data_2l46_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 2l46 _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 ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.502 0 N-CA-C 114.086 0.394 . . . . 0.0 114.086 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.469 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.666 0 CA-C-O 119.585 -0.564 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.5 t . . . . . 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.364 0 CA-C-O 120.167 -0.241 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.498 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.498 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.9 t . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.412 0 CA-C-O 119.987 -0.34 . . . . 0.0 113.259 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.541 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.541 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' HE2' ' SG ' ' A' ' 6' ' ' CYS . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 CA-C-O 119.825 -0.431 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 CA-C-O 119.389 -0.673 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.41 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t . . . . . 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.551 0 N-CA-C 111.989 -0.444 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.491 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.491 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.4 0 CA-C-O 119.766 -0.464 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.481 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.8 t . . . . . 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.202 0 N-CA-C 114.501 0.56 . . . . 0.0 114.501 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.466 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 CA-C-O 119.15 -0.806 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.496 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.496 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t . . . . . 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.513 0 N-CA-C 114.75 0.66 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.447 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.6 t . . . . . 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.406 0 CA-C-O 119.894 -0.392 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.452 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.421 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.452 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t . . . . . 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.304 0 CA-C-O 119.69 -0.505 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.514 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.457 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.6 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.586 0 N-CA-C 114.247 0.459 . . . . 0.0 114.247 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.462 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.462 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.4 t . . . . . 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 CA-C-O 119.86 -0.411 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.511 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.421 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.7 t . . . . . 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.619 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.481 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.0 t . . . . . 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.519 0 CA-C-O 119.709 -0.495 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.97 0 CA-C-O 119.53 -0.594 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.527 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.527 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.7 t . . . . . 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 CA-C-O 119.437 -0.646 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.46 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.46 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.6 t . . . . . 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 CA-C-O 119.387 -0.674 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.92 -157.02 19.78 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.553 1.549 . . . . 0.0 114.086 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.55 168.79 6.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -86.81 -1.96 58.18 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.785 -1.197 . . . . 0.0 110.937 168.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -145.84 113.23 6.26 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.045 1.738 . . . . 0.0 112.87 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 . . . . . 0 N--CA 1.495 1.785 0 C-N-CA 127.233 2.213 . . . . 0.0 115.369 169.155 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.951 1 O4'-C1'-N19 112.318 5.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.409 -3.324 2 O4'-C1'-C2' 98.095 -7.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 1 O4'-C1'-N19 112.425 5.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.525 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.237 2 O4'-C1'-N19 117.234 11.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.525 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.145 1 C5'-C4'-O4' 115.931 4.082 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.583 2 O4'-C1'-N19 116.38 10.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.05 -162.69 11.29 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.746 1.641 . . . . 0.0 113.271 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -72.25 163.73 27.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 4.58 8.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 119.76 -1.838 . . . . 0.0 112.345 170.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -135.63 124.85 24.58 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.395 1.878 . . . . 0.0 112.606 -165.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.406 ' O ' ' HE2' ' A' ' 5' ' ' LYS . 11.0 ptt180 . . . . . 0 N--CA 1.499 1.981 1 C-N-CA 131.835 4.054 . . . . 0.0 119.038 165.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.797 1 O4'-C1'-N19 113.736 7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 2 O4'-C1'-N19 113.537 7.171 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-C2' 102.534 -3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.537 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.418 -2.558 2 O4'-C1'-N19 116.053 10.317 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.42 -2.331 1 O4'-C1'-N19 115.578 9.723 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 4 O4'-C1'-C2' 98.288 -7.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.7 -160.59 23.58 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.815 1.198 . . . . 0.0 112.798 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.484 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.9 t -70.87 166.42 21.17 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.1 t -82.76 4.53 24.83 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.961 -1.087 . . . . 0.0 111.209 168.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -130.35 144.06 51.15 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 126.271 1.829 . . . . 0.0 115.1 -170.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.484 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 2.0 ptt180 . . . . . 0 N--CA 1.489 1.493 1 C-N-CA 134.124 4.97 . . . . 0.0 118.708 174.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.183 1 O4'-C1'-N19 113.058 6.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.13 2 O4'-C1'-C2' 98.051 -7.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.93 1 O4'-C1'-N19 112.286 5.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.516 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.833 2 O4'-C1'-N19 116.744 11.18 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.516 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 P--O3' 1.578 -2.439 1 O4'-C1'-N19 115.053 9.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.027 3 O4'-C1'-C2' 97.938 -7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.592 0.234 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.01 -160.5 34.09 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 120.957 -1.09 . . . . 0.0 113.259 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.495 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' SG ' ' HE2' ' A' ' 8' ' ' LYS . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' HE2' ' SG ' ' A' ' 6' ' ' CYS . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -66.21 163.67 17.32 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.41 -6.57 59.07 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.795 -1.191 . . . . 0.0 111.785 171.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -120.91 126.01 48.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.223 -1.548 . . . . 0.0 112.346 -169.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' OXT' ' HE2' ' A' ' 5' ' ' LYS 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 C-N-CA 129.685 3.194 . . . . 0.0 119.134 165.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.835 1 O4'-C1'-N19 112.665 6.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.831 3 O4'-C1'-N19 113.917 7.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.141 1 O4'-C1'-N19 111.554 4.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.56 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.416 -2.692 2 O4'-C1'-N19 115.92 10.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.545 4.253 2 O4'-C1'-N19 115.572 9.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.496 -1.792 2 O4'-C1'-N19 115.713 9.891 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt . . . . . 0 N--CA 1.479 1.019 0 CA-C-O 121.404 0.621 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.92 -178.28 46.6 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.673 -1.267 . . . . 0.0 113.74 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t -75.55 177.63 6.6 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.7 t -101.75 10.21 40.19 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.852 1.261 . . . . 0.0 112.409 175.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -145.25 142.19 29.29 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 126.425 1.89 . . . . 0.0 112.857 -164.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 C-N-CA 130.44 3.496 . . . . 0.0 117.217 167.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.973 2 O4'-C1'-N19 114.035 7.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.421 0 O4'-C1'-N19 110.828 3.784 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.402 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.405 -3.707 3 O4'-C1'-N19 114.763 8.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.402 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 2 O4'-C1'-N19 116.394 10.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.473 0 O5'-C5'-C4' 114.635 3.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.42 -165.87 39.14 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.285 -0.884 . . . . 0.0 112.528 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.41 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.63 170.01 15.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 t -88.1 -12.36 44.37 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.653 172.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -151.64 112.09 4.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.153 0.981 . . . . 0.0 112.118 -168.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . 0.412 2.2 ptp180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 173.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 1 O4'-C1'-N19 113.496 7.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.052 2 O4'-C1'-C2' 97.925 -7.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.487 0 O4'-C1'-C2' 103.09 -2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.457 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.083 4 O4'-C1'-N19 116.01 10.263 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.457 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 117.421 12.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.693 0 O5'-C5'-C4' 114.182 2.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.2 mttm . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 110.717 -0.105 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -169.94 40.57 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 127.038 2.256 . . . . 0.0 111.989 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -69.65 161.17 30.2 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 t -90.29 -9.24 48.63 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.366 1.066 . . . . 0.0 111.562 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -141.6 127.08 18.84 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.348 1.459 . . . . 0.0 112.476 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.493 ' CB ' " H1'" ' B' ' 25' ' ' ' DC' 0.288 0.8 OUTLIER . . . . . 0 C--O 1.246 0.918 0 N-CA-C 118.616 2.821 . . . . 0.0 118.616 163.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 112.782 6.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.158 2 O4'-C1'-N19 114.47 8.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.92 1 O4'-C1'-N19 111.315 4.393 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.557 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.406 -3.661 1 O4'-C1'-N19 114.44 8.3 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.557 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.055 2 O4'-C1'-N19 114.888 8.86 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.493 " H1'" ' CB ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.529 2.287 6 O4'-C1'-N19 114.708 8.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 121.395 0.617 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -124.83 -166.85 12.49 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 126.666 2.079 . . . . 0.0 112.256 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.8 t -66.16 163.67 17.22 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.3 t -88.93 -12.18 42.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.09 172.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -143.5 121.7 12.23 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.767 1.227 . . . . 0.0 112.372 -175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.454 ' O ' ' HE2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 118.907 2.928 . . . . 0.0 118.907 156.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.241 2 O4'-C1'-N19 114.719 8.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.267 2 O4'-C1'-N19 111.629 4.787 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.516 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.404 -3.842 2 O4'-C1'-N19 113.915 7.644 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.516 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.812 2 O4'-C1'-N19 114.446 8.308 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.42 " H1'" ' HB3' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.846 5 C4'-C3'-C2' 97.33 -5.87 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt . . . . . 0 N--CA 1.47 0.548 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.58 -164.97 16.48 Favored Glycine 0 CA--C 1.533 1.202 0 O-C-N 121.316 -0.865 . . . . 0.0 114.501 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -70.18 144.54 51.92 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 t -71.18 -5.4 31.55 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.429 -1.419 . . . . 0.0 112.379 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.9 mm-40 -116.09 145.56 42.92 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.982 1.713 . . . . 0.0 113.1 -175.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.465 ' HD2' " H1'" ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.53 0 C-N-CA 125.533 1.533 . . . . 0.0 110.387 153.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.68 1 O4'-C1'-N19 111.467 4.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.295 3 O4'-C1'-C2' 97.801 -7.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.644 1 O4'-C1'-N19 111.312 4.39 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.44 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.828 2 O4'-C1'-N19 116.218 10.523 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.469 " H5'" ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 1 O4'-C1'-N19 114.68 8.6 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.465 " H1'" ' HD2' ' A' ' 19' ' ' ARG . . . . . . . . 0 O4'--C4' 1.428 -1.664 2 O4'-C1'-N19 118.513 13.391 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.8 mttp . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.29 -166.13 39.05 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.011 1.291 . . . . 0.0 112.147 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 t -77.62 171.42 14.95 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.6 t -87.11 0.99 54.39 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.183 -0.948 . . . . 0.0 112.876 171.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -133.37 141.88 48.11 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.998 1.319 . . . . 0.0 114.208 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.0 mtm180 . . . . . 0 N--CA 1.496 1.846 1 C-N-CA 132.774 4.43 . . . . 0.0 116.347 174.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.095 4.119 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 2 O4'-C1'-N19 114.081 7.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.494 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.862 6 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.494 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 2.961 1 O4'-C1'-N19 115.387 9.483 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.811 3 O4'-C1'-C2' 96.156 -9.04 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.44 -163.89 14.72 Favored Glycine 0 CA--C 1.538 1.513 0 C-N-CA 125.481 1.515 . . . . 0.0 114.75 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.63 162.45 13.03 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -87.66 -12.43 45.47 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 121.243 -0.91 . . . . 0.0 110.021 173.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -134.2 120.18 19.73 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 126.408 1.883 . . . . 0.0 112.26 178.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.531 ' CB ' " H1'" ' B' ' 25' ' ' ' DC' . 7.5 ptp180 . . . . . 0 C--O 1.249 1.035 0 N-CA-C 120.614 3.561 . . . . 0.0 120.614 154.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.893 1 O4'-C1'-N19 111.985 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.844 2 O4'-C1'-C2' 98.42 -6.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O4'-C1'-N19 110.189 2.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.433 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.832 2 O4'-C1'-N19 114.774 8.718 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.433 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 113.084 6.605 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.531 " H1'" ' CB ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C2'--C1' 1.494 -1.935 5 C4'-C3'-C2' 96.816 -6.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 tttp . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 121.29 -163.58 14.7 Favored Glycine 0 N--CA 1.477 1.406 0 C-N-CA 124.286 0.946 . . . . 0.0 113.063 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.421 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -79.49 178.93 7.76 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -7.25 47.07 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 120.862 -1.149 . . . . 0.0 111.886 172.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -117.18 152.37 34.91 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.88 2.472 . . . . 0.0 111.115 -169.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.417 ' H ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 C-N-CA 124.385 1.074 . . . . 0.0 108.948 158.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 1 O4'-C1'-N19 113.494 7.118 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.82 2 O4'-C1'-N19 113.431 7.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.552 1 O4'-C1'-N19 111.617 4.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.567 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.443 2 O4'-C1'-N19 117.095 11.619 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.567 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 O4'-C1'-N19 113.068 6.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.576 -2.589 2 O4'-C1'-N19 114.936 8.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.648 0.737 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -177.46 47.8 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.669 1.604 . . . . 0.0 111.966 -170.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -67.53 162.36 23.52 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.8 t -96.47 -4.9 40.77 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.334 1.053 . . . . 0.0 112.155 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -151.98 129.3 11.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 126.306 1.843 . . . . 0.0 110.371 -176.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' CB ' " H1'" ' B' ' 25' ' ' ' DC' 0.264 7.8 ptp180 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 119.724 3.231 . . . . 0.0 119.724 164.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.108 1 O4'-C1'-N19 112.324 5.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.001 2 O4'-C1'-N19 113.714 7.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.731 1 O4'-C1'-N19 111.756 4.945 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.522 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.114 3 O4'-C1'-N19 116.003 10.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.522 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 114.014 7.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.478 " H1'" ' CB ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.928 4 O4'-C1'-N19 114.752 8.69 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.26 -166.22 31.42 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.409 1.459 . . . . 0.0 114.247 174.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.4 t -71.1 160.78 32.26 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -3.97 57.73 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.629 0.772 . . . . 0.0 111.899 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -151.61 125.66 9.22 Favored 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 125.549 1.539 . . . . 0.0 111.731 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.454 ' CB ' " H1'" ' B' ' 25' ' ' ' DC' 0.305 3.9 ptp180 . . . . . 0 C--O 1.245 0.841 0 N-CA-C 119.236 3.05 . . . . 0.0 119.236 161.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 1 O4'-C1'-N19 112.418 5.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.458 3 O4'-C1'-N19 114.498 8.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.093 1 O4'-C1'-N19 111.411 4.514 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.521 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.408 -3.482 1 O4'-C1'-N19 114.841 8.801 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.521 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.611 1 O4'-C1'-N19 113.842 7.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.454 " H1'" ' CB ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.524 1.594 5 O4'-C1'-N19 113.429 7.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.16 -167.78 29.32 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.755 1.169 . . . . 0.0 112.519 -170.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.7 t -75.39 170.18 16.61 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -100.55 5.19 43.96 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.669 1.188 . . . . 0.0 113.103 178.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -142.82 152.14 41.88 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.948 1.699 . . . . 0.0 111.909 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.477 ' C ' ' H42' ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 126.651 1.98 . . . . 0.0 110.175 166.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.485 1 O4'-C1'-N19 112.024 5.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.768 2 O4'-C1'-N19 115.237 9.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.803 1 O4'-C1'-N19 112.021 5.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.525 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 O4'--C4' 1.395 -4.601 3 O4'-C1'-N19 112.371 5.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.525 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.814 1 O4'-C1'-N19 115.892 10.115 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.477 ' H42' ' C ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.536 3.073 1 P-O3'-C3' 125.652 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 111.133 0.049 . . . . 0.0 111.133 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.28 -175.39 26.67 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 125.972 1.749 . . . . 0.0 113.099 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -88.07 172.02 9.84 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.1 t -91.22 2.98 55.96 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.901 -1.124 . . . . 0.0 112.595 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -136.62 154.36 50.68 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.409 1.884 . . . . 0.0 112.154 -166.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.839 1 C-N-CA 132.007 4.123 . . . . 0.0 116.341 -169.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 1 O4'-C1'-N19 111.528 4.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.935 2 O4'-C1'-C2' 98.205 -7.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.548 4.66 2 O4'-C1'-N19 112.912 6.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.552 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.855 5 O4'-C1'-N19 117.914 12.643 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.552 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.902 1 O4'-C1'-N19 116.335 10.669 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . 0.414 ' C5 ' ' C8 ' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.42 -2.338 4 O4'-C1'-C2' 98.136 -7.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 mttt . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.736 -0.65 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.95 -165.08 38.64 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.905 1.717 . . . . 0.0 112.593 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -71.57 153.74 41.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 p -75.75 -2.36 29.37 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.168 -1.583 . . . . 0.0 113.065 173.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -105.62 138.38 41.9 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.115 0.966 . . . . 0.0 111.036 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 129.146 2.978 . . . . 0.0 113.438 164.649 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.359 1 O4'-C1'-N19 113.114 6.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 2 O4'-C1'-C2' 98.131 -7.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 1 O4'-C1'-N19 111.26 4.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.444 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.39 2 O4'-C1'-N19 118.079 12.849 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.444 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 113.835 7.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 5 O4'-C1'-N19 118.901 13.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.73 -167.58 23.36 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 123.904 0.764 . . . . 0.0 112.696 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -65.25 163.73 14.76 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -83.22 -12.06 57.21 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.036 -1.665 . . . . 0.0 110.749 168.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -143.29 95.71 2.8 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -167.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.9 mtm-85 . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 115.377 -2.249 . . . . 0.0 115.856 169.169 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.211 1 O4'-C1'-N19 114.403 8.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 2 O4'-C1'-C2' 97.503 -7.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.52 1 O4'-C1'-N19 111.153 4.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.517 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 117.469 12.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.517 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.845 2 O4'-C1'-N19 114.131 7.914 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.661 4 C4'-C3'-C2' 95.545 -7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 tptp . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.97 -174.39 19.01 Favored Glycine 0 N--CA 1.48 1.575 0 C-N-CA 125.727 1.632 . . . . 0.0 112.804 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.487 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -87.04 172.61 9.85 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -88.87 0.36 56.65 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.336 -0.852 . . . . 0.0 112.774 170.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.89 146.49 52.15 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.899 1.68 . . . . 0.0 112.695 -167.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.487 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 1.4 ptt85 . . . . . 0 N--CA 1.5 2.055 0 C-N-CA 130.511 3.524 . . . . 0.0 116.536 174.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.824 1 O4'-C1'-N19 111.857 5.071 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.878 2 O4'-C1'-C2' 97.475 -7.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.224 2 O4'-C1'-N19 112.731 6.163 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . 0.509 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.102 3 O4'-C1'-N19 116.683 11.103 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.509 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.43 1 O4'-C1'-N19 114.7 8.625 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.093 5 O4'-C1'-N19 116.67 11.088 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.82 171.85 29.81 Favored Glycine 0 N--CA 1.479 1.502 0 CA-C-N 120.831 1.65 . . . . 0.0 112.661 -178.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t -74.65 162.27 28.9 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 1.34 20.36 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.396 -0.815 . . . . 0.0 111.856 168.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -140.21 148.17 41.15 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -169.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.457 ' O ' ' HE2' ' A' ' 5' ' ' LYS 0.266 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.655 1 C-N-CA 136.065 5.746 . . . . 0.0 119.527 -179.147 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.085 1 O4'-C1'-N19 113.675 7.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.729 3 O4'-C1'-C2' 98.083 -7.288 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.675 0 OP1-P-OP2 114.885 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.581 2 O4'-C1'-N19 114.792 8.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 2 O4'-C1'-N19 112.842 6.303 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.879 4 C4'-C3'-C2' 94.84 -8.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.502 0 N-CA-C 114.086 0.394 . . . . 0.0 114.086 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.454 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.666 0 CA-C-O 119.585 -0.564 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.364 0 CA-C-O 120.167 -0.241 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.412 0 CA-C-O 119.987 -0.34 . . . . 0.0 113.259 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 CA-C-O 119.825 -0.431 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.439 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.428 ' HE2' ' HG ' ' A' ' 6' ' ' CYS . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 CA-C-O 119.389 -0.673 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.411 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.486 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 14' ' ' LYS . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t . . . . . 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.551 0 N-CA-C 111.989 -0.444 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.4 0 CA-C-O 119.766 -0.464 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.202 0 N-CA-C 114.501 0.56 . . . . 0.0 114.501 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.413 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.446 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.413 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 CA-C-O 119.15 -0.806 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.405 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t . . . . . 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.513 0 N-CA-C 114.75 0.66 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.6 t . . . . . 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.406 0 CA-C-O 119.894 -0.392 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.408 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t . . . . . 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.304 0 CA-C-O 119.69 -0.505 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.452 ' HG ' ' HE2' ' A' ' 11' ' ' HIS . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.452 ' HE2' ' HG ' ' A' ' 6' ' ' CYS . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.6 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.586 0 N-CA-C 114.247 0.459 . . . . 0.0 114.247 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.44 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.4 t . . . . . 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 CA-C-O 119.86 -0.411 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TRP . . . . . 0.431 ' HB2' ' HE2' ' A' ' 5' ' ' LYS . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 4' ' ' TRP . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.619 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.519 0 CA-C-O 119.709 -0.495 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 4.0 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.97 0 CA-C-O 119.53 -0.594 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.426 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.7 t . . . . . 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 CA-C-O 119.437 -0.646 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.404 ' HG ' ' HE2' ' A' ' 11' ' ' HIS . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 CA-C-O 119.387 -0.674 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.413 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.92 -157.02 19.78 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.553 1.549 . . . . 0.0 114.086 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.454 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.55 168.79 6.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -86.81 -1.96 58.18 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.785 -1.197 . . . . 0.0 110.937 168.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -145.84 113.23 6.26 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.045 1.738 . . . . 0.0 112.87 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 . . . . . 0 N--CA 1.495 1.785 0 C-N-CA 127.233 2.213 . . . . 0.0 115.369 169.155 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.951 1 O4'-C1'-N19 112.318 5.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . 0.421 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.409 -3.324 2 O4'-C1'-C2' 98.095 -7.278 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.421 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.282 1 O4'-C1'-N19 112.425 5.781 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.56 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.237 2 O4'-C1'-N19 117.234 11.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.145 1 C5'-C4'-O4' 115.931 4.082 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.583 2 O4'-C1'-N19 116.38 10.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.05 -162.69 11.29 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.746 1.641 . . . . 0.0 113.271 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -72.25 163.73 27.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 4.58 8.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 119.76 -1.838 . . . . 0.0 112.345 170.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -135.63 124.85 24.58 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.395 1.878 . . . . 0.0 112.606 -165.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HE2' ' A' ' 5' ' ' LYS . 11.0 ptt180 . . . . . 0 N--CA 1.499 1.981 1 C-N-CA 131.835 4.054 . . . . 0.0 119.038 165.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.797 1 O4'-C1'-N19 113.736 7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 2 O4'-C1'-N19 113.537 7.171 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-C2' 102.534 -3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.577 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.418 -2.558 2 O4'-C1'-N19 116.053 10.317 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.577 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.42 -2.331 1 O4'-C1'-N19 115.578 9.723 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 4 O4'-C1'-C2' 98.288 -7.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.7 -160.59 23.58 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.815 1.198 . . . . 0.0 112.798 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.557 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.9 t -70.87 166.42 21.17 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.1 t -82.76 4.53 24.83 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.961 -1.087 . . . . 0.0 111.209 168.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -130.35 144.06 51.15 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 126.271 1.829 . . . . 0.0 115.1 -170.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.557 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 2.0 ptt180 . . . . . 0 N--CA 1.489 1.493 1 C-N-CA 134.124 4.97 . . . . 0.0 118.708 174.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.183 1 O4'-C1'-N19 113.058 6.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.13 2 O4'-C1'-C2' 98.051 -7.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.93 1 O4'-C1'-N19 112.286 5.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.555 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.833 2 O4'-C1'-N19 116.744 11.18 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.555 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 P--O3' 1.578 -2.439 1 O4'-C1'-N19 115.053 9.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.027 3 O4'-C1'-C2' 97.938 -7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.592 0.234 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.01 -160.5 34.09 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 120.957 -1.09 . . . . 0.0 113.259 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -66.21 163.67 17.32 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.41 -6.57 59.07 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.795 -1.191 . . . . 0.0 111.785 171.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -120.91 126.01 48.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.223 -1.548 . . . . 0.0 112.346 -169.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.503 ' OXT' ' HE2' ' A' ' 5' ' ' LYS 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 C-N-CA 129.685 3.194 . . . . 0.0 119.134 165.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.835 1 O4'-C1'-N19 112.665 6.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . 0.411 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.831 3 O4'-C1'-N19 113.917 7.646 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.411 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.141 1 O4'-C1'-N19 111.554 4.693 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.598 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.416 -2.692 2 O4'-C1'-N19 115.92 10.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.598 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.545 4.253 2 O4'-C1'-N19 115.572 9.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.462 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C2'--C1' 1.496 -1.792 2 O4'-C1'-N19 115.713 9.891 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt . . . . . 0 N--CA 1.479 1.019 0 CA-C-O 121.404 0.621 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.92 -178.28 46.6 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.673 -1.267 . . . . 0.0 113.74 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t -75.55 177.63 6.6 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.7 t -101.75 10.21 40.19 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.852 1.261 . . . . 0.0 112.409 175.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -145.25 142.19 29.29 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 126.425 1.89 . . . . 0.0 112.857 -164.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 C-N-CA 130.44 3.496 . . . . 0.0 117.217 167.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.973 2 O4'-C1'-N19 114.035 7.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.421 0 O4'-C1'-N19 110.828 3.784 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.451 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.405 -3.707 3 O4'-C1'-N19 114.763 8.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.451 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 2 O4'-C1'-N19 116.394 10.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.473 0 O5'-C5'-C4' 114.635 3.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.42 -165.87 39.14 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.285 -0.884 . . . . 0.0 112.528 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.486 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 14' ' ' LYS . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.63 170.01 15.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.706 HG23 ' HG3' ' A' ' 18' ' ' GLU . 7.9 t -88.1 -12.36 44.37 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.653 172.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.706 ' HG3' HG23 ' A' ' 17' ' ' THR . 6.1 mt-10 -151.64 112.09 4.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.153 0.981 . . . . 0.0 112.118 -168.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . 0.412 2.2 ptp180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 173.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 1 O4'-C1'-N19 113.496 7.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.052 2 O4'-C1'-C2' 97.925 -7.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.487 0 O4'-C1'-C2' 103.09 -2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.506 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.083 4 O4'-C1'-N19 116.01 10.263 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.506 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 117.421 12.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.693 0 O5'-C5'-C4' 114.182 2.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.2 mttm . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 110.717 -0.105 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -169.94 40.57 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 127.038 2.256 . . . . 0.0 111.989 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -69.65 161.17 30.2 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 t -90.29 -9.24 48.63 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.366 1.066 . . . . 0.0 111.562 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -141.6 127.08 18.84 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.348 1.459 . . . . 0.0 112.476 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.479 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.288 0.8 OUTLIER . . . . . 0 C--O 1.246 0.918 0 N-CA-C 118.616 2.821 . . . . 0.0 118.616 163.126 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 112.782 6.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.158 2 O4'-C1'-N19 114.47 8.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.468 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.92 1 O4'-C1'-N19 111.315 4.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.591 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.406 -3.661 1 O4'-C1'-N19 114.44 8.3 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.055 2 O4'-C1'-N19 114.888 8.86 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.479 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.529 2.287 6 O4'-C1'-N19 114.708 8.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 121.395 0.617 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -124.83 -166.85 12.49 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 126.666 2.079 . . . . 0.0 112.256 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.8 t -66.16 163.67 17.22 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.57 HG23 ' HG3' ' A' ' 18' ' ' GLU . 11.3 t -88.93 -12.18 42.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.09 172.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HG23 ' A' ' 17' ' ' THR . 7.8 mt-10 -143.5 121.7 12.23 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.767 1.227 . . . . 0.0 112.372 -175.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.502 ' HB3' " H1'" ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 118.907 2.928 . . . . 0.0 118.907 156.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.241 2 O4'-C1'-N19 114.719 8.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.449 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.545 4.267 2 O4'-C1'-N19 111.629 4.787 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.545 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.404 -3.842 2 O4'-C1'-N19 113.915 7.644 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.545 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.812 2 O4'-C1'-N19 114.446 8.308 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.502 " H1'" ' HB3' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.846 5 C4'-C3'-C2' 97.33 -5.87 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt . . . . . 0 N--CA 1.47 0.548 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.58 -164.97 16.48 Favored Glycine 0 CA--C 1.533 1.202 0 O-C-N 121.316 -0.865 . . . . 0.0 114.501 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.446 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -70.18 144.54 51.92 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 t -71.18 -5.4 31.55 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.429 -1.419 . . . . 0.0 112.379 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.9 mm-40 -116.09 145.56 42.92 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.982 1.713 . . . . 0.0 113.1 -175.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.607 ' HD2' " H1'" ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.53 0 C-N-CA 125.533 1.533 . . . . 0.0 110.387 153.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.68 1 O4'-C1'-N19 111.467 4.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . 0.459 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.41 -3.295 3 O4'-C1'-C2' 97.801 -7.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.459 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.644 1 O4'-C1'-N19 111.312 4.39 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.477 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.828 2 O4'-C1'-N19 116.218 10.523 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.496 " H5'" ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 1 O4'-C1'-N19 114.68 8.6 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.607 " H1'" ' HD2' ' A' ' 19' ' ' ARG . . . . . . . . 0 O4'--C4' 1.428 -1.664 2 O4'-C1'-N19 118.513 13.391 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.8 mttp . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.29 -166.13 39.05 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.011 1.291 . . . . 0.0 112.147 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.405 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 t -77.62 171.42 14.95 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.6 t -87.11 0.99 54.39 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.183 -0.948 . . . . 0.0 112.876 171.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -133.37 141.88 48.11 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.998 1.319 . . . . 0.0 114.208 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.427 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 2.0 mtm180 . . . . . 0 N--CA 1.496 1.846 1 C-N-CA 132.774 4.43 . . . . 0.0 116.347 174.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.095 4.119 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 2 O4'-C1'-N19 114.081 7.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.527 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.862 6 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.527 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 2.961 1 O4'-C1'-N19 115.387 9.483 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.419 " H5'" ' HB3' ' A' ' 19' ' ' ARG . . . . . . . . 0 O5'--C5' 1.411 -1.811 3 O4'-C1'-C2' 96.156 -9.04 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.44 -163.89 14.72 Favored Glycine 0 CA--C 1.538 1.513 0 C-N-CA 125.481 1.515 . . . . 0.0 114.75 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.63 162.45 13.03 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -87.66 -12.43 45.47 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 121.243 -0.91 . . . . 0.0 110.021 173.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -134.2 120.18 19.73 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 126.408 1.883 . . . . 0.0 112.26 178.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' . 7.5 ptp180 . . . . . 0 C--O 1.249 1.035 0 N-CA-C 120.614 3.561 . . . . 0.0 120.614 154.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.893 1 O4'-C1'-N19 111.985 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.844 2 O4'-C1'-C2' 98.42 -6.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.4 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O4'-C1'-N19 110.189 2.987 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.464 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.832 2 O4'-C1'-N19 114.774 8.718 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 113.084 6.605 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.53 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C2'--C1' 1.494 -1.935 5 C4'-C3'-C2' 96.816 -6.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 tttp . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 121.29 -163.58 14.7 Favored Glycine 0 N--CA 1.477 1.406 0 C-N-CA 124.286 0.946 . . . . 0.0 113.063 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.408 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -79.49 178.93 7.76 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -7.25 47.07 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 120.862 -1.149 . . . . 0.0 111.886 172.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -117.18 152.37 34.91 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.88 2.472 . . . . 0.0 111.115 -169.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' H ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 C-N-CA 124.385 1.074 . . . . 0.0 108.948 158.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 1 O4'-C1'-N19 113.494 7.118 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.82 2 O4'-C1'-N19 113.431 7.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.552 1 O4'-C1'-N19 111.617 4.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.594 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.443 2 O4'-C1'-N19 117.095 11.619 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.594 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 O4'-C1'-N19 113.068 6.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.576 -2.589 2 O4'-C1'-N19 114.936 8.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.648 0.737 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -177.46 47.8 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.669 1.604 . . . . 0.0 111.966 -170.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -67.53 162.36 23.52 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.8 t -96.47 -4.9 40.77 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.334 1.053 . . . . 0.0 112.155 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -151.98 129.3 11.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 126.306 1.843 . . . . 0.0 110.371 -176.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.489 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.264 7.8 ptp180 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 119.724 3.231 . . . . 0.0 119.724 164.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.108 1 O4'-C1'-N19 112.324 5.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.001 2 O4'-C1'-N19 113.714 7.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.415 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.549 4.731 1 O4'-C1'-N19 111.756 4.945 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.558 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.114 3 O4'-C1'-N19 116.003 10.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 114.014 7.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.489 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.928 4 O4'-C1'-N19 114.752 8.69 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.26 -166.22 31.42 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.409 1.459 . . . . 0.0 114.247 174.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.4 t -71.1 160.78 32.26 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -3.97 57.73 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.629 0.772 . . . . 0.0 111.899 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -151.61 125.66 9.22 Favored 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 125.549 1.539 . . . . 0.0 111.731 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.448 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.305 3.9 ptp180 . . . . . 0 C--O 1.245 0.841 0 N-CA-C 119.236 3.05 . . . . 0.0 119.236 161.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 1 O4'-C1'-N19 112.418 5.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.458 3 O4'-C1'-N19 114.498 8.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.456 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.544 4.093 1 O4'-C1'-N19 111.411 4.514 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.554 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.408 -3.482 1 O4'-C1'-N19 114.841 8.801 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.611 1 O4'-C1'-N19 113.842 7.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.448 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.524 1.594 5 O4'-C1'-N19 113.429 7.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.16 -167.78 29.32 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.755 1.169 . . . . 0.0 112.519 -170.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.431 ' HB2' ' HE2' ' A' ' 5' ' ' LYS . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 4' ' ' TRP . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.7 t -75.39 170.18 16.61 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -100.55 5.19 43.96 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.669 1.188 . . . . 0.0 113.103 178.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -142.82 152.14 41.88 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.948 1.699 . . . . 0.0 111.909 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.57 ' HA ' " H1'" ' B' ' 24' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 126.651 1.98 . . . . 0.0 110.175 166.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.485 1 O4'-C1'-N19 112.024 5.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.768 2 O4'-C1'-N19 115.237 9.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.803 1 O4'-C1'-N19 112.021 5.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.602 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 O4'--C4' 1.395 -4.601 3 O4'-C1'-N19 112.371 5.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.602 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.814 1 O4'-C1'-N19 115.892 10.115 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.418 ' H41' ' C ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.536 3.073 1 P-O3'-C3' 125.652 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 111.133 0.049 . . . . 0.0 111.133 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.28 -175.39 26.67 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 125.972 1.749 . . . . 0.0 113.099 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.424 ' SD ' " H1'" ' B' ' 25' ' ' ' DC' . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -88.07 172.02 9.84 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.1 t -91.22 2.98 55.96 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.901 -1.124 . . . . 0.0 112.595 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -136.62 154.36 50.68 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.409 1.884 . . . . 0.0 112.154 -166.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.839 1 C-N-CA 132.007 4.123 . . . . 0.0 116.341 -169.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 1 O4'-C1'-N19 111.528 4.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.935 2 O4'-C1'-C2' 98.205 -7.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.548 4.66 2 O4'-C1'-N19 112.912 6.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.58 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.855 5 O4'-C1'-N19 117.914 12.643 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.58 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.902 1 O4'-C1'-N19 116.335 10.669 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.424 " H1'" ' SD ' ' A' ' 13' ' ' MET . . . . . . . . 0 O4'--C4' 1.42 -2.338 4 O4'-C1'-C2' 98.136 -7.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 mttt . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.736 -0.65 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.95 -165.08 38.64 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.905 1.717 . . . . 0.0 112.593 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 4.0 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -71.57 153.74 41.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 p -75.75 -2.36 29.37 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.168 -1.583 . . . . 0.0 113.065 173.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -105.62 138.38 41.9 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.115 0.966 . . . . 0.0 111.036 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HB3' " H1'" ' B' ' 24' ' ' ' DC' . 2.8 ptt180 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 129.146 2.978 . . . . 0.0 113.438 164.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.359 1 O4'-C1'-N19 113.114 6.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 2 O4'-C1'-C2' 98.131 -7.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 1 O4'-C1'-N19 111.26 4.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.484 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.39 2 O4'-C1'-N19 118.079 12.849 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 113.835 7.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 5 O4'-C1'-N19 118.901 13.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.73 -167.58 23.36 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 123.904 0.764 . . . . 0.0 112.696 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -65.25 163.73 14.76 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -83.22 -12.06 57.21 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.036 -1.665 . . . . 0.0 110.749 168.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -143.29 95.71 2.8 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -167.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.9 mtm-85 . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 115.377 -2.249 . . . . 0.0 115.856 169.169 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.211 1 O4'-C1'-N19 114.403 8.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 2 O4'-C1'-C2' 97.503 -7.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.52 1 O4'-C1'-N19 111.153 4.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.547 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 117.469 12.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.845 2 O4'-C1'-N19 114.131 7.914 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.661 4 C4'-C3'-C2' 95.545 -7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 tptp . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.97 -174.39 19.01 Favored Glycine 0 N--CA 1.48 1.575 0 C-N-CA 125.727 1.632 . . . . 0.0 112.804 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.511 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -87.04 172.61 9.85 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -88.87 0.36 56.65 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.336 -0.852 . . . . 0.0 112.774 170.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.89 146.49 52.15 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.899 1.68 . . . . 0.0 112.695 -167.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 1.4 ptt85 . . . . . 0 N--CA 1.5 2.055 0 C-N-CA 130.511 3.524 . . . . 0.0 116.536 174.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.824 1 O4'-C1'-N19 111.857 5.071 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.878 2 O4'-C1'-C2' 97.475 -7.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.224 2 O4'-C1'-N19 112.731 6.163 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . 0.537 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.102 3 O4'-C1'-N19 116.683 11.103 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.43 1 O4'-C1'-N19 114.7 8.625 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . 0.402 " H5'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 O4'--C4' 1.423 -2.093 5 O4'-C1'-N19 116.67 11.088 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.82 171.85 29.81 Favored Glycine 0 N--CA 1.479 1.502 0 CA-C-N 120.831 1.65 . . . . 0.0 112.661 -178.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.413 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t -74.65 162.27 28.9 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 1.34 20.36 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.396 -0.815 . . . . 0.0 111.856 168.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -140.21 148.17 41.15 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -169.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.503 ' O ' ' HE2' ' A' ' 5' ' ' LYS 0.266 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.655 1 C-N-CA 136.065 5.746 . . . . 0.0 119.527 -179.147 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.085 1 O4'-C1'-N19 113.675 7.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.729 3 O4'-C1'-C2' 98.083 -7.288 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.675 0 OP1-P-OP2 114.885 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.581 2 O4'-C1'-N19 114.792 8.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 2 O4'-C1'-N19 112.842 6.303 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.879 4 C4'-C3'-C2' 94.84 -8.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.502 0 N-CA-C 114.086 0.394 . . . . 0.0 114.086 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.454 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.51 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.666 0 CA-C-O 119.585 -0.564 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.364 0 CA-C-O 120.167 -0.241 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.412 0 CA-C-O 119.987 -0.34 . . . . 0.0 113.259 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 CA-C-O 119.825 -0.431 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.439 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.428 ' HE2' ' HG ' ' A' ' 6' ' ' CYS . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 CA-C-O 119.389 -0.673 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.411 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.486 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 14' ' ' LYS . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t . . . . . 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.551 0 N-CA-C 111.989 -0.444 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.4 0 CA-C-O 119.766 -0.464 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 3' ' ' CYS . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.202 0 N-CA-C 114.501 0.56 . . . . 0.0 114.501 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.413 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.446 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.413 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 CA-C-O 119.15 -0.806 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.405 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t . . . . . 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.513 0 N-CA-C 114.75 0.66 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.6 t . . . . . 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.406 0 CA-C-O 119.894 -0.392 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.408 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t . . . . . 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.304 0 CA-C-O 119.69 -0.505 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.452 ' HG ' ' HE2' ' A' ' 11' ' ' HIS . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.452 ' HE2' ' HG ' ' A' ' 6' ' ' CYS . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.6 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.586 0 N-CA-C 114.247 0.459 . . . . 0.0 114.247 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.44 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.4 t . . . . . 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 CA-C-O 119.86 -0.411 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . 0.431 ' HB2' ' HE2' ' A' ' 5' ' ' LYS . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 4' ' ' TRP . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.619 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.519 0 CA-C-O 119.709 -0.495 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.0 t . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.97 0 CA-C-O 119.53 -0.594 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.426 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.7 t . . . . . 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 CA-C-O 119.437 -0.646 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.404 ' HG ' ' HE2' ' A' ' 11' ' ' HIS . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 CA-C-O 119.387 -0.674 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.413 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.92 -157.02 19.78 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.553 1.549 . . . . 0.0 114.086 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 46.0 t -77.45 133.17 38.68 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.582 1.553 . . . . 0.0 111.215 170.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 34.1 m0 -87.3 -26.34 23.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.415 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.09 -59.24 2.89 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.757 1.623 . . . . 0.0 112.226 -169.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 p -100.55 -41.25 7.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.374 1.87 . . . . 0.0 111.155 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.75 17.71 8.92 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 127.288 2.375 . . . . 0.0 114.441 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -100.22 107.19 18.97 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.395 1.878 . . . . 0.0 113.174 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -62.12 158.41 16.83 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.554 175.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.37 -11.2 50.97 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.353 1.454 . . . . 0.0 113.385 -174.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 20.4 p-80 -151.97 -167.4 2.77 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.991 1.716 . . . . 0.0 112.152 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.1 tt0 -149.63 -45.69 0.13 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 173.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.4 mtt -150.64 -62.71 0.2 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.222 1.009 . . . . 0.0 111.682 -178.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tttm -35.11 -47.85 0.4 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.28 1.832 . . . . 0.0 113.301 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.454 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -112.13 -11.05 13.83 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 130.644 3.578 . . . . 0.0 110.036 -152.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.55 168.79 6.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 122.144 0.973 . . . . 0.0 109.038 165.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -86.81 -1.96 58.18 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.785 -1.197 . . . . 0.0 110.937 168.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -145.84 113.23 6.26 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.045 1.738 . . . . 0.0 112.87 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 . . . . . 0 N--CA 1.495 1.785 0 C-N-CA 127.233 2.213 . . . . 0.0 115.369 169.155 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.951 1 O4'-C1'-N19 112.318 5.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . 0.421 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.409 -3.324 2 O4'-C1'-C2' 98.095 -7.278 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.421 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.282 1 O4'-C1'-N19 112.425 5.781 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.56 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.237 2 O4'-C1'-N19 117.234 11.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.145 1 C5'-C4'-O4' 115.931 4.082 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.583 2 O4'-C1'-N19 116.38 10.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.05 -162.69 11.29 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.746 1.641 . . . . 0.0 113.271 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 51.2 t -63.05 136.77 58.0 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.261 1.031 . . . . 0.0 111.072 170.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -96.25 -18.15 20.24 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.855 1.262 . . . . 0.0 111.702 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 2.4 mmmp? -74.15 -71.08 0.35 Allowed 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.122 1.369 . . . . 0.0 110.44 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.2 p -96.51 -26.46 15.27 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.006 1.722 . . . . 0.0 112.872 -173.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.56 22.05 25.05 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 123.979 0.8 . . . . 0.0 114.067 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -102.43 112.0 24.54 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.407 2.283 . . . . 0.0 113.832 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -60.96 160.53 9.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 123.232 1.491 . . . . 0.0 113.167 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -26.1 25.83 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.161 1.363 . . . . 0.0 112.742 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 36.0 p-80 -132.98 -167.97 2.0 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.313 1.445 . . . . 0.0 113.532 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -143.77 -63.97 0.38 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.816 1.246 . . . . 0.0 113.223 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 49.8 mtt -148.41 -46.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.691 1.197 . . . . 0.0 111.364 176.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -37.94 -48.64 1.18 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 126.094 1.758 . . . . 0.0 113.165 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 3.6 t70 -101.09 -15.36 17.44 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 112.038 -2.347 . . . . 0.0 111.32 -162.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -72.25 163.73 27.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -177.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 4.58 8.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 119.76 -1.838 . . . . 0.0 112.345 170.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -135.63 124.85 24.58 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.395 1.878 . . . . 0.0 112.606 -165.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HE2' ' A' ' 5' ' ' LYS . 11.0 ptt180 . . . . . 0 N--CA 1.499 1.981 1 C-N-CA 131.835 4.054 . . . . 0.0 119.038 165.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.797 1 O4'-C1'-N19 113.736 7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.08 2 O4'-C1'-N19 113.537 7.171 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-C2' 102.534 -3.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.577 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.418 -2.558 2 O4'-C1'-N19 116.053 10.317 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.577 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.42 -2.331 1 O4'-C1'-N19 115.578 9.723 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 4 O4'-C1'-C2' 98.288 -7.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.7 -160.59 23.58 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.815 1.198 . . . . 0.0 112.798 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.536 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.9 t -61.88 129.16 39.65 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.895 0.878 . . . . 0.0 111.889 170.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -87.3 -22.37 25.18 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.183 1.393 . . . . 0.0 111.892 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.557 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 2.6 mmmp? -71.06 -63.65 1.06 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.715 0.806 . . . . 0.0 110.84 -177.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -111.65 -20.14 12.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.551 1.54 . . . . 0.0 113.592 -166.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.43 44.52 5.85 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 123.799 0.714 . . . . 0.0 113.41 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 40.1 mttp -130.05 99.55 5.12 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 127.35 2.26 . . . . 0.0 111.632 -177.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -56.73 161.87 2.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.995 174.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.33 -14.12 65.93 Favored Glycine 0 CA--C 1.542 1.741 0 C-N-CA 124.336 0.969 . . . . 0.0 113.743 -174.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.3 p-80 -145.39 -173.54 4.14 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.259 1.824 . . . . 0.0 112.038 174.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 11.6 tt0 -141.3 -73.09 0.33 Allowed 'General case' 0 C--N 1.346 0.427 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 70.6 mtm -128.97 -43.04 1.36 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.956 0.798 . . . . 0.0 111.14 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -41.76 -49.06 4.35 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.831 1.777 . . . . 0.0 113.7 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.64 -3.62 11.76 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.369 3.067 . . . . 0.0 110.357 -157.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.9 t -70.87 166.42 21.17 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 165.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.1 t -82.76 4.53 24.83 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.961 -1.087 . . . . 0.0 111.209 168.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -130.35 144.06 51.15 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 126.271 1.829 . . . . 0.0 115.1 -170.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.557 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 2.0 ptt180 . . . . . 0 N--CA 1.489 1.493 1 C-N-CA 134.124 4.97 . . . . 0.0 118.708 174.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.183 1 O4'-C1'-N19 113.058 6.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.13 2 O4'-C1'-C2' 98.051 -7.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.93 1 O4'-C1'-N19 112.286 5.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.555 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.833 2 O4'-C1'-N19 116.744 11.18 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.555 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 P--O3' 1.578 -2.439 1 O4'-C1'-N19 115.053 9.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.027 3 O4'-C1'-C2' 97.938 -7.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.592 0.234 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.01 -160.5 34.09 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 120.957 -1.09 . . . . 0.0 113.259 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.3 t -68.3 136.15 53.01 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.881 0.848 . . . . 0.0 112.247 171.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -93.49 -30.87 14.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.36 1.464 . . . . 0.0 111.128 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -61.68 -53.2 59.34 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.058 1.343 . . . . 0.0 111.728 -176.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -116.05 -44.43 2.91 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.579 1.952 . . . . 0.0 112.246 -167.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 106.19 37.42 2.5 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.612 1.577 . . . . 0.0 113.844 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.9 mppt? -118.61 106.8 12.99 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 126.71 2.004 . . . . 0.0 112.061 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -59.3 157.94 10.03 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.217 -1.356 . . . . 0.0 112.532 175.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.02 -18.06 56.29 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.019 0.818 . . . . 0.0 113.713 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 27.7 p-80 -141.06 -172.36 3.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.719 2.007 . . . . 0.0 112.388 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.0 tt0 -148.11 -52.46 0.19 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.3 mtm -145.38 -56.25 0.31 Allowed 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.947 1.249 . . . . 0.0 111.27 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -33.01 -49.51 0.24 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.126 1.77 . . . . 0.0 113.261 173.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.9 OUTLIER -115.38 -12.66 11.72 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 110.25 -3.159 . . . . 0.0 110.329 -153.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -66.21 163.67 17.32 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 163.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.41 -6.57 59.07 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.795 -1.191 . . . . 0.0 111.785 171.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -120.91 126.01 48.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.223 -1.548 . . . . 0.0 112.346 -169.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.503 ' OXT' ' HE2' ' A' ' 5' ' ' LYS 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 C-N-CA 129.685 3.194 . . . . 0.0 119.134 165.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.835 1 O4'-C1'-N19 112.665 6.082 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . 0.411 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.831 3 O4'-C1'-N19 113.917 7.646 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.411 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.141 1 O4'-C1'-N19 111.554 4.693 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.598 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.416 -2.692 2 O4'-C1'-N19 115.92 10.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.598 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.545 4.253 2 O4'-C1'-N19 115.572 9.715 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.462 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C2'--C1' 1.496 -1.792 2 O4'-C1'-N19 115.713 9.891 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt . . . . . 0 N--CA 1.479 1.019 0 CA-C-O 121.404 0.621 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.92 -178.28 46.6 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.673 -1.267 . . . . 0.0 113.74 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.2 t -55.72 140.84 40.38 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 122.125 0.964 . . . . 0.0 111.908 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -98.12 -22.48 16.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.986 1.314 . . . . 0.0 110.969 175.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -53.51 11.64 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.283 1.033 . . . . 0.0 110.972 -173.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 p -110.44 -33.15 6.69 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 127.113 2.165 . . . . 0.0 111.934 -176.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 105.31 4.78 40.7 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.223 1.392 . . . . 0.0 114.575 -177.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -89.03 113.46 24.57 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.654 1.982 . . . . 0.0 112.925 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -63.55 170.25 3.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.235 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.87 -14.48 52.44 Favored Glycine 0 CA--C 1.542 1.735 0 C-N-CA 124.151 0.881 . . . . 0.0 114.104 -176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -143.32 -174.54 4.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.96 2.104 . . . . 0.0 111.918 174.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -149.63 -45.11 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.5 mtt -158.99 -44.12 0.06 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.575 1.95 . . . . 0.0 112.162 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.3 -34.62 6.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 128.066 2.546 . . . . 0.0 114.9 178.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.68 -9.29 6.17 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 110.328 -3.123 . . . . 0.0 110.372 -160.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.4 t -75.55 177.63 6.6 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.855 1.312 . . . . 0.0 109.418 170.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.7 t -101.75 10.21 40.19 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.852 1.261 . . . . 0.0 112.409 175.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -145.25 142.19 29.29 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 126.425 1.89 . . . . 0.0 112.857 -164.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 C-N-CA 130.44 3.496 . . . . 0.0 117.217 167.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.494 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.973 2 O4'-C1'-N19 114.035 7.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.421 0 O4'-C1'-N19 110.828 3.784 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.451 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.405 -3.707 3 O4'-C1'-N19 114.763 8.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.451 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 2 O4'-C1'-N19 116.394 10.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.473 0 O5'-C5'-C4' 114.635 3.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.42 -165.87 39.14 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 121.285 -0.884 . . . . 0.0 112.528 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.8 t -68.31 141.36 55.85 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.867 0.833 . . . . 0.0 110.582 168.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -100.28 -22.99 14.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.778 176.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 3.2 mmpt? -73.45 -63.26 1.23 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.684 1.194 . . . . 0.0 109.67 -171.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.1 p -93.14 -42.12 9.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.105 1.762 . . . . 0.0 111.96 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.03 18.38 9.35 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.623 1.582 . . . . 0.0 114.669 -174.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 5.3 mmtm -95.8 118.24 32.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.984 1.713 . . . . 0.0 114.094 177.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.12 160.43 32.07 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.347 -0.846 . . . . 0.0 112.532 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.94 -16.4 61.39 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.207 1.384 . . . . 0.0 114.116 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.486 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 23.9 p-80 -140.7 -168.61 2.62 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.897 1.679 . . . . 0.0 111.527 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.4 tt0 -149.99 -42.72 0.13 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 175.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.7 mtm -156.45 -50.76 0.08 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.75 1.22 . . . . 0.0 111.43 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 14' ' ' LYS . 0.9 OUTLIER -50.95 -32.37 20.68 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.012 1.725 . . . . 0.0 115.1 -179.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.86 -3.71 11.18 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 111.864 -2.426 . . . . 0.0 111.27 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.63 170.01 15.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 122.639 1.209 . . . . 0.0 110.211 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.706 HG23 ' HG3' ' A' ' 18' ' ' GLU . 7.9 t -88.1 -12.36 44.37 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.653 172.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.706 ' HG3' HG23 ' A' ' 17' ' ' THR . 6.1 mt-10 -151.64 112.09 4.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.153 0.981 . . . . 0.0 112.118 -168.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . 0.412 2.2 ptp180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 173.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.569 1 O4'-C1'-N19 113.496 7.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.052 2 O4'-C1'-C2' 97.925 -7.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.487 0 O4'-C1'-C2' 103.09 -2.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.506 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.083 4 O4'-C1'-N19 116.01 10.263 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.506 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.729 1 O4'-C1'-N19 117.421 12.026 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.693 0 O5'-C5'-C4' 114.182 2.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.2 mttm . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 110.717 -0.105 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -169.94 40.57 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 127.038 2.256 . . . . 0.0 111.989 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.05 142.95 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.725 1.21 . . . . 0.0 111.129 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -104.27 -15.43 15.47 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 125.354 1.461 . . . . 0.0 112.035 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -64.78 1.1 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.418 1.087 . . . . 0.0 110.492 -173.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -92.14 -30.45 15.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.224 1.41 . . . . 0.0 112.717 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.04 30.87 11.73 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.826 1.203 . . . . 0.0 113.795 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -108.25 112.11 24.42 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.585 1.954 . . . . 0.0 112.329 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -67.66 167.26 13.47 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.756 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.94 -11.81 70.94 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-N 114.835 -1.075 . . . . 0.0 114.227 -175.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -143.04 -172.04 3.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.124 2.169 . . . . 0.0 111.76 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -140.6 -61.9 0.5 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 mtm -145.77 -43.9 0.21 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 119.862 1.21 . . . . 0.0 111.636 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.18 -46.25 12.04 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 127.665 2.386 . . . . 0.0 113.082 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -15.11 15.62 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 111.426 -2.625 . . . . 0.0 110.843 -166.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -69.65 161.17 30.2 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 122.606 1.194 . . . . 0.0 109.7 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 t -90.29 -9.24 48.63 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.366 1.066 . . . . 0.0 111.562 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -141.6 127.08 18.84 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.348 1.459 . . . . 0.0 112.476 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.479 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.288 0.8 OUTLIER . . . . . 0 C--O 1.246 0.918 0 N-CA-C 118.616 2.821 . . . . 0.0 118.616 163.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.683 1 O4'-C1'-N19 112.782 6.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.158 2 O4'-C1'-N19 114.47 8.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.468 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.92 1 O4'-C1'-N19 111.315 4.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.591 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.406 -3.661 1 O4'-C1'-N19 114.44 8.3 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.055 2 O4'-C1'-N19 114.888 8.86 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.479 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.529 2.287 6 O4'-C1'-N19 114.708 8.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 121.395 0.617 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -124.83 -166.85 12.49 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 126.666 2.079 . . . . 0.0 112.256 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.3 t -68.25 134.89 51.11 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.111 0.956 . . . . 0.0 110.475 170.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.6 m0 -96.6 -13.46 22.88 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 124.34 1.056 . . . . 0.0 111.733 175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -80.15 -58.87 2.94 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.267 1.027 . . . . 0.0 111.045 -175.097 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.85 -28.99 10.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.665 1.986 . . . . 0.0 112.914 -176.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.74 20.98 22.74 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.736 1.16 . . . . 0.0 114.416 -177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -102.76 114.68 29.14 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.781 2.032 . . . . 0.0 113.108 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.76 169.54 14.34 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.559 1.171 . . . . 0.0 113.252 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 -6.36 83.75 Favored Glycine 0 CA--C 1.543 1.834 0 C-N-CA 125.124 1.345 . . . . 0.0 113.862 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.9 p-80 -148.04 -172.4 4.05 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.643 1.977 . . . . 0.0 113.225 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -143.44 -53.42 0.37 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.215 1.406 . . . . 0.0 113.99 179.197 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 59.1 mtm -156.61 -48.53 0.07 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.797 1.639 . . . . 0.0 111.842 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -45.96 -46.63 16.35 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 124.182 1.944 . . . . 0.0 112.943 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -15.28 19.74 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.174 -169.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.8 t -66.16 163.67 17.22 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 123.321 1.534 . . . . 0.0 109.94 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.57 HG23 ' HG3' ' A' ' 18' ' ' GLU . 11.3 t -88.93 -12.18 42.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.09 172.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HG23 ' A' ' 17' ' ' THR . 7.8 mt-10 -143.5 121.7 12.23 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.767 1.227 . . . . 0.0 112.372 -175.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.502 ' HB3' " H1'" ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 118.907 2.928 . . . . 0.0 118.907 156.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.258 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.241 2 O4'-C1'-N19 114.719 8.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.449 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.545 4.267 2 O4'-C1'-N19 111.629 4.787 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.545 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.404 -3.842 2 O4'-C1'-N19 113.915 7.644 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.545 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.812 2 O4'-C1'-N19 114.446 8.308 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.502 " H1'" ' HB3' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.846 5 C4'-C3'-C2' 97.33 -5.87 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt . . . . . 0 N--CA 1.47 0.548 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.58 -164.97 16.48 Favored Glycine 0 CA--C 1.533 1.202 0 O-C-N 121.316 -0.865 . . . . 0.0 114.501 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.9 t -60.25 129.56 42.29 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.26 1.424 . . . . 0.0 111.459 172.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -91.04 -14.95 30.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.91 -1.495 . . . . 0.0 111.437 175.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.63 -58.05 2.97 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 109.378 -173.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.3 p -110.93 -28.45 8.35 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.528 1.531 . . . . 0.0 114.707 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.33 16.44 18.33 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.397 0.999 . . . . 0.0 115.275 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.7 mttp -93.7 108.24 20.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.905 2.482 . . . . 0.0 112.789 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.73 -17.47 55.91 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.2 -14.44 59.39 Favored Glycine 0 CA--C 1.541 1.67 0 N-CA-C 115.155 0.822 . . . . 0.0 115.155 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.6 p-80 -150.27 -160.7 1.21 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.526 1.53 . . . . 0.0 112.509 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.0 tt0 -141.33 -63.39 0.46 Allowed 'General case' 0 C--N 1.347 0.47 0 N-CA-C 115.764 1.765 . . . . 0.0 115.764 173.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 42.9 mtm -143.32 -49.79 0.32 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 118.738 0.699 . . . . 0.0 111.127 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -36.03 -49.23 0.63 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.982 2.113 . . . . 0.0 113.803 174.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.446 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 2.2 t0 -114.59 -5.2 12.77 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 129.19 2.996 . . . . 0.0 109.641 -157.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -70.18 144.54 51.92 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 168.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 t -71.18 -5.4 31.55 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.429 -1.419 . . . . 0.0 112.379 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.9 mm-40 -116.09 145.56 42.92 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.982 1.713 . . . . 0.0 113.1 -175.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.607 ' HD2' " H1'" ' B' ' 25' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.53 0 C-N-CA 125.533 1.533 . . . . 0.0 110.387 153.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.68 1 O4'-C1'-N19 111.467 4.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . 0.459 " H4'" " O5'" ' B' ' 22' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.41 -3.295 3 O4'-C1'-C2' 97.801 -7.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.459 " O5'" " H4'" ' B' ' 21' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.644 1 O4'-C1'-N19 111.312 4.39 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.477 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.828 2 O4'-C1'-N19 116.218 10.523 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.496 " H5'" ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 1 O4'-C1'-N19 114.68 8.6 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.607 " H1'" ' HD2' ' A' ' 19' ' ' ARG . . . . . . . . 0 O4'--C4' 1.428 -1.664 2 O4'-C1'-N19 118.513 13.391 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.8 mttp . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.29 -166.13 39.05 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.011 1.291 . . . . 0.0 112.147 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 52.4 t -62.24 135.32 57.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.54 1.17 . . . . 0.0 111.643 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 30.5 m0 -94.29 -16.29 23.7 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.763 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 1.9 mmmp? -83.4 -45.07 14.11 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -174.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 p -122.4 -21.14 5.88 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.158 1.783 . . . . 0.0 112.702 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.7 24.68 27.35 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 125.055 1.312 . . . . 0.0 114.342 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.405 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 19.4 mttt -107.72 103.08 12.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.897 2.079 . . . . 0.0 112.879 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.69 154.46 11.61 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.428 -1.26 . . . . 0.0 112.654 174.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -17.74 52.24 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.159 0.885 . . . . 0.0 113.517 -174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 23.8 p-80 -144.23 -169.95 3.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.241 1.816 . . . . 0.0 112.508 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.2 tt0 -148.78 -57.35 0.21 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 175.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 50.5 mtt -150.77 -39.27 0.13 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.333 1.053 . . . . 0.0 112.191 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -45.05 -33.92 2.31 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.351 2.261 . . . . 0.0 115.242 171.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.4 OUTLIER -134.29 -7.17 2.61 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.91 -2.405 . . . . 0.0 110.829 -155.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 t -77.62 171.42 14.95 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.976 1.31 . . . . 0.0 108.531 169.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.6 t -87.11 0.99 54.39 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.183 -0.948 . . . . 0.0 112.876 171.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -133.37 141.88 48.11 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.998 1.319 . . . . 0.0 114.208 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.427 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 2.0 mtm180 . . . . . 0 N--CA 1.496 1.846 1 C-N-CA 132.774 4.43 . . . . 0.0 116.347 174.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.095 4.119 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 2 O4'-C1'-N19 114.081 7.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.72 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.527 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.862 6 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.527 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 2.961 1 O4'-C1'-N19 115.387 9.483 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.419 " H5'" ' HB3' ' A' ' 19' ' ' ARG . . . . . . . . 0 O5'--C5' 1.411 -1.811 3 O4'-C1'-C2' 96.156 -9.04 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.44 -163.89 14.72 Favored Glycine 0 CA--C 1.538 1.513 0 C-N-CA 125.481 1.515 . . . . 0.0 114.75 -178.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.7 t -72.76 137.2 45.71 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.277 1.431 . . . . 0.0 110.118 168.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.7 m0 -103.41 -13.67 16.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.479 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -79.06 -56.81 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.065 0.946 . . . . 0.0 110.936 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.4 p -109.69 -24.33 10.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.823 1.249 . . . . 0.0 113.926 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.14 22.01 33.81 Favored Glycine 0 CA--C 1.536 1.388 0 O-C-N 121.554 -0.716 . . . . 0.0 114.331 -177.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -102.41 112.98 25.93 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.735 2.014 . . . . 0.0 112.566 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.05 163.39 9.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.502 -1.226 . . . . 0.0 112.62 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.1 -12.04 69.74 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.679 1.133 . . . . 0.0 114.119 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -142.13 -169.08 2.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.455 1.902 . . . . 0.0 113.349 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 -62.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.947 1.299 . . . . 0.0 113.579 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.9 mtm -145.09 -53.72 0.3 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.665 1.186 . . . . 0.0 111.63 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -34.61 -52.73 0.52 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 127.165 2.186 . . . . 0.0 113.12 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.94 -10.44 19.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 130.39 3.476 . . . . 0.0 110.814 -163.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.63 162.45 13.03 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 123.038 1.399 . . . . 0.0 108.778 168.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -87.66 -12.43 45.47 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 121.243 -0.91 . . . . 0.0 110.021 173.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -134.2 120.18 19.73 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 126.408 1.883 . . . . 0.0 112.26 178.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' . 7.5 ptp180 . . . . . 0 C--O 1.249 1.035 0 N-CA-C 120.614 3.561 . . . . 0.0 120.614 154.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.893 1 O4'-C1'-N19 111.985 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.844 2 O4'-C1'-C2' 98.42 -6.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.4 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O4'-C1'-N19 110.189 2.987 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.464 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.832 2 O4'-C1'-N19 114.774 8.718 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 113.084 6.605 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.53 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C2'--C1' 1.494 -1.935 5 C4'-C3'-C2' 96.816 -6.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 tttp . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 121.29 -163.58 14.7 Favored Glycine 0 N--CA 1.477 1.406 0 C-N-CA 124.286 0.946 . . . . 0.0 113.063 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.86 143.32 57.72 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 122.346 1.069 . . . . 0.0 111.945 174.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -102.42 -21.24 14.29 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.92 1.288 . . . . 0.0 110.89 176.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.408 ' N ' ' HE2' ' A' ' 5' ' ' LYS . 2.1 mmpt? -78.11 -47.79 17.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.179 1.392 . . . . 0.0 111.017 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.8 p -119.7 -23.1 6.62 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.179 1.792 . . . . 0.0 113.823 -176.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 19.74 44.69 Favored Glycine 0 CA--C 1.534 1.22 0 O-C-N 121.534 -0.729 . . . . 0.0 114.085 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -101.75 105.37 16.24 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 126.883 2.073 . . . . 0.0 111.719 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -53.46 162.14 0.85 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.472 -1.24 . . . . 0.0 112.908 168.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.67 -22.51 40.12 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.29 1.424 . . . . 0.0 112.79 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -139.52 -168.86 2.56 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.875 2.07 . . . . 0.0 112.087 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.33 -51.76 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 173.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 67.5 mtm -151.32 -65.38 0.18 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.003 0.82 . . . . 0.0 110.314 -175.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -33.29 18.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.45 1.1 . . . . 0.0 112.968 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -5.88 21.3 Favored 'General case' 0 C--N 1.322 -0.618 1 C-N-CA 131.815 4.046 . . . . 0.0 113.574 -171.708 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -79.49 178.93 7.76 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.816 0.817 . . . . 0.0 110.136 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -7.25 47.07 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 120.862 -1.149 . . . . 0.0 111.886 172.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -117.18 152.37 34.91 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.88 2.472 . . . . 0.0 111.115 -169.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' H ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 C-N-CA 124.385 1.074 . . . . 0.0 108.948 158.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 1 O4'-C1'-N19 113.494 7.118 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.82 2 O4'-C1'-N19 113.431 7.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.552 1 O4'-C1'-N19 111.617 4.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.594 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.443 2 O4'-C1'-N19 117.095 11.619 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.594 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 O4'-C1'-N19 113.068 6.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.576 -2.589 2 O4'-C1'-N19 114.936 8.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.648 0.737 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.47 -177.46 47.8 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.669 1.604 . . . . 0.0 111.966 -170.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 41.5 t -66.17 135.9 55.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.856 0.836 . . . . 0.0 112.244 178.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -99.1 -9.59 23.63 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.783 1.633 . . . . 0.0 112.105 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.53 -51.38 5.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.441 1.096 . . . . 0.0 112.022 -170.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.16 -31.93 8.04 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.115 1.766 . . . . 0.0 111.94 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.46 34.67 5.72 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.521 1.057 . . . . 0.0 113.849 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 36.9 mttp -120.92 115.3 22.95 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.103 2.161 . . . . 0.0 112.467 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -66.87 169.41 8.15 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.474 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -9.91 66.67 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 115.116 0.806 . . . . 0.0 115.116 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 28.2 p-80 -140.62 -170.36 2.99 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.359 1.863 . . . . 0.0 111.068 170.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.12 -77.08 0.27 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 117.66 -1.162 . . . . 0.0 112.359 171.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -125.57 -41.32 2.02 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 120.892 1.678 . . . . 0.0 112.999 176.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -49.15 -44.64 42.83 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.009 2.124 . . . . 0.0 113.973 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.94 -13.52 16.88 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 128.586 2.755 . . . . 0.0 109.856 -170.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -67.53 162.36 23.52 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.073 1.349 . . . . 0.0 110.729 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.8 t -96.47 -4.9 40.77 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.334 1.053 . . . . 0.0 112.155 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -151.98 129.3 11.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 126.306 1.843 . . . . 0.0 110.371 -176.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.489 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.264 7.8 ptp180 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 119.724 3.231 . . . . 0.0 119.724 164.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.108 1 O4'-C1'-N19 112.324 5.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.001 2 O4'-C1'-N19 113.714 7.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.415 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.549 4.731 1 O4'-C1'-N19 111.756 4.945 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.558 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.114 3 O4'-C1'-N19 116.003 10.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 114.014 7.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.489 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.928 4 O4'-C1'-N19 114.752 8.69 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.26 -166.22 31.42 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.409 1.459 . . . . 0.0 114.247 174.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.7 t -64.87 137.13 57.57 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.012 0.925 . . . . 0.0 111.307 172.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -96.8 -15.86 21.11 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 124.837 1.255 . . . . 0.0 111.831 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -87.91 -62.6 1.46 Allowed 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.216 1.006 . . . . 0.0 110.643 -172.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.6 p -93.28 -28.06 16.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.539 1.536 . . . . 0.0 113.063 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.87 11.59 49.49 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.985 1.278 . . . . 0.0 114.736 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -92.96 117.55 30.18 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.05 2.14 . . . . 0.0 113.733 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -67.92 165.27 18.08 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.84 0.828 . . . . 0.0 112.594 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.97 -2.65 79.88 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 123.668 0.651 . . . . 0.0 114.691 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -151.57 -168.71 3.16 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.725 2.01 . . . . 0.0 112.39 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.4 tt0 -142.73 -61.84 0.43 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 174.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.5 mtm -145.24 -44.61 0.22 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.307 1.043 . . . . 0.0 111.506 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -46.36 -46.39 18.3 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.384 2.274 . . . . 0.0 113.328 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.27 -9.49 20.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 111.928 -2.397 . . . . 0.0 111.353 -169.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.4 t -71.1 160.78 32.26 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 122.164 0.983 . . . . 0.0 109.752 -178.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -3.97 57.73 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.629 0.772 . . . . 0.0 111.899 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -151.61 125.66 9.22 Favored 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 125.549 1.539 . . . . 0.0 111.731 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.448 ' HB2' " H1'" ' B' ' 25' ' ' ' DC' 0.305 3.9 ptp180 . . . . . 0 C--O 1.245 0.841 0 N-CA-C 119.236 3.05 . . . . 0.0 119.236 161.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 1 O4'-C1'-N19 112.418 5.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.458 3 O4'-C1'-N19 114.498 8.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.456 " H3'" H5'' ' B' ' 23' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.544 4.093 1 O4'-C1'-N19 111.411 4.514 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.554 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.408 -3.482 1 O4'-C1'-N19 114.841 8.801 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.611 1 O4'-C1'-N19 113.842 7.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.448 " H1'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.524 1.594 5 O4'-C1'-N19 113.429 7.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.16 -167.78 29.32 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.755 1.169 . . . . 0.0 112.519 -170.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 53.3 t -69.23 139.89 54.49 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 117.8 0.8 . . . . 0.0 110.994 168.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.431 ' HB2' ' HE2' ' A' ' 5' ' ' LYS . 1.8 m0 -105.87 -1.53 24.08 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.756 1.223 . . . . 0.0 111.565 175.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 4' ' ' TRP . 0.0 OUTLIER -94.73 -62.78 1.26 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.498 1.119 . . . . 0.0 110.369 -173.147 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.91 -31.16 13.25 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.152 2.181 . . . . 0.0 113.026 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.45 24.68 15.5 Favored Glycine 0 CA--C 1.541 1.668 0 C-N-CA 124.834 1.207 . . . . 0.0 114.502 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -106.9 111.08 23.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.556 1.942 . . . . 0.0 112.874 177.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.19 161.4 29.24 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.1 0.952 . . . . 0.0 112.751 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.7 -17.95 55.75 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.99 1.281 . . . . 0.0 113.087 -176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -135.52 -169.14 2.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.828 2.051 . . . . 0.0 111.45 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.2 tt0 -145.29 -63.96 0.34 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.3 mtm -139.9 -39.99 0.45 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.384 0.993 . . . . 0.0 111.961 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.29 -47.63 18.25 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 127.572 2.349 . . . . 0.0 114.02 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.52 -7.71 16.45 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 110.963 -2.835 . . . . 0.0 110.561 -165.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.7 t -75.39 170.18 16.61 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.043 1.337 . . . . 0.0 110.646 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -100.55 5.19 43.96 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.669 1.188 . . . . 0.0 113.103 178.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -142.82 152.14 41.88 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.948 1.699 . . . . 0.0 111.909 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.57 ' HA ' " H1'" ' B' ' 24' ' ' ' DC' . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 126.651 1.98 . . . . 0.0 110.175 166.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.485 1 O4'-C1'-N19 112.024 5.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.768 2 O4'-C1'-N19 115.237 9.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.803 1 O4'-C1'-N19 112.021 5.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.602 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 O4'--C4' 1.395 -4.601 3 O4'-C1'-N19 112.371 5.714 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.602 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.415 -2.814 1 O4'-C1'-N19 115.892 10.115 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.418 ' H41' ' C ' ' A' ' 19' ' ' ARG . . . . . . . . 0 C5'--C4' 1.536 3.073 1 P-O3'-C3' 125.652 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 111.133 0.049 . . . . 0.0 111.133 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.28 -175.39 26.67 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 125.972 1.749 . . . . 0.0 113.099 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 41.6 t -59.4 139.01 57.45 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 119.148 1.474 . . . . 0.0 111.973 175.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -97.16 -14.92 21.17 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.988 1.315 . . . . 0.0 112.103 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.34 -68.61 0.69 Allowed 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.462 1.105 . . . . 0.0 111.223 -177.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.3 p -94.08 -28.57 15.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.206 1.802 . . . . 0.0 111.92 -176.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.82 30.72 10.05 Favored Glycine 0 CA--C 1.532 1.152 0 O-C-N 121.303 -0.873 . . . . 0.0 113.88 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -109.98 113.58 26.41 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 127.844 2.458 . . . . 0.0 112.564 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 166.42 10.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.405 1.098 . . . . 0.0 113.283 178.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.49 -18.36 57.19 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 126.088 1.804 . . . . 0.0 112.854 -173.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 p-80 -142.69 -172.89 3.73 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.527 1.531 . . . . 0.0 114.055 -176.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 3.5 tt0 -142.26 -59.74 0.45 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.68 1.592 . . . . 0.0 113.689 178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.424 ' SD ' " H1'" ' B' ' 25' ' ' ' DC' . 65.7 mtt -152.71 -46.2 0.1 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.686 1.594 . . . . 0.0 111.668 -176.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -43.89 -43.09 6.2 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.911 2.084 . . . . 0.0 114.052 173.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.63 2.09 14.42 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 111.424 -2.626 . . . . 0.0 109.454 -165.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -88.07 172.02 9.84 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.663 1.585 . . . . 0.0 109.489 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.1 t -91.22 2.98 55.96 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.901 -1.124 . . . . 0.0 112.595 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -136.62 154.36 50.68 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.409 1.884 . . . . 0.0 112.154 -166.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.839 1 C-N-CA 132.007 4.123 . . . . 0.0 116.341 -169.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 1 O4'-C1'-N19 111.528 4.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.935 2 O4'-C1'-C2' 98.205 -7.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.548 4.66 2 O4'-C1'-N19 112.912 6.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.58 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.415 -2.855 5 O4'-C1'-N19 117.914 12.643 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.58 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.902 1 O4'-C1'-N19 116.335 10.669 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.424 " H1'" ' SD ' ' A' ' 13' ' ' MET . . . . . . . . 0 O4'--C4' 1.42 -2.338 4 O4'-C1'-C2' 98.136 -7.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 mttt . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.736 -0.65 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.95 -165.08 38.64 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.905 1.717 . . . . 0.0 112.593 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 43.1 t -67.85 132.42 47.35 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.534 1.134 . . . . 0.0 111.761 176.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -92.76 -15.79 26.18 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.924 0.89 . . . . 0.0 111.993 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 2.8 mmmp? -74.19 -62.67 1.43 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.441 -0.787 . . . . 0.0 110.934 178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -110.5 -19.78 12.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.595 1.958 . . . . 0.0 113.867 -169.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.66 13.63 54.8 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.27 0.938 . . . . 0.0 114.515 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -98.57 112.43 24.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.965 2.106 . . . . 0.0 113.198 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.0 158.84 27.22 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.063 177.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.26 -13.46 55.13 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 124.921 1.248 . . . . 0.0 112.432 -175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 24.0 p-80 -148.08 -172.38 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.956 1.702 . . . . 0.0 113.199 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.9 tt0 -142.85 -60.79 0.43 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.0 mtt -145.59 -55.07 0.29 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.883 1.273 . . . . 0.0 111.606 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -30.87 -42.95 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 127.805 2.442 . . . . 0.0 115.172 171.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.7 OUTLIER -117.14 -14.67 10.53 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 128.382 2.673 . . . . 0.0 110.959 -160.125 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -71.57 153.74 41.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 p -75.75 -2.36 29.37 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.168 -1.583 . . . . 0.0 113.065 173.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -105.62 138.38 41.9 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.115 0.966 . . . . 0.0 111.036 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HB3' " H1'" ' B' ' 24' ' ' ' DC' . 2.8 ptt180 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 129.146 2.978 . . . . 0.0 113.438 164.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.359 1 O4'-C1'-N19 113.114 6.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 2 O4'-C1'-C2' 98.131 -7.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 1 O4'-C1'-N19 111.26 4.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.484 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.39 2 O4'-C1'-N19 118.079 12.849 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 1 O4'-C1'-N19 113.835 7.544 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 5 O4'-C1'-N19 118.901 13.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.73 -167.58 23.36 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 123.904 0.764 . . . . 0.0 112.696 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 44.7 t -62.43 126.48 27.49 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 118.442 1.121 . . . . 0.0 111.49 174.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -89.08 -12.12 42.13 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 0.0 111.304 174.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.41 -60.67 1.91 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.882 1.273 . . . . 0.0 110.024 -173.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.9 p -101.86 -39.72 7.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.081 1.753 . . . . 0.0 112.557 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 110.24 15.22 11.82 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.423 1.011 . . . . 0.0 115.596 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 11' ' ' HIS . 36.6 mttt -92.35 108.77 20.2 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.257 2.223 . . . . 0.0 112.644 173.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -55.63 -19.89 11.98 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.51 -10.4 36.33 Favored Glycine 0 CA--C 1.542 1.743 0 N-CA-C 115.709 1.044 . . . . 0.0 115.709 178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 8' ' ' LYS . 25.3 p-80 -157.44 -154.81 0.47 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.013 1.725 . . . . 0.0 111.845 -178.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 12.5 tt0 -143.66 -54.5 0.37 Allowed 'General case' 0 C--N 1.346 0.451 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 174.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.6 mtm -152.05 -54.81 0.13 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.697 1.199 . . . . 0.0 110.079 177.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -38.55 -47.03 1.25 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.67 1.588 . . . . 0.0 114.37 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.14 -3.79 17.06 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 129.241 3.016 . . . . 0.0 111.28 -163.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -65.25 163.73 14.76 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.207 1.003 . . . . 0.0 108.438 167.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -83.22 -12.06 57.21 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.036 -1.665 . . . . 0.0 110.749 168.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -143.29 95.71 2.8 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -167.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.9 mtm-85 . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 115.377 -2.249 . . . . 0.0 115.856 169.169 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.211 1 O4'-C1'-N19 114.403 8.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 2 O4'-C1'-C2' 97.503 -7.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.52 1 O4'-C1'-N19 111.153 4.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.547 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 117.469 12.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.845 2 O4'-C1'-N19 114.131 7.914 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.661 4 C4'-C3'-C2' 95.545 -7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.7 tptp . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.97 -174.39 19.01 Favored Glycine 0 N--CA 1.48 1.575 0 C-N-CA 125.727 1.632 . . . . 0.0 112.804 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' GLN . 42.1 t -54.39 131.64 42.6 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.142 0.977 . . . . 0.0 111.655 176.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -88.96 -23.6 22.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.523 1.129 . . . . 0.0 111.205 175.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.511 ' HE2' ' OXT' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -75.37 -59.73 2.62 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.961 0.904 . . . . 0.0 111.627 -173.057 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -109.54 -19.11 13.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.79 1.636 . . . . 0.0 113.37 -174.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.4 21.83 33.67 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 123.584 0.611 . . . . 0.0 114.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -109.2 108.76 19.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 127.157 2.183 . . . . 0.0 112.184 -176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.03 164.91 16.77 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 122.674 1.226 . . . . 0.0 112.828 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.14 0.43 90.22 Favored Glycine 0 CA--C 1.539 1.591 0 O-C-N 121.461 -0.774 . . . . 0.0 114.138 -173.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 15' ' ' ASP . 21.5 p-80 -149.7 -173.42 4.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.093 1.757 . . . . 0.0 112.039 167.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.4 tt0 -146.46 -57.09 0.28 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 175.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -148.64 -49.06 0.15 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 178.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -32.46 2.5 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.382 1.873 . . . . 0.0 114.921 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 11' ' ' HIS . 0.1 OUTLIER -120.62 -2.12 9.96 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 128.104 2.562 . . . . 0.0 110.764 -165.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.6 t -87.04 172.61 9.85 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.562 1.945 . . . . 0.0 108.749 174.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -88.87 0.36 56.65 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.336 -0.852 . . . . 0.0 112.774 170.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.89 146.49 52.15 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.899 1.68 . . . . 0.0 112.695 -167.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' OXT' ' HE2' ' A' ' 5' ' ' LYS . 1.4 ptt85 . . . . . 0 N--CA 1.5 2.055 0 C-N-CA 130.511 3.524 . . . . 0.0 116.536 174.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.824 1 O4'-C1'-N19 111.857 5.071 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.878 2 O4'-C1'-C2' 97.475 -7.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.224 2 O4'-C1'-N19 112.731 6.163 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . 0.537 H2'' ' C6 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.412 -3.102 3 O4'-C1'-N19 116.683 11.103 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' B' ' 23' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.43 1 O4'-C1'-N19 114.7 8.625 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . 0.402 " H5'" ' HB2' ' A' ' 19' ' ' ARG . . . . . . . . 0 O4'--C4' 1.423 -2.093 5 O4'-C1'-N19 116.67 11.088 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.82 171.85 29.81 Favored Glycine 0 N--CA 1.479 1.502 0 CA-C-N 120.831 1.65 . . . . 0.0 112.661 -178.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 8' ' ' LYS . 43.1 t -48.83 119.8 3.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.464 1.506 . . . . 0.0 114.239 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -78.81 -20.44 49.72 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.587 1.155 . . . . 0.0 112.113 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 19' ' ' ARG . 1.6 mmmp? -79.69 -59.36 2.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.589 1.556 . . . . 0.0 111.676 -174.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.5 p -108.12 -25.0 11.32 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -173.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.66 24.31 13.96 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.025 0.821 . . . . 0.0 114.453 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.413 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 41.4 mttp -115.36 109.74 18.35 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.161 2.184 . . . . 0.0 113.229 -177.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -60.92 164.7 4.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 123.069 1.414 . . . . 0.0 113.456 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.01 -21.68 35.66 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.861 1.219 . . . . 0.0 113.858 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -135.19 -175.54 3.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.662 1.585 . . . . 0.0 112.308 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.44 -54.53 0.25 Allowed 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.8 mtt -146.83 -47.55 0.18 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.542 0.737 . . . . 0.0 112.142 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.4 ttmm -42.85 -54.64 4.06 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.863 1.316 . . . . 0.0 113.077 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.94 -10.3 22.95 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.128 2.971 . . . . 0.0 109.918 -162.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.1 t -74.65 162.27 28.9 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-O 122.521 1.153 . . . . 0.0 109.389 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 1.34 20.36 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.396 -0.815 . . . . 0.0 111.856 168.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -140.21 148.17 41.15 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -169.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.503 ' O ' ' HE2' ' A' ' 5' ' ' LYS 0.266 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.655 1 C-N-CA 136.065 5.746 . . . . 0.0 119.527 -179.147 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.085 1 O4'-C1'-N19 113.675 7.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.729 3 O4'-C1'-C2' 98.083 -7.288 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.675 0 OP1-P-OP2 114.885 -3.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.581 2 O4'-C1'-N19 114.792 8.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 2 O4'-C1'-N19 112.842 6.303 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.879 4 C4'-C3'-C2' 94.84 -8.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_