre-proline 0 N--CA 1.454 -0.226 0 C-N-CA 123.255 0.622 . . . . 0.0 109.976 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.05 8.65 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 124.254 3.303 . . . . 0.0 112.784 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -148.94 159.61 44.04 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.236 0.615 . . . . 0.0 110.342 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 77.4 p -143.17 -2.68 0.99 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.704 0.802 . . . . 0.0 112.11 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.09 161.01 25.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.195 0.452 . . . . 0.0 110.076 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.53 -179.47 7.81 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.743 0.417 . . . . 0.0 110.692 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -144.82 -178.32 5.96 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.429 0.691 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.38 -158.87 9.25 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -128.46 7.92 5.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.643 0.377 . . . . 0.0 111.734 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 49.97 -163.11 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.846 1.258 . . . . 0.0 113.592 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 5.2 t -43.42 138.01 2.87 Favored Pre-proline 0 C--N 1.34 0.189 0 C-N-CA 125.699 1.6 . . . . 0.0 112.387 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -79.01 2.4 8.32 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.98 3.12 . . . . 0.0 111.964 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.8 t0 54.86 28.35 10.3 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.17 0.588 . . . . 0.0 111.957 -177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -142.58 159.31 42.47 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.822 1.249 . . . . 0.0 108.828 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.9 p -150.44 163.66 37.83 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -163.03 154.57 14.96 Favored Pre-proline 0 N--CA 1.456 -0.15 0 C-N-CA 124.26 1.024 . . . . 0.0 109.17 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -70.23 156.65 61.64 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.64 2.227 . . . . 0.0 110.219 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.82 175.09 11.75 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 123.735 2.957 . . . . 0.0 111.09 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -143.16 15.17 1.87 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.001 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -146.63 169.21 19.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.345 0.658 . . . . 0.0 109.448 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 57.7 t -141.47 151.05 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 122.787 0.435 . . . . 0.0 109.833 -177.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -179.96 -173.22 44.76 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 -178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.0 t -152.59 168.04 26.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.119 0.459 . . . . 0.0 110.738 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -144.24 9.01 1.42 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.041 0.536 . . . . 0.0 111.094 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.42 -173.24 41.0 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 -177.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -143.31 2.76 1.3 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -67.16 0.24 2.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.752 0.821 . . . . 0.0 111.476 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.4 m -136.3 14.75 3.24 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.354 0.662 . . . . 0.0 111.252 -179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -142.36 -1.9 1.15 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.848 0.459 . . . . 0.0 111.563 179.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 60.9 m -145.1 5.69 1.12 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.506 0.722 . . . . 0.0 110.697 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.0 m -148.48 177.87 9.09 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.903 0.881 . . . . 0.0 110.635 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 80.8 p -148.43 168.46 22.61 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.894 0.878 . . . . 0.0 110.56 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 173.14 -161.69 32.8 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -141.71 158.07 44.27 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 5.3 p -149.09 6.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.445 0.698 . . . . 0.0 110.061 -176.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.3 t -66.44 8.28 0.25 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.772 0.829 . . . . 0.0 112.705 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.1 mt -135.12 11.12 3.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.164 0.586 . . . . 0.0 111.042 -178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 63.8 p -147.57 5.85 0.82 Allowed 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.62 -0.08 0.85 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.644 0.656 . . . . 0.0 112.469 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 81.9 p -158.83 160.79 29.1 Favored Pre-proline 0 C--O 1.234 0.249 0 O-C-N 122.06 -0.4 . . . . 0.0 110.729 179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.23 163.43 4.64 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.63 2.886 . . . . 0.0 112.157 173.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 26.7 m -59.99 152.78 58.88 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.673 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -77.22 0.34 9.84 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.827 3.018 . . . . 0.0 111.604 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.98 163.29 17.51 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 121.434 0.635 . . . . 0.0 111.628 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 66.7 p -84.49 178.73 7.61 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.26 0.624 . . . . 0.0 110.743 178.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 45.62 40.39 5.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.39 1.076 . . . . 0.0 111.832 178.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 6.2 t -121.2 4.5 10.33 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.597 0.359 . . . . 0.0 111.887 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 36.26 66.73 1.8 Allowed Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 125.626 1.57 . . . . 0.0 112.496 177.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.15 165.79 31.28 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.611 2.874 . . . . 0.0 110.814 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -50.96 155.58 5.77 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.118 3.212 . . . . 0.0 112.794 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.421 ' N ' HD23 ' A' ' 149' ' ' LEU . 2.1 pt? -152.78 153.53 30.23 Favored Pre-proline 0 CA--C 1.531 0.212 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.13 9.62 2.02 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.292 3.328 . . . . 0.0 113.764 -171.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 17.3 tt -56.78 138.23 77.97 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 118.401 0.546 . . . . 0.0 109.628 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -51.28 133.98 43.44 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.858 2.372 . . . . 0.0 111.438 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.68 166.65 25.22 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.93 3.087 . . . . 0.0 110.552 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.02 173.14 14.11 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.994 2.463 . . . . 0.0 109.836 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -153.04 143.65 15.7 Favored Pre-proline 0 C--O 1.233 0.224 0 O-C-N 121.634 -0.666 . . . . 0.0 110.404 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -52.55 166.85 0.68 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.474 3.449 . . . . 0.0 112.684 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.07 155.61 5.98 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.71 2.94 . . . . 0.0 111.969 177.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.37 15.05 0.68 Allowed 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 124.877 3.718 . . . . 0.0 111.685 -177.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 30.6 m -63.53 -5.69 4.16 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -176.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 90.54 11.65 62.05 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 118.574 0.625 . . . . 0.0 112.17 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -146.93 -175.6 4.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 117.439 0.62 . . . . 0.0 111.393 -178.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.436 ' HB2' ' HD2' ' A' ' 163' ' ' PRO . 51.7 p-10 -128.05 159.81 64.85 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.436 ' HD2' ' HB2' ' A' ' 162' ' ' ASN . 59.8 Cg_endo -70.69 -13.81 32.64 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.755 2.303 . . . . 0.0 110.767 -175.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 86.4 t -62.8 -38.84 82.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 122.615 0.366 . . . . 0.0 110.517 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 93.2 mmm -86.55 -41.82 14.01 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.329 -176.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 54.1 mt -52.46 -50.05 40.88 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 167' ' ' LEU . 2.2 tt -64.41 -48.1 76.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -74.76 15.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.39 0.676 . . . . 0.0 112.109 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -136.84 -25.56 1.09 Allowed 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.95 -0.469 . . . . 0.0 111.448 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.86 20.75 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.664 -0.647 . . . . 0.0 109.98 176.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -159.05 74.98 3.38 Favored Pre-proline 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 -177.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.38 -177.64 1.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.111 2.541 . . . . 0.0 109.239 175.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 107.07 38.18 2.2 Favored Glycine 0 CA--C 1.525 0.685 0 O-C-N 121.807 -0.558 . . . . 0.0 112.469 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 -176.37 3.98 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 117.595 0.697 . . . . 0.0 110.641 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.424 ' HB2' ' HE3' ' A' ' 175' ' ' LYS . 43.0 mtmt -142.97 152.79 42.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.46 ' CG ' HG13 ' A' ' 194' ' ' VAL . 32.9 m-85 -130.54 150.22 51.84 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -132.38 165.22 24.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.849 173.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -122.05 140.1 52.91 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.88 159.86 32.68 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 123.868 0.73 . . . . 0.0 110.737 -173.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 91.2 p -42.04 159.36 0.02 OUTLIER 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 128.422 2.689 . . . . 0.0 116.352 -167.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.411 ' HB2' ' HE2' ' A' ' 188' ' ' LYS . 0.0 OUTLIER -136.39 159.72 40.92 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 113.214 -1.812 . . . . 0.0 111.728 -176.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.4 p -165.1 165.29 20.02 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.158 0.583 . . . . 0.0 109.9 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 123.39 175.75 14.59 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 177.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.37 159.63 34.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 49.4 m -61.99 -6.72 3.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -127.04 12.93 7.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.365 0.266 . . . . 0.0 110.68 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -147.72 15.59 1.1 Allowed 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 181' ' ' GLU . 63.6 tttt -61.29 158.74 13.64 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.386 1.074 . . . . 0.0 112.285 -176.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 87.3 p -141.64 157.41 45.11 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.208 0.527 . . . . 0.0 109.952 175.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -144.25 169.43 17.91 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 -174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -145.93 160.67 11.55 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 O-C-N 121.007 -1.058 . . . . 0.0 111.411 176.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 91.9 mmm -130.56 157.5 42.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 202' ' ' GLU . 78.3 p -129.51 173.06 10.92 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 167.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.46 HG13 ' CG ' ' A' ' 176' ' ' TYR . 1.6 t -149.89 162.58 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-O 121.11 0.481 . . . . 0.0 109.964 -177.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 99.2 t -137.3 126.85 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.8 p -147.95 133.46 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 38.3 t70 53.75 9.93 0.22 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.07 46.96 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -75.36 174.1 10.02 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.583 0.753 . . . . 0.0 109.54 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -139.41 140.29 37.35 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -138.0 167.81 21.02 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.173 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 193' ' ' SER . 40.2 tt0 -151.23 161.71 42.23 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -172.59 139.23 5.13 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 94.1 p -119.62 153.29 35.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -161.96 171.5 37.9 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.786 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -71.45 -9.7 58.59 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.715 0.806 . . . . 0.0 112.838 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -150.2 156.42 41.56 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.687 0.795 . . . . 0.0 109.324 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.91 -34.03 72.66 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -174.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -65.85 -41.19 92.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 118.317 0.508 . . . . 0.0 111.135 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.73 -38.77 64.68 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -57.58 -39.45 76.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.082 -0.386 . . . . 0.0 111.686 176.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 21.4 tttp -76.5 -34.64 58.61 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -66.86 -16.97 64.66 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 122.196 -0.315 . . . . 0.0 110.98 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -96.86 -44.74 6.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 122.812 0.445 . . . . 0.0 110.476 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -62.2 -35.16 78.03 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 174.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -79.12 -42.67 25.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.563 0.745 . . . . 0.0 110.719 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -47.06 -40.75 15.64 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 123.444 0.465 . . . . 0.0 110.487 169.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 57.0 m -76.05 -40.98 52.16 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 121.799 -0.563 . . . . 0.0 111.952 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.71 -43.24 89.72 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.125 0.17 . . . . 0.0 111.008 -178.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.53 -51.65 67.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -50.62 -63.75 1.03 Allowed 'General case' 0 CA--C 1.54 0.568 0 O-C-N 123.076 0.235 . . . . 0.0 111.54 -175.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 86.5 m -61.74 -51.14 69.58 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -176.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.0 -22.76 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.676 0.671 . . . . 0.0 112.036 -174.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 167' ' ' LEU . 2.5 m-30 -105.76 8.9 33.09 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 118.384 0.538 . . . . 0.0 111.474 -175.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 32.92 22.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.099 0.959 . . . . 0.0 112.512 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 86.7 mt -132.09 -172.64 2.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.729 0.811 . . . . 0.0 110.573 -175.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -145.77 18.44 1.46 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.954 0.501 . . . . 0.0 111.549 -177.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 228' ' ' LEU . 15.0 tp 50.14 31.7 5.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.596 1.158 . . . . 0.0 111.9 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 70.7 mt 61.51 8.1 2.09 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.897 1.679 . . . . 0.0 113.497 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.89 155.34 36.7 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.344 -0.847 . . . . 0.0 110.365 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -158.73 170.04 23.04 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.066 -0.396 . . . . 0.0 110.531 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -91.22 0.97 57.43 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.989 0.516 . . . . 0.0 111.501 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -143.56 176.32 9.29 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.564 0.746 . . . . 0.0 109.17 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -151.1 161.96 41.75 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.618 0.247 . . . . 0.0 111.484 -174.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.36 160.08 42.95 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.102 0.961 . . . . 0.0 109.437 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.861 179.105 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C4'-C3'-C2' 99.118 -3.582 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.97 0 C4'-C3'-C2' 99.204 -3.496 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.757 0 C4'-C3'-C2' 99.595 -3.105 . 0.847 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.577 0 C4'-C3'-C2' 99.215 -3.485 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.865 3.665 . 0.599 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.59 0 C4'-C3'-C2' 98.765 -3.935 . 0.808 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.859 0 C4'-C3'-C2' 98.905 -3.795 . 0.704 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 C4'-C3'-C2' 99.376 -3.324 . 0.713 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 C4'-C3'-C2' 99.702 -2.998 . 0.771 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.364 0 O4'-C1'-N19 111.548 3.348 . 0.524 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 O4'-C1'-N19 111.756 3.556 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 O4'-C1'-N19 111.349 3.149 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.894 0 C4'-C3'-C2' 99.872 -2.828 . 0.791 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 C4'-C3'-C2' 99.524 -3.176 . 0.775 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 0 C4'-C3'-C2' 99.416 -3.284 . 0.799 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.971 0 C4'-C3'-C2' 99.088 -3.612 . 0.631 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.396 0 C4'-C3'-C2' 98.973 -3.727 . 0.708 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C4'-C3'-C2' 99.6 -3.1 . 0.723 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.429 0 O4'-C1'-N19 111.031 2.831 . 0.724 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C4'-C3'-C2' 99.253 -3.447 . 0.626 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.16 0 C4'-C3'-C2' 99.212 -3.488 . 0.807 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.936 0 C4'-C3'-C2' 99.409 -3.291 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.529 1 C4'-C3'-C2' 98.385 -4.315 . 0.724 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C4'-C3'-C2' 99.083 -3.617 . 0.755 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.42 0 C4'-C3'-C2' 99.939 -2.761 . 0.868 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C4'-C3'-C2' 99.647 -3.053 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.079 0 C4'-C3'-C2' 99.112 -3.588 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C4'-C3'-C2' 98.805 -3.895 . 0.878 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C4'-C3'-C2' 99.937 -2.763 . 0.835 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.737 0 C4'-C3'-C2' 99.646 -3.054 . 0.805 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.425 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.805 0 C4'-C3'-C2' 99.663 -3.037 . 0.667 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.557 -3.143 . 0.763 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 0 C4'-C3'-C2' 99.831 -2.869 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 0 N19-C1'-C2' 108.7 -2.938 . 0.722 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.584 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 C5'--C4' 1.542 2.455 1 C4'-C3'-O3' 121.345 4.133 . 0.192 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.584 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.921 3 P-O3'-C3' 125.399 4.749 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.583 0 C4'-C3'-C2' 99.894 -2.806 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.264 0 C4'-C3'-C2' 99.694 -3.006 . 0.761 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 C4'-C3'-C2' 98.93 -3.77 . 0.581 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . 0.41 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.392 1 C4'-C3'-C2' 98.545 -4.155 . 0.684 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.528 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.417 -2.998 0 C4'-C3'-C2' 100.023 -2.677 . 0.55 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.528 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C4'-C3'-C2' 99.7 -3.0 . 0.774 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.663 1 C4'-C3'-C2' 98.383 -4.317 . 0.783 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C4'-C3'-C2' 98.978 -3.722 . 0.736 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.578 1 C4'-C3'-C2' 98.556 -4.144 . 0.906 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C4'-C3'-C2' 99.01 -3.69 . 0.83 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.344 0 C4'-C3'-C2' 99.393 -3.307 . 0.861 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.95 0 C4'-C3'-C2' 99.214 -3.486 . 0.825 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.014 0 C4'-C3'-C2' 100.095 -2.605 . 0.872 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.545 1 O4'-C1'-N19 113.075 4.875 . 0.573 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.424 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.74 0 C4'-C3'-C2' 99.539 -3.161 . 0.542 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.424 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.285 0 C4'-C3'-C2' 99.9 -2.8 . 0.738 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.102 0 O4'-C1'-N19 111.392 3.192 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 C4'-C3'-C2' 99.149 -3.551 . 0.864 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.761 -2.939 . 0.496 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C4'-C3'-C2' 99.275 -3.425 . 0.745 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 C4'-C3'-C2' 99.519 -3.181 . 0.692 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 1 O4'-C1'-N19 112.227 4.027 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.495 3.295 . 0.833 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.616 2.264 0 C4'-C3'-C2' 99.443 -3.257 . 0.731 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C4'-C3'-C2' 99.136 -3.564 . 0.662 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.033 0 O4'-C1'-N19 112.007 3.807 . 0.584 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.009 0 C4'-C3'-C2' 99.473 -3.227 . 0.86 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C4'-C3'-C2' 99.356 -3.344 . 0.739 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.866 0 C4'-C3'-C2' 98.815 -3.885 . 0.653 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.899 0 C4'-C3'-C2' 99.255 -3.445 . 0.668 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.701 0 C4'-C3'-C2' 99.112 -3.588 . 0.789 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.877 0 C4'-C3'-C2' 98.782 -3.918 . 0.832 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.839 0 C4'-C3'-C2' 99.977 -2.723 . 0.843 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.455 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.459 1 C4'-C3'-C2' 97.849 -4.851 . 0.777 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.455 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.417 -2.989 0 O4'-C1'-N19 111.75 3.55 . 0.812 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.983 0.34 . . . . 0.0 112.983 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.4 177.54 48.3 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 178.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -50.89 156.98 4.14 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 124.928 3.752 . . . . 0.0 114.083 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.8 p -154.0 136.35 6.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.8 tp 41.73 54.86 8.69 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.467 0.707 . . . . 0.0 111.718 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.8 -16.99 37.65 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.646 2.897 . . . . 0.0 111.821 -173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.43 -26.96 33.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 119.412 -0.328 . . . . 0.0 111.441 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -56.73 -67.83 0.27 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.151 0.282 . . . . 0.0 111.225 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.31 -34.59 68.88 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.591 0.357 . . . . 0.0 111.628 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.42 -60.45 3.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.792 0.269 . . . . 0.0 110.348 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 64.2 mtt -63.59 -41.58 98.35 Favored 'General case' 0 CA--C 1.518 -0.259 0 O-C-N 123.563 0.539 . . . . 0.0 112.262 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -58.56 -46.14 87.5 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.63 -43.38 98.97 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.793 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -57.86 -32.45 67.66 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.578 -0.701 . . . . 0.0 110.817 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.57 -57.41 4.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.016 0.527 . . . . 0.0 111.051 177.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 6.5 pt -65.25 -21.63 29.7 Favored 'Isoleucine or valine' 0 C--N 1.343 0.294 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.504 ' HG3' HD12 ' A' ' 20' ' ' LEU . 35.8 ttmt -43.83 100.26 0.22 Allowed Pre-proline 0 C--O 1.241 0.614 0 C-N-CA 127.41 2.284 . . . . 0.0 113.244 -177.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ILE . 43.8 Cg_endo -82.39 -11.22 10.77 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.997 2.465 . . . . 0.0 109.168 171.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.69 37.02 0.11 Allowed Glycine 0 CA--C 1.53 0.983 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.7 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.23 169.52 1.13 Allowed 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -171.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.7 ' N ' HD22 ' A' ' 20' ' ' LEU . 18.3 mt-30 -134.3 135.49 42.85 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.706 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 58' ' ' LYS . 19.5 m-85 -105.26 135.24 46.99 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 174.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.1 ptp -135.67 142.79 45.2 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.413 0.625 . . . . 0.0 110.578 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.573 HD22 ' H ' ' A' ' 25' ' ' LEU . 3.0 tm? -105.33 141.2 37.26 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.774 1.23 . . . . 0.0 108.149 -173.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.573 ' H ' HD22 ' A' ' 24' ' ' LEU . 95.2 mt -138.96 161.68 36.76 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -168.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.601 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 15.7 m 67.5 -111.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.554 1.784 . . . . 0.0 108.528 171.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 75.29 72.29 0.09 Allowed 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.11 162.72 34.09 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.8 -169.47 33.52 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -175.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -74.27 8.76 2.01 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 124.06 3.174 . . . . 0.0 113.135 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 t 75.14 2.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 0.0 111.92 176.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -130.96 -7.02 3.94 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.574 -0.704 . . . . 0.0 110.42 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -136.9 60.23 28.09 Favored Pre-proline 0 N--CA 1.453 -0.286 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 168.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -70.32 135.85 30.12 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 125.001 3.8 . . . . 0.0 110.983 -174.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.457 ' C ' HD13 ' A' ' 35' ' ' LEU . 3.4 tm? -106.65 113.04 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.923 0.868 . . . . 0.0 112.558 -176.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -106.18 139.83 40.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 113.937 -1.483 . . . . 0.0 107.444 -175.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.601 ' CG2' ' HB2' ' A' ' 26' ' ' SER . 23.2 t -125.49 104.07 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.503 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.494 ' HG2' HD23 ' A' ' 24' ' ' LEU . 19.7 mtp -100.62 132.37 46.05 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -176.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HA ' ' O ' ' A' ' 47' ' ' PHE . 85.0 p -128.39 135.73 49.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.523 ' CG2' HD23 ' A' ' 20' ' ' LEU . 9.3 p -114.51 149.88 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -172.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -134.68 127.92 32.0 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -169.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.559 HG11 ' CE2' ' A' ' 69' ' ' PHE . 17.0 t -135.71 123.84 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 55.28 -5.78 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.558 1.543 . . . . 0.0 114.433 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 131.73 -0.88 5.07 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.62 1.555 . . . . 0.0 112.005 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -102.84 130.58 49.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 176.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 23.0 t -126.11 135.51 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -176.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' A' ' 39' ' ' SER . 77.5 m-85 -133.91 135.55 43.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -114.71 136.72 52.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.236 0.541 . . . . 0.0 111.631 -167.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -129.08 135.6 8.54 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 107.583 -2.207 . . . . 0.0 107.583 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -128.9 114.32 16.34 Favored 'General case' 0 CA--C 1.523 -0.066 0 C-N-CA 123.23 0.612 . . . . 0.0 110.617 -172.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.39 168.26 33.63 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.629 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' O ' HG22 ' A' ' 53' ' ' THR . 58.3 Cg_endo -67.7 141.21 53.9 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.264 2.643 . . . . 0.0 107.31 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 52' ' ' PRO 0.294 9.5 t 58.11 147.91 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.174 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -68.64 -23.66 64.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.301 -0.863 . . . . 0.0 113.12 -174.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -55.81 -68.81 0.17 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.561 0.345 . . . . 0.0 111.811 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -55.36 -42.34 73.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.328 1.051 . . . . 0.0 111.818 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.97 -61.2 2.54 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 122.115 -0.366 . . . . 0.0 111.549 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.493 ' HE3' H5'' ' B' ' 277' ' ' ' G' . 2.5 pttm -59.58 -38.9 82.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -177.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.58 -59.87 4.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.731 0.812 . . . . 0.0 110.038 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' CE1' ' HE3' ' A' ' 64' ' ' LYS . 3.6 t-80 -55.63 -44.78 77.43 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.132 0.492 . . . . 0.0 110.831 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.65 -48.25 75.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 122.108 -0.37 . . . . 0.0 110.027 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.9 -47.19 81.11 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.771 0.829 . . . . 0.0 111.361 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.02 -53.02 61.98 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.381 0.672 . . . . 0.0 110.925 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HE3' ' CE1' ' A' ' 60' ' ' HIS . 98.0 mttt -55.69 -58.04 9.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.597 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.22 -37.87 75.7 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.6 tp -55.29 -59.54 4.65 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 70.6 mtt85 -65.61 -26.71 67.95 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -174.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.0 t -73.38 -56.13 5.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 119.203 -0.999 . . . . 0.0 109.888 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.783 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 21.2 t80 -57.45 -31.52 66.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.112 1.765 . . . . 0.0 113.872 -174.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.3 m -56.7 -14.26 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 CA-C-N 119.775 1.17 . . . . 0.0 112.508 176.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -107.92 -6.68 16.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.513 0.725 . . . . 0.0 111.097 179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 10.5 m-85 -144.21 54.54 2.85 Favored Pre-proline 0 C--N 1.341 0.239 0 CA-C-O 120.497 0.189 . . . . 0.0 110.92 176.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.783 ' HA ' ' CE1' ' A' ' 69' ' ' PHE . 72.0 Cg_endo -68.73 -5.4 15.33 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 124.87 3.714 . . . . 0.0 112.884 -178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -149.4 17.96 0.93 Allowed 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.79 -0.569 . . . . 0.0 110.895 -177.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.78 172.2 15.02 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.915 -0.49 . . . . 0.0 110.876 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 88.9 p -155.94 6.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.16 -2.61 19.32 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.8 -0.563 . . . . 0.0 111.777 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.9 174.92 13.01 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.62 0.768 . . . . 0.0 109.672 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -157.1 177.06 11.92 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 122.899 0.48 . . . . 0.0 111.642 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 51.8 tp -152.43 166.14 32.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.892 1.277 . . . . 0.0 107.878 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.07 157.64 44.34 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.314 0.578 . . . . 0.0 110.735 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 84.2 mtp -146.52 24.6 1.24 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.063 0.945 . . . . 0.0 110.229 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.23 174.55 23.76 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 111.339 -0.704 . . . . 0.0 111.339 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -154.4 -175.9 5.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.113 0.565 . . . . 0.0 111.226 -175.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.0 m -53.79 155.51 3.24 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 124.573 1.149 . . . . 0.0 110.913 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 97.0 mt -134.11 178.52 6.9 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.869 0.868 . . . . 0.0 110.174 -177.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.7 t -149.92 -170.72 3.72 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.456 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -57.38 168.41 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.239 0.616 . . . . 0.0 111.781 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -145.41 174.49 11.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.435 0.694 . . . . 0.0 109.614 -175.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.1 t -145.16 166.64 24.83 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 123.034 0.534 . . . . 0.0 111.209 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -153.17 -175.67 5.44 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.532 0.733 . . . . 0.0 109.392 -175.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -134.26 169.41 17.24 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 121.16 0.505 . . . . 0.0 110.848 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 t -149.79 -176.0 5.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.756 0.822 . . . . 0.0 109.035 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.0 m -140.44 177.55 7.93 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.376 0.608 . . . . 0.0 111.823 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.79 179.15 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.502 0.721 . . . . 0.0 110.046 -177.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.58 165.63 26.74 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.2 0.6 . . . . 0.0 111.141 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.22 169.82 11.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.956 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -153.94 165.11 37.13 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.407 0.683 . . . . 0.0 109.776 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -145.61 154.62 52.55 Favored Pre-proline 0 N--CA 1.456 -0.148 0 C-N-CA 122.905 0.482 . . . . 0.0 109.903 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.51 171.86 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.919 3.08 . . . . 0.0 111.256 -178.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -151.59 163.8 38.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.725 0.81 . . . . 0.0 109.775 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.6 p -146.47 171.72 14.62 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.375 0.67 . . . . 0.0 110.198 -177.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.7 mt -141.56 168.31 20.08 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.118 0.967 . . . . 0.0 109.614 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -146.48 176.36 9.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 122.561 0.344 . . . . 0.0 110.329 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -62.91 169.1 3.46 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.244 0.618 . . . . 0.0 112.0 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.51 -176.53 38.88 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.77 149.28 40.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 111.267 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -157.27 168.06 28.51 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.423 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 10.2 t -149.46 144.41 17.85 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.56 173.99 12.39 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 C-N-CA 123.639 2.893 . . . . 0.0 110.764 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -151.43 168.87 23.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.927 0.491 . . . . 0.0 110.196 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -144.78 174.48 10.95 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.535 0.734 . . . . 0.0 110.042 -177.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.2 m -144.0 159.05 43.26 Favored 'General case' 0 C--N 1.337 0.065 0 C-N-CA 122.907 0.483 . . . . 0.0 110.806 -178.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -73.32 155.88 89.49 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.03 165.45 32.34 Favored 'Trans proline' 0 N--CA 1.452 -0.969 0 C-N-CA 123.416 2.744 . . . . 0.0 110.163 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -70.74 174.12 10.83 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.922 3.081 . . . . 0.0 111.405 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.29 170.44 15.98 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.585 0.754 . . . . 0.0 110.05 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -143.29 -176.46 4.94 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.488 0.715 . . . . 0.0 111.216 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.76 12.61 2.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 122.742 0.417 . . . . 0.0 110.628 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -157.95 170.42 34.82 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 51.0 m -148.38 13.06 0.95 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.777 0.431 . . . . 0.0 111.513 -175.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -146.78 163.52 35.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.127 0.489 . . . . 0.0 110.575 -176.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 179.29 28.22 0.05 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -144.3 45.33 1.42 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.225 0.61 . . . . 0.0 110.288 -175.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -133.9 32.14 3.54 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.157 0.583 . . . . 0.0 110.753 -176.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.3 p -137.95 168.67 19.23 Favored 'General case' 0 N--CA 1.461 0.116 0 C-N-CA 123.417 0.687 . . . . 0.0 109.967 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -82.07 8.28 11.17 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.901 0.48 . . . . 0.0 111.997 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 42.0 m 54.97 31.19 15.48 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.989 0.915 . . . . 0.0 112.133 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 65.7 m -135.43 11.04 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.227 0.611 . . . . 0.0 111.195 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 37.4 m -69.57 -2.7 12.19 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.329 0.252 . . . . 0.0 111.673 178.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -174.07 171.02 44.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -155.02 13.43 0.39 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 121.059 0.457 . . . . 0.0 111.117 -179.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.86 28.23 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.172 0.511 . . . . 0.0 110.585 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.2 t -133.77 13.73 4.02 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.072 0.549 . . . . 0.0 110.955 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -133.69 5.88 3.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.155 0.582 . . . . 0.0 110.669 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.6 p -151.92 14.29 0.63 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -144.95 12.44 1.42 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.492 0.717 . . . . 0.0 111.918 -174.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 65.4 m -144.76 156.79 55.8 Favored Pre-proline 0 CA--C 1.531 0.245 0 C-N-CA 122.326 0.251 . . . . 0.0 110.56 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -74.06 -173.88 1.57 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 124.104 3.203 . . . . 0.0 111.029 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.9 m -136.49 154.89 77.16 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.58 170.36 17.75 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.71 2.94 . . . . 0.0 111.656 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.32 178.18 9.79 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.46 0.704 . . . . 0.0 110.329 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 82.4 p -142.8 7.5 1.66 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.487 0.315 . . . . 0.0 111.716 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.408 ' C ' HD12 ' A' ' 144' ' ' LEU . 1.7 pp -155.71 177.79 10.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.676 0.39 . . . . 0.0 110.865 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 12.8 t -153.89 166.44 32.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.925 0.49 . . . . 0.0 110.319 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -63.07 123.07 78.87 Favored Pre-proline 0 CA--C 1.531 0.237 0 C-N-CA 122.807 0.443 . . . . 0.0 110.296 -179.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.36 161.93 25.44 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 123.268 2.645 . . . . 0.0 110.069 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -61.31 147.11 96.42 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.302 2.668 . . . . 0.0 111.704 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.592 ' H ' ' CD ' ' A' ' 150' ' ' PRO . 3.6 mm? -131.28 -9.01 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 117.524 -1.227 . . . . 0.0 113.888 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.592 ' CD ' ' H ' ' A' ' 149' ' ' LEU . 50.6 Cg_endo -79.91 2.52 8.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 CA-C-N 122.369 1.882 . . . . 0.0 112.708 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 38.9 pt -57.9 149.1 56.28 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-O 121.072 0.463 . . . . 0.0 111.871 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -76.69 166.34 27.3 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.316 3.344 . . . . 0.0 110.239 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.37 168.17 21.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.533 2.822 . . . . 0.0 109.578 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.05 -14.02 26.26 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.951 3.101 . . . . 0.0 114.123 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -146.38 67.09 11.55 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.087 0.555 . . . . 0.0 111.127 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.92 152.14 21.79 Favored 'Trans proline' 0 N--CA 1.447 -1.226 0 C-N-CA 123.352 2.701 . . . . 0.0 110.727 -174.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.93 164.52 27.41 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 124.043 3.162 . . . . 0.0 109.108 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -70.2 161.61 45.35 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.672 2.248 . . . . 0.0 109.974 175.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.2 t -157.92 -22.93 0.08 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 179.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 151.38 -170.42 30.98 Favored Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -140.89 158.58 43.74 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -64.57 112.42 7.8 Favored Pre-proline 0 C--O 1.227 -0.083 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.9 -10.69 9.24 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 123.371 2.714 . . . . 0.0 111.851 -172.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 74.5 t -63.99 -45.77 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 O-C-N 122.015 -0.428 . . . . 0.0 111.773 -179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 90.4 mmm -76.57 -43.08 40.33 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.371 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 46.5 mt -54.9 -50.83 58.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 167' ' ' LEU . 3.6 tt -62.68 -50.11 72.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -70.47 5.31 1.85 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.368 0.667 . . . . 0.0 112.47 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -132.94 -16.14 2.56 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.061 -1.024 . . . . 0.0 112.182 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.24 -38.65 15.07 Favored 'General case' 0 C--N 1.338 0.083 0 CA-C-N 118.643 0.656 . . . . 0.0 109.33 174.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -157.02 72.89 4.61 Favored Pre-proline 0 C--O 1.236 0.359 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.02 -170.78 0.5 Allowed 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 123.717 2.945 . . . . 0.0 110.044 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 96.46 42.14 3.5 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.936 -0.369 . . . . 0.0 112.186 -176.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.38 -176.73 3.91 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.383 0.673 . . . . 0.0 110.086 -174.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 157.05 46.25 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 194' ' ' VAL . 35.3 m-85 -131.12 153.87 48.91 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -140.76 122.91 15.71 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 120.8 0.333 . . . . 0.0 110.178 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -76.12 139.09 41.16 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.76 157.14 30.33 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.776 0.798 . . . . 0.0 110.469 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 90.5 p -45.4 166.14 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 127.406 2.282 . . . . 0.0 116.347 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.3 164.58 28.91 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.26 -1.336 . . . . 0.0 111.527 -173.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 84.6 p -160.62 158.61 29.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.493 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 121.54 173.04 14.46 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -83.08 166.76 18.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 50.2 m -65.4 4.92 0.46 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -176.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -132.87 12.56 4.35 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.359 0.264 . . . . 0.0 110.903 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -156.04 13.77 0.32 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 110.09 -178.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -63.41 162.39 12.56 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 123.476 0.71 . . . . 0.0 112.556 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' SER . . . . . . . . . . . . . 78.4 p -144.72 157.21 44.28 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.917 0.887 . . . . 0.0 109.004 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -145.01 165.12 29.08 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 204' ' ' SER . 0.5 OUTLIER -142.5 160.41 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 122.332 1.063 . . . . 0.0 110.805 176.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 2.2 tpt -143.56 143.66 31.61 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' SER . . . . . . . . . . . . . 76.9 p -131.24 175.16 9.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 O-C-N 122.193 -0.317 . . . . 0.0 110.307 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' VAL . . . . . 0.514 ' HA ' ' HA ' ' A' ' 176' ' ' TYR . 1.3 t -152.16 166.12 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.042 0.448 . . . . 0.0 110.157 -175.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 69.4 t -136.99 128.37 42.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 198' ' ' GLY . 22.1 t -143.2 121.79 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.85 -0.37 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 196' ' ' VAL . . . 125.63 -20.22 6.52 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.487 HE21 HG22 ' A' ' 223' ' ' VAL . 3.4 mp0 -72.0 172.9 9.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 117.254 0.527 . . . . 0.0 110.115 176.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -139.14 131.7 28.77 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.01 168.78 15.55 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -157.95 152.82 25.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.152 -176.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -163.57 131.26 2.41 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 191' ' ' VAL . 92.7 p -98.34 162.05 13.38 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 122.364 0.265 . . . . 0.0 111.162 177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -169.57 178.3 42.68 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 -11.93 58.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.856 0.328 . . . . 0.0 111.579 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -154.48 165.46 36.35 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.29 -33.02 73.84 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -70.49 -38.07 74.29 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.749 0.704 . . . . 0.0 110.025 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.48 -36.85 63.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.006 0.522 . . . . 0.0 109.956 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -61.11 -43.72 98.45 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.46 -36.44 76.59 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 121.467 -0.771 . . . . 0.0 110.688 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.12 69.36 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.505 -0.747 . . . . 0.0 111.798 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -81.76 -50.13 9.62 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.785 -0.189 . . . . 0.0 110.829 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -63.7 -32.86 74.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -71.66 -56.23 6.23 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' GLN . . . . . . . . . . . . . 16.8 tm0? -42.19 -39.01 1.9 Allowed 'General case' 0 C--N 1.341 0.224 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 73.2 m -70.51 -40.8 73.32 Favored 'General case' 0 C--N 1.342 0.239 0 CA-C-N 119.134 0.879 . . . . 0.0 111.148 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.34 86.77 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.046 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.4 HD23 ' C ' ' A' ' 220' ' ' LEU . 6.4 tt -62.5 -57.97 9.27 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 122.765 0.426 . . . . 0.0 109.887 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -57.15 -36.48 70.79 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 222' ' ' THR . . . . . . . . . . . . . 28.5 m -82.77 -40.0 21.07 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 121.509 -0.744 . . . . 0.0 112.966 -178.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.487 HG22 HE21 ' A' ' 199' ' ' GLN . 40.0 t -90.95 -18.97 7.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 119.47 1.032 . . . . 0.0 110.639 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -95.54 -3.04 47.28 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 121.762 -0.586 . . . . 0.0 109.637 177.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 225' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 56.46 34.64 24.62 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.093 0.557 . . . . 0.0 111.743 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 87.9 mt -139.28 -162.44 1.33 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.628 1.171 . . . . 0.0 109.729 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 227' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -146.64 156.62 43.34 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.03 139.75 58.8 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 111.032 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.0 168.41 11.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.213 0.605 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -144.69 12.9 1.5 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.83 0.852 . . . . 0.0 111.346 178.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 231' ' ' HIS . . . . . . . . . . . . . 59.7 m80 -72.68 2.94 5.62 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.334 0.654 . . . . 0.0 112.542 -179.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 232' ' ' HIS . . . . . 0.592 ' CG ' ' H ' ' A' ' 233' ' ' HIS . 14.6 t60 -152.66 -170.07 3.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 120.902 0.382 . . . . 0.0 110.323 -176.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 233' ' ' HIS . . . . . 0.592 ' H ' ' CG ' ' A' ' 232' ' ' HIS . 21.9 t60 -132.27 173.78 10.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.854 0.862 . . . . 0.0 110.511 -178.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 234' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -146.93 -168.51 3.06 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.002 0.521 . . . . 0.0 111.808 -177.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 235' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -56.62 -18.45 12.06 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -170.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.361 -179.839 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 237' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.718 0 C4'-C3'-C2' 99.045 -3.655 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 238' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.798 3.598 . 0.721 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 239' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C4'-C3'-C2' 99.27 -3.43 . 0.804 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 240' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 C4'-C3'-C2' 99.226 -3.474 . 0.813 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 241' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.452 0 O4'-C1'-N19 111.721 3.521 . 0.738 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 242' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C4'-C3'-C2' 99.271 -3.429 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 243' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.54 1 C4'-C3'-C2' 98.555 -4.145 . 0.602 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 244' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.103 0 C4'-C3'-C2' 99.059 -3.641 . 0.699 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 245' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.643 0 C4'-C3'-C2' 99.188 -3.512 . 0.735 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 246' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.404 3.204 . 0.508 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 247' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 O4'-C1'-N19 111.884 3.684 . 0.828 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 248' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.027 0 C4'-C3'-C2' 98.823 -3.877 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 249' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C4'-C3'-C2' 99.332 -3.368 . 0.818 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 250' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 C4'-C3'-C2' 100.083 -2.617 . 0.86 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 251' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C4'-C3'-C2' 98.919 -3.781 . 0.809 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 252' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.343 0 C4'-C3'-C2' 99.051 -3.649 . 0.696 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 253' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.111 0 C4'-C3'-C2' 99.346 -3.354 . 0.72 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 254' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.639 0 C5'-C4'-O4' 113.067 2.762 . 0.718 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 255' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 C4'-C3'-C2' 99.492 -3.208 . 0.787 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 256' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C4'-C3'-C2' 99.389 -3.311 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 257' ' ' ' A' . . . . . 0.453 " H2'" ' C8 ' ' B' ' 258' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C4'-C3'-C2' 99.223 -3.477 . 0.817 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 258' ' ' ' G' . . . . . 0.453 ' C8 ' " H2'" ' B' ' 257' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.47 0 C4'-C3'-C2' 98.97 -3.73 . 0.842 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 259' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.315 1 C4'-C3'-C2' 98.572 -4.128 . 0.802 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 260' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.807 0 O4'-C1'-N19 111.31 3.11 . 0.757 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 261' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 C4'-C3'-C2' 99.452 -3.248 . 0.891 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 262' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.324 0 C4'-C3'-C2' 99.587 -3.113 . 0.84 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 263' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.571 0 C4'-C3'-C2' 99.284 -3.416 . 0.76 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 264' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C4'-C3'-C2' 99.7 -3.0 . 0.885 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 265' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.078 0 C4'-C3'-C2' 99.514 -3.186 . 0.854 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 266' ' ' ' A' . . . . . 0.407 " H2'" ' C6 ' ' B' ' 267' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.34 0 C4'-C3'-C2' 99.364 -3.336 . 0.828 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 267' ' ' ' U' . . . . . 0.407 ' C6 ' " H2'" ' B' ' 266' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.423 0 C4'-C3'-C2' 99.633 -3.067 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 268' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.77 0 C4'-C3'-C2' 99.366 -3.334 . 0.714 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 269' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 N19-C1'-C2' 108.318 -3.176 . 0.784 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 270' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C5'-C4'-C3' 111.893 -2.405 . 0.654 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 271' ' ' ' C' . . . . . 0.446 " H4'" H5'' ' B' ' 272' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.478 1 C5'-C4'-C3' 108.909 -4.394 OUTLIER-DELTA 0.01 1c . 0.0 . . . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 272' ' ' ' U' . . . . . 0.446 H5'' " H4'" ' B' ' 271' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.924 1 C5'-C4'-C3' 109.152 -4.232 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' B' B ' 273' ' ' ' A' . . . . . 0.62 ' C2 ' ' C4 ' ' B' ' 274' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.863 0 C4'-C3'-C2' 99.345 -3.355 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 274' ' ' ' A' . . . . . 0.62 ' C4 ' ' C2 ' ' B' ' 273' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.411 -3.494 2 N19-C1'-C2' 122.448 5.655 . 0.325 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 275' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -2.149 0 O4'-C1'-N19 110.947 2.747 . 0.305 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 276' ' ' ' U' . . . . . 0.452 " H2'" " O4'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C4'-C3'-C2' 98.789 -3.911 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 277' ' ' ' G' . . . . . 0.53 " H2'" ' C6 ' ' B' ' 278' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.413 -3.359 0 O4'-C1'-N19 111.426 3.226 . 0.587 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 278' ' ' ' U' . . . . . 0.53 ' C6 ' " H2'" ' B' ' 277' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C4'-C3'-C2' 98.871 -3.829 . 0.894 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 279' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C4'-C3'-C2' 98.603 -4.097 . 0.877 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 280' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.037 0 C4'-C3'-C2' 99.357 -3.343 . 0.801 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 281' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.11 0 C4'-C3'-C2' 99.163 -3.537 . 0.93 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 282' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.892 0 C4'-C3'-C2' 99.189 -3.511 . 0.862 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 283' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C4'-C3'-C2' 99.359 -3.341 . 0.822 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 284' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C4'-C3'-C2' 99.293 -3.407 . 0.893 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 285' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.889 0 C4'-C3'-C2' 100.354 -2.346 . 0.887 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 286' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -3.143 0 O4'-C1'-N19 112.148 3.948 . 0.573 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 287' ' ' ' U' . . . . . 0.415 " H2'" ' C8 ' ' B' ' 288' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 C4'-C3'-C2' 99.144 -3.556 . 0.597 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 288' ' ' ' A' . . . . . 0.415 ' C8 ' " H2'" ' B' ' 287' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.55 0 C4'-C3'-C2' 99.955 -2.745 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 289' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.904 0 C5'-C4'-C3' 110.932 -3.045 . 0.867 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 290' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 O4'-C1'-N19 112.042 3.842 . 0.88 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 291' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 O4'-C1'-N19 111.656 3.456 . 0.539 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 292' ' ' ' C' . . . . . 0.414 " H2'" ' C8 ' ' B' ' 293' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.122 0 C4'-C3'-C2' 99.349 -3.351 . 0.727 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 293' ' ' ' A' . . . . . 0.414 ' C8 ' " H2'" ' B' ' 292' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.377 0 O4'-C1'-N19 111.838 3.638 . 0.625 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 294' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.534 0 C4'-C3'-C2' 98.83 -3.87 . 0.707 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 295' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -2.085 0 O4'-C1'-N19 111.656 3.456 . 0.788 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 296' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C4'-C3'-C2' 99.181 -3.519 . 0.752 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 297' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C4'-C3'-C2' 99.699 -3.001 . 0.589 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 298' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 C4'-C3'-C2' 98.863 -3.837 . 0.684 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 299' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.043 2.843 . 0.794 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 300' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.502 0 C4'-C3'-C2' 99.52 -3.18 . 0.814 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 301' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C4'-C3'-C2' 99.057 -3.643 . 0.648 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 302' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 C4'-C3'-C2' 98.48 -4.22 . 0.634 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 303' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C4'-C3'-C2' 98.611 -4.089 . 0.677 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 304' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 112.024 3.824 . 0.792 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 305' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.743 0 O4'-C1'-N19 111.076 2.876 . 0.774 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 306' ' ' ' C' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 307' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.354 1 C4'-C3'-C2' 98.112 -4.588 . 0.776 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 307' ' ' ' C' . . . . . 0.438 ' C6 ' " H2'" ' B' ' 306' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 O4'-C1'-N19 111.854 3.654 . 0.785 1a . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_