data_2kae_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 2kae _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 ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.482 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.634 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.634 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . 0.553 HG23 ' N ' ' A' ' 124' ' ' ARG . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.553 ' N ' HG23 ' A' ' 123' ' ' ILE . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.598 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 128' ' ' ILE . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.598 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.498 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . 0.535 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.552 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . 0.408 HD22 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.408 ' HD3' HD22 ' A' ' 156' ' ' ASN . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.552 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 110.297 -0.26 . . . . 10.0 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.465 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.65 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.404 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.65 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.553 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.517 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.562 HE21 ' N ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.562 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.408 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 144' ' ' ARG . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.462 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.447 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 141' ' ' ILE . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.455 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . 0.447 ' HB2' ' HA ' ' A' ' 143' ' ' GLN . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp . . . . . 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.355 -0.239 . . . . 10.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.568 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.597 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.597 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.45 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 137' ' ' ASN . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.575 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.499 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.46 ' CA ' HE21 ' A' ' 135' ' ' GLN . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 124' ' ' ARG . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.629 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.499 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.432 ' O ' ' HB3' ' A' ' 144' ' ' ARG . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.629 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 141' ' ' ILE . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.604 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.604 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 CA--C 1.539 0.521 0 CA-C-O 120.0 -0.047 . . . . 10.0 110.982 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 117' ' ' CYS . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.435 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.501 ' HB2' ' CB ' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.563 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.508 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . 0.418 ' ND2' ' HB3' ' A' ' 125' ' ' TRP . 0.7 OUTLIER -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.485 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.613 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.508 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.502 HG21 HD13 ' A' ' 141' ' ' ILE . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.613 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 5.4 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.622 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.622 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.52 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.664 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.664 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.629 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.593 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . 0.448 HD22 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.43 ' H ' ' HG3' ' A' ' 129' ' ' ARG . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.402 ' HG3' ' OE1' ' A' ' 132' ' ' GLU . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.402 ' OE1' ' HG3' ' A' ' 131' ' ' LYS . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.593 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.558 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.434 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.501 HG21 HD13 ' A' ' 141' ' ' ILE . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.445 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.573 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 22.8 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.544 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 . . . . . 0 CA--C 1.536 0.428 0 CA-C-O 119.568 -0.253 . . . . 10.0 111.307 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.426 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.601 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 118' ' ' SER . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.601 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.553 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.563 ' CZ3' ' HB2' ' A' ' 135' ' ' GLN . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.516 HH21 HD13 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . 0.431 ' ND2' ' HB3' ' A' ' 125' ' ' TRP . 0.8 OUTLIER -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.489 ' HZ2' ' CD ' ' A' ' 132' ' ' GLU . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.489 ' CD ' ' HZ2' ' A' ' 131' ' ' LYS . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.516 HD13 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.563 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.433 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.508 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.628 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.508 HG12 ' O ' ' A' ' 137' ' ' ASN . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.628 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.571 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . 0.571 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . 0.409 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.409 ' HG2' ' ND2' ' A' ' 156' ' ' ASN . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.472 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 22.3 tttm . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.342 0.115 . . . . 10.0 111.198 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.539 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.64 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.64 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.67 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.413 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.541 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.634 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.432 ' OE1' ' HE3' ' A' ' 162' ' ' LYS . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.432 ' HE3' ' OE1' ' A' ' 159' ' ' GLN . 1.7 ttpp . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.366 -0.235 . . . . 10.0 110.366 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.463 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.602 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.602 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.411 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.547 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . 0.413 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 2.5 m-80 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.413 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.442 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.653 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.587 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.429 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 124' ' ' ARG . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.402 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 126' ' ' ARG . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . 0.405 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.1 m-80 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.405 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.587 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.423 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.482 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.482 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 161' ' ' ARG . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 29.1 tttp . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.42 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 119.806 -0.14 . . . . 10.0 110.897 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.52 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.581 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.581 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.616 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.506 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' CYS . . . . . 0.415 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.451 HD13 HG21 ' A' ' 141' ' ' ILE . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . 0.476 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.413 ' HD2' ' HD2' ' A' ' 151' ' ' PRO . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LYS . . . . . 0.469 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.477 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.477 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.413 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . 0.417 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' TYR . . . . . 0.452 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' GLN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . 0.401 ' HE ' ' HB3' ' A' ' 161' ' ' ARG . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.48 ' HB2' ' HA ' ' A' ' 159' ' ' GLN . 13.0 mtpt . . . . . 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.43 -106.3 0.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.482 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.634 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.634 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . 0.553 HG23 ' N ' ' A' ' 124' ' ' ARG . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.553 ' N ' HG23 ' A' ' 123' ' ' ILE . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.598 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 128' ' ' ILE . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.598 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.498 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.432 HD12 ' N6 ' ' C' ' 30' ' ' ' DA' . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.586 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.523 ' HZ1' " H3'" ' C' ' 26' ' ' ' DA' . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 0.535 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.403 ' HB3' ' H41' ' B' ' 13' ' ' ' DC' . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.552 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . 0.408 HD22 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.596 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.552 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.49 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.403 ' HZ2' " H3'" ' C' ' 24' ' ' ' DA' . 4.6 mtpp -66.2 -11.54 50.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 70.9 mt -93.82 -13.21 27.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.715 -0.394 . . . . 10.0 110.703 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 161' ' ' ARG . 47.9 mtmt -84.73 -52.62 5.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.845 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.99 144.34 34.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.453 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.51 179.825 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.651 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 100.908 -1.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.651 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 100.792 -1.363 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.619 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.935 -1.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 99.806 -2.067 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.589 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.242 -2.47 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.523 " H3'" ' HZ1' ' A' ' 145' ' ' LYS . . . . . . . . 0 C2'--C1' 1.506 -1.098 0 C3'-C2'-C1' 99.309 -2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.794 0 O4'-C1'-C2' 103.989 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.501 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 O4'-C1'-N19 109.01 1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.501 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 98.931 -2.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.468 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.583 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 99.411 -2.35 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.583 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.638 0 C3'-C2'-C1' 99.732 -2.12 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 C3'-C2'-C1' 99.509 -2.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.513 ' H73' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.189 -1.737 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.652 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 O4'-C1'-C2' 104.546 -1.413 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.652 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.68 -1.443 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.568 H2'' ' C5 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.722 0 C3'-C2'-C1' 99.772 -2.091 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.568 ' C5 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.604 0 C3'-C2'-C1' 101.586 -0.796 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.607 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.857 -1.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.607 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C5'-C4'-O4' 108.227 -0.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.529 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.549 -1.536 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.529 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 99.594 -2.218 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.559 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C3'-C2'-C1' 100.397 -1.645 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C3'-C2'-C1' 100.797 -1.359 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.559 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.284 -1.726 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 99.695 -2.146 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.543 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 98.79 -2.793 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.484 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.618 0 C3'-C2'-C1' 98.606 -2.924 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.494 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.417 0 O4'-C1'-N19 109.807 2.509 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.601 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 100.998 -1.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.601 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.865 0 C3'-C2'-C1' 97.755 -3.532 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.704 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 OP1-P-O3' 110.263 0.895 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.704 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 N19-C1'-C2' 116.359 1.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.623 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 100.158 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.49 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.506 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 100.22 -1.771 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.639 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 100.339 -1.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.639 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 O4'-C1'-C2' 104.598 -1.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 100.227 -1.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.516 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 OP1-P-O3' 109.292 0.591 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.781 0.324 . . . . 10.0 110.625 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 -105.81 -96.76 0.34 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.297 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.465 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.65 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.404 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.65 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.553 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.592 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.517 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.562 HE21 ' N ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.562 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.408 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.49 HG22 ' H72' ' C' ' 29' ' ' ' DT' . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.462 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.447 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.478 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.493 ' HZ2' " H3'" ' C' ' 26' ' ' ' DA' . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . 0.534 ' HH ' " H3'" ' C' ' 27' ' ' ' DA' . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.502 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.52 ' CE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.404 ' NZ ' " H3'" ' B' ' 13' ' ' ' DC' . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.509 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.415 ' C ' ' H ' ' A' ' 164' ' ' LYS . 3.0 ttpp -73.79 -8.71 57.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 6.1 tp -69.15 7.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' A' ' 162' ' ' LYS . 24.0 mtpp -60.25 -45.41 93.34 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.23 108.67 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.268 -1.333 . . . . 10.0 109.109 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.379 -178.553 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.599 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.635 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 100.401 -1.642 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.635 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.77 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.603 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 99.993 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.488 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.649 0 C3'-C2'-C1' 98.939 -2.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.52 ' N6 ' ' CE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 98.956 -2.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.534 " H3'" ' HH ' ' A' ' 146' ' ' TYR . . . . . . . . 0 P--O3' 1.594 -1.047 0 O4'-C1'-C2' 104.142 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.455 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C1'-O4'-C4' 107.476 -1.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.49 ' H72' HG22 ' A' ' 141' ' ' ILE . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 98.964 -2.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.572 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 100.274 -1.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.597 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 99.412 -2.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.597 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 99.162 -2.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.592 ' H42' ' NH2' ' A' ' 124' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 99.263 -2.455 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.501 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 O4'-C1'-C2' 103.987 -1.921 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.616 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.785 0 O4'-C1'-C2' 104.852 -1.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.616 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 100.879 -1.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.462 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 100.132 -1.834 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.684 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.75 0 O4'-C1'-C2' 104.752 -1.225 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.684 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.013 -1.92 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 OP1-P-O3' 109.573 0.679 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.548 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 100.364 -1.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.548 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 99.54 -2.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.408 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 99.981 -1.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.555 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.665 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.555 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 99.526 -2.267 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.542 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.668 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.509 ' N6 ' HH21 ' A' ' 124' ' ' ARG . . . . . . . . 0 C2'--C1' 1.511 -0.698 0 C3'-C2'-C1' 98.036 -3.331 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.4 ' O6 ' ' NH2' ' A' ' 124' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.622 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.256 0 O4'-C1'-C2' 103.998 -1.911 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 100.503 -1.569 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.566 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 98.293 -3.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.533 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.698 0 C3'-C2'-C1' 99.88 -2.014 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.556 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 O4'-C1'-C2' 104.457 -1.494 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.596 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 100.003 -1.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.596 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C3'-C2'-C1' 99.591 -2.221 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.483 ' C7 ' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.515 -2.275 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.623 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 100.304 -1.711 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.623 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.96 -1.037 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.533 ' C5 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.421 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.497 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 OP1-P-O3' 109.444 0.639 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 m . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.461 0.648 . . . . 10.0 110.501 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -94.96 -95.56 0.17 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.355 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.568 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.597 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.597 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.45 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.521 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.575 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.499 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.46 ' CA ' HE21 ' A' ' 135' ' ' GLN . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 124' ' ' ARG . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.629 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.499 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.5 HG23 ' H61' ' C' ' 30' ' ' ' DA' . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.629 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.458 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.604 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.47 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.604 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.479 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.529 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.478 ' C ' ' H ' ' A' ' 164' ' ' LYS . 1.5 mtpt -92.65 -8.53 43.82 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.3 mt -53.81 8.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.34 1.607 . . . . 10.0 115.34 -176.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.478 ' H ' ' C ' ' A' ' 162' ' ' LYS . 10.6 ptmt -65.89 -17.18 64.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 118.226 0.467 . . . . 10.0 110.669 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 29.1 m -65.57 -18.66 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.945 0.72 . . . . 10.0 112.945 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 111.133 -179.552 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.523 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.575 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 100.065 -1.882 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.674 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 100.102 -1.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.674 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 99.565 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.563 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 99.039 -2.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.453 H2'' ' C8 ' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.33 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.462 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.952 0 O4'-C1'-C2' 104.324 -1.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.531 ' C8 ' ' H73' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C1'-O4'-C4' 107.781 -1.371 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.531 ' H73' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 98.906 -2.71 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.606 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.89 0 C3'-C2'-C1' 100.418 -1.63 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.606 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C3'-C2'-C1' 99.65 -2.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.58 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.455 0.797 0 C3'-C2'-C1' 99.166 -2.524 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.645 ' C6 ' ' H71' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.645 ' H71' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.697 0 N19-C1'-C2' 116.459 1.412 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.583 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 101.152 -1.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.618 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 99.938 -1.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.62 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.62 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C3'-C2'-C1' 100.558 -1.53 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.527 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 C3'-C2'-C1' 100.841 -1.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.527 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 C3'-C2'-C1' 101.757 -0.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.475 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 100.334 -1.69 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.508 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 100.483 -1.584 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.508 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 100.485 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.561 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.117 -1.131 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.561 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.603 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C3'-C2'-C1' 99.283 -2.441 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.603 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 98.342 -3.113 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.429 H2'' ' C6 ' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 100.551 -1.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.515 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.873 -2.019 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.878 0 O4'-C1'-C2' 104.724 -1.251 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.598 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 99.749 -2.108 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.47 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 98.669 -2.879 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.433 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.929 0 O4'-C1'-C2' 104.442 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.593 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 100.436 -1.617 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.593 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.239 -2.472 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.581 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.008 0 O4'-C1'-C2' 104.346 -1.595 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.703 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.74 0 C3'-C2'-C1' 100.753 -1.391 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.703 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 C5'-C4'-C3' 116.336 1.09 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.61 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 100.051 -1.892 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.483 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-O3' 108.981 -0.599 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.3 m . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.356 0.598 . . . . 10.0 111.37 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -84.0 -99.32 0.05 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.982 179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 117' ' ' CYS . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.435 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.501 ' HB2' ' CB ' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.553 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.563 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.508 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . 0.418 ' ND2' ' HB3' ' A' ' 125' ' ' TRP . 0.7 OUTLIER -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.485 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.613 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.508 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.502 HG21 HD13 ' A' ' 141' ' ' ILE . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.613 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 5.4 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.455 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.515 ' HB3' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.622 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.554 ' HG3' " H3'" ' B' ' 12' ' ' ' DA' . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.622 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.464 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm -81.04 -10.16 59.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.4 tp -83.89 9.38 12.3 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -175.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.21 -33.16 69.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.416 0.627 . . . . 10.0 109.843 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 60.7 t -140.35 89.32 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.968 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 166' ' ' GLN . 10.7 mm-40 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.506 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 100.084 -1.868 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.639 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 100.542 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.639 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.452 0.587 0 C3'-C2'-C1' 99.898 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.532 H2'' ' C8 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.579 0 C3'-C2'-C1' 99.837 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.511 -0.714 0 C3'-C2'-C1' 99.21 -2.493 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.518 ' C5 ' ' C2 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.178 0 C3'-C2'-C1' 99.941 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 C3'-C2'-C1' 99.985 -1.939 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.509 " C2'" ' H73' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 O4'-C1'-N19 109.032 1.54 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.509 ' H73' " C2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 98.98 -2.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.631 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.639 0 C3'-C2'-C1' 100.728 -1.409 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.631 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.623 0 C3'-C2'-C1' 99.928 -1.98 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.579 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.742 0 C3'-C2'-C1' 98.757 -2.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.579 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 C3'-C2'-C1' 100.543 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.5 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 100.053 -1.891 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.565 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.746 0 C3'-C2'-C1' 100.603 -1.498 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.624 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.088 -1.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.624 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 100.262 -1.741 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.646 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-C2' 104.796 -1.186 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.646 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.314 -2.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C5'-C4'-C3' 115.728 0.685 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.501 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.168 -1.809 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.617 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.452 -2.32 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.641 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.599 -1.501 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.641 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 100.109 -1.851 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.611 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 100.187 -1.795 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.539 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.164 -1.811 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.539 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 98.631 -2.906 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.598 -0.756 0 C3'-C2'-C1' 99.858 -2.03 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.43 ' H73' ' HB2' ' A' ' 126' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 99.441 -2.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.577 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 O4'-C1'-C2' 104.828 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.577 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 98.377 -3.088 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.554 " H3'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.503 -1.29 0 C3'-C2'-C1' 100.278 -1.73 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.515 ' N4 ' ' HB3' ' A' ' 154' ' ' ALA . . . . . . . . 0 C2'--C1' 1.508 -0.933 0 O4'-C1'-C2' 104.391 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.619 " C2'" ' H72' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.56 0 C3'-C2'-C1' 100.275 -1.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.619 ' H72' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C3'-C2'-C1' 98.718 -2.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.595 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.121 0 C1'-O4'-C4' 106.851 -2.035 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.595 ' C6 ' H2'' ' B' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.463 -2.312 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.707 0 O4'-C1'-C2' 104.788 -1.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.631 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 100.582 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.631 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 OP1-P-O3' 109.963 0.801 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 120.651 0.262 . . . . 10.0 110.52 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 -82.77 -97.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.52 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.664 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.664 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.461 HH21 ' N6 ' ' B' ' 7' ' ' ' DA' . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.629 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.593 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . 0.448 HD22 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.43 ' H ' ' HG3' ' A' ' 129' ' ' ARG . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.402 ' HG3' ' OE1' ' A' ' 132' ' ' GLU . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.402 ' OE1' ' HG3' ' A' ' 131' ' ' LYS . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.593 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.558 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.434 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.528 HG23 ' H61' ' C' ' 30' ' ' ' DA' . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.455 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.451 ' HE2' ' OP2' ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.511 ' HB3' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.573 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.499 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 22.8 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.452 HH12 ' C7 ' ' B' ' 16' ' ' ' DT' . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.544 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp -65.84 -13.49 59.65 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 mt -93.3 -11.94 31.26 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.814 -0.354 . . . . 10.0 111.316 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -90.66 -84.47 0.24 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.911 -0.316 . . . . 10.0 110.352 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 9.5 p -173.51 147.4 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 120.471 -0.492 . . . . 10.0 111.556 -178.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.585 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.661 0 C3'-C2'-C1' 100.036 -1.903 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.588 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.622 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.701 0 C3'-C2'-C1' 100.389 -1.651 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 99.824 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.507 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.509 -0.935 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.492 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C3'-C2'-C1' 99.145 -2.539 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.479 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.713 0 O4'-C1'-C2' 103.761 -2.127 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.595 " C2'" ' H73' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.537 0.89 0 O4'-C1'-N19 108.746 1.183 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.595 ' H73' " C2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.151 -2.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.607 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C3'-C2'-C1' 100.868 -1.309 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.607 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.903 0 C3'-C2'-C1' 100.316 -1.703 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.782 0 C3'-C2'-C1' 98.587 -2.938 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.505 ' C6 ' ' H71' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 99.838 -2.044 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.567 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 O4'-C1'-C2' 104.102 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.611 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.826 0 O4'-C1'-C2' 104.762 -1.217 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.611 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.08 0 N19-C1'-C2' 116.64 1.525 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.597 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.984 0 C3'-C2'-C1' 100.282 -1.727 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.61 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.907 0 C3'-C2'-C1' 100.028 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.61 ' C5 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 100.646 -1.467 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.487 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 103.981 0.781 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.576 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.576 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 100.754 -1.39 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.618 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 100.94 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.618 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.536 0.757 0 C3'-C2'-C1' 99.359 -2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.559 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.452 0.537 0 C3'-C2'-C1' 100.352 -1.677 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.111 0 C3'-C2'-C1' 98.2 -3.214 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.403 " H2'" ' HA ' ' A' ' 126' ' ' ARG . . . . . . . . 0 P--O3' 1.595 -1.02 0 C3'-C2'-C1' 100.003 -1.927 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.58 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.166 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.58 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-C2' 104.593 -1.37 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.914 0 C3'-C2'-C1' 99.04 -2.614 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.499 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.024 0 C3'-C2'-C1' 98.784 -2.797 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.523 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.501 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.558 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 99.767 -2.095 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.558 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.538 1.039 0 C3'-C2'-C1' 99.338 -2.402 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.521 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.001 0 O4'-C1'-C2' 103.91 -1.991 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.542 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 100.277 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.542 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 100.641 -1.471 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.53 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 P--O3' 1.594 -1.083 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.525 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 110.772 0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.083 0.468 . . . . 10.0 110.863 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 -77.08 -99.58 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.307 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.426 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.601 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 118' ' ' SER . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.601 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.553 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.483 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.563 ' CZ3' ' HB2' ' A' ' 135' ' ' GLN . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.516 HH21 HD13 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . 0.431 ' ND2' ' HB3' ' A' ' 125' ' ' TRP . 0.8 OUTLIER -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.489 ' HZ2' ' CD ' ' A' ' 132' ' ' GLU . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.489 ' CD ' ' HZ2' ' A' ' 131' ' ' LYS . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.516 HD13 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.563 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.433 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.508 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.628 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.547 HG23 ' C4 ' ' C' ' 29' ' ' ' DT' . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.628 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.489 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.571 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 0.571 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.509 ' HB3' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . 0.409 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.52 ' HZ1' " H3'" ' B' ' 12' ' ' ' DA' . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.515 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.46 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.533 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.479 ' C ' ' H ' ' A' ' 164' ' ' LYS . 22.3 tttm -92.73 -6.04 49.97 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.5 mt -54.09 16.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.869 1.803 . . . . 10.0 115.869 -175.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.479 ' H ' ' C ' ' A' ' 162' ' ' LYS . 59.2 mttm -62.16 -37.09 83.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.794 0.724 . . . . 10.0 109.534 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 3.9 p -153.22 116.61 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.496 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.595 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.638 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 100.592 -1.506 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.694 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.212 -1.777 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.694 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 98.917 -2.702 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.549 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.598 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 C3'-C2'-C1' 99.157 -2.531 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.515 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.342 -2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.406 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.785 -2.104 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.573 " H2'" ' H73' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 O4'-C1'-N19 109.091 1.614 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.573 ' H73' " H2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.815 0 C3'-C2'-C1' 98.895 -2.718 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.562 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.42 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.562 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 C3'-C2'-C1' 99.652 -2.177 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.517 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.566 0 C3'-C2'-C1' 99.284 -2.44 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.517 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.496 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 99.568 -2.237 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.496 ' C7 ' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 99.715 -2.132 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.614 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 100.622 -1.484 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.614 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 O4'-C1'-C2' 104.237 -1.693 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.492 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 N19-C1'-C2' 116.946 1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.586 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.769 0 C3'-C2'-C1' 101.292 -1.006 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.586 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 OP1-P-O3' 109.063 0.52 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.444 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 100.222 -1.77 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.607 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 P--O3' 1.615 0.657 0 C3'-C2'-C1' 100.958 -1.244 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.607 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 100.912 -1.277 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.571 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 100.667 -1.452 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.571 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 100.443 -1.612 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.625 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C3'-C2'-C1' 100.697 -1.431 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.625 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.828 0 C3'-C2'-C1' 99.097 -2.574 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.464 " C2'" ' H73' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.736 0 C3'-C2'-C1' 99.998 -1.93 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.464 ' H73' " C2'" ' B' ' 8' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C3'-C2'-C1' 99.084 -2.583 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.491 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 101.298 -1.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.491 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.953 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.52 " H3'" ' HZ1' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.841 -2.042 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.509 ' N4 ' ' HB3' ' A' ' 154' ' ' ALA . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 O4'-C1'-C2' 104.276 -1.658 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.5 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.871 -2.021 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.533 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 100.134 -1.833 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.464 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.537 0.912 0 C3'-C2'-C1' 99.908 -1.994 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.534 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.807 0 C3'-C2'-C1' 99.638 -2.187 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.582 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 O4'-C1'-C2' 105.029 -0.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.643 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.268 -1.023 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.643 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 OP1-P-O3' 109.625 0.695 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.625 0.25 . . . . 10.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -121.9 -102.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.198 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.539 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.64 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.64 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.497 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.67 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.413 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.541 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.413 HD12 ' N6 ' ' B' ' 10' ' ' ' DA' . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.518 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.634 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.532 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.495 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.447 HH22 ' H71' ' B' ' 16' ' ' ' DT' . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.456 ' C ' ' H ' ' A' ' 164' ' ' LYS . 1.7 ttpp -77.41 -9.86 59.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 40.5 mt -68.39 16.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.173 0.805 . . . . 10.0 113.173 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.456 ' H ' ' C ' ' A' ' 162' ' ' LYS . 12.8 ttpt -62.07 -33.59 74.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.9 0.381 . . . . 10.0 110.026 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 2.7 p -147.69 121.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.114 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.774 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.477 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.556 0 C3'-C2'-C1' 100.094 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.507 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.655 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 C3'-C2'-C1' 99.517 -2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.655 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.511 -0.716 0 C3'-C2'-C1' 100.276 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.653 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.488 -2.294 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 100.028 -1.909 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.441 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.029 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.445 H2'' ' H71' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 O4'-C1'-N19 109.134 1.667 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.493 ' C2 ' ' C5 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.439 -2.329 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.493 ' C5 ' ' C2 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.664 0 C3'-C2'-C1' 99.708 -2.137 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.598 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.691 0 O4'-C1'-C2' 104.249 -1.683 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.511 -0.731 0 C3'-C2'-C1' 99.537 -2.26 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.525 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 C3'-C2'-C1' 100.157 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.587 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 100.113 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.587 ' C6 ' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.082 0 C3'-C2'-C1' 100.442 -1.613 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.553 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 100.43 -1.621 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.577 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 100.923 -1.269 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.577 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 105.027 -0.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.506 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 C3'-C2'-C1' 100.491 -1.578 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.506 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C1'-O4'-C4' 110.556 0.611 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.526 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 100.471 -1.592 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.526 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.729 0 C3'-C2'-C1' 99.856 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.483 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C5'-C4'-C3' 116.451 1.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.555 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.791 0 C3'-C2'-C1' 99.771 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.564 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.564 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C3'-C2'-C1' 99.456 -2.317 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.673 -2.877 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.413 " C2'" ' H73' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.43 -2.336 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.475 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 C3'-C2'-C1' 99.761 -2.099 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.61 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 100.308 -1.709 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.61 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.547 -2.966 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.669 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C3'-C2'-C1' 100.365 -1.668 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.669 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.579 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 100.593 -1.505 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.579 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.104 0 C3'-C2'-C1' 100.107 -1.852 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.447 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 C3'-C2'-C1' 98.702 -2.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.634 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 C3'-C2'-C1' 100.716 -1.417 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.634 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 101.364 -0.954 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.58 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 99.976 -1.946 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.529 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C4'-C3'-C2' 103.8 0.6 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.208 0.528 . . . . 10.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -91.84 -94.78 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.366 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.463 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.602 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.602 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.466 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.547 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . 0.413 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 2.5 m-80 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.413 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.442 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.447 HD11 ' N6 ' ' B' ' 10' ' ' ' DA' . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.416 ' HD3' ' H71' ' B' ' 11' ' ' ' DT' . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.487 ' NZ ' " H2'" ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.475 ' HB3' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.518 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.653 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.474 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt -88.35 -39.32 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 18.9 mt -42.19 -39.62 2.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 114.678 -1.146 . . . . 10.0 112.698 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -71.66 -86.0 0.03 OUTLIER 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.518 -0.473 . . . . 10.0 110.922 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 79.2 t -149.82 114.25 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.372 0.129 . . . . 10.0 110.934 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 C--N 1.327 -0.399 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 177.844 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 100.226 -1.767 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.67 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 99.797 -2.073 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.67 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 100.413 -1.634 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.647 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.067 -1.881 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.531 -2.263 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.505 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 O4'--C4' 1.455 0.809 0 C3'-C2'-C1' 98.369 -3.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.534 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 O4'-C1'-C2' 104.755 -1.222 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.534 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.86 0 O4'-C1'-C2' 104.303 -1.633 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.48 ' H73' " C2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 99.525 -2.268 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.551 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.626 0 C3'-C2'-C1' 100.194 -1.79 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.551 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.912 0 C3'-C2'-C1' 99.293 -2.434 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.449 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.944 0 C3'-C2'-C1' 98.896 -2.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.466 ' H42' HH21 ' A' ' 124' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.726 -2.124 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.461 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 C3'-C2'-C1' 99.866 -2.024 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.547 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.831 0 C3'-C2'-C1' 100.326 -1.696 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.555 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.751 0 N19-C1'-C2' 115.771 0.982 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.555 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.559 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.847 -1.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.559 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 100.861 -1.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.548 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C5'-C4'-C3' 116.049 0.9 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.692 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 100.141 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.692 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 100.138 -1.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.612 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 C3'-C2'-C1' 99.904 -1.997 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.672 -2.163 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.567 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.58 0 C3'-C2'-C1' 99.63 -2.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.538 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C3'-C2'-C1' 99.326 -2.41 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.463 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 98.505 -2.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.573 -2.233 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.47 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.816 0 C3'-C2'-C1' 99.479 -2.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.47 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.803 0 C3'-C2'-C1' 100.714 -1.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.492 H2'' ' C8 ' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.133 0 C3'-C2'-C1' 99.689 -2.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.518 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 100.063 -1.884 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.544 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.906 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.544 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.8 0 C3'-C2'-C1' 99.204 -2.497 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.474 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.506 -1.075 0 C3'-C2'-C1' 99.435 -2.332 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.454 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.783 -2.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.574 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.834 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.574 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 101.407 -0.923 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.602 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 101.381 -0.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.602 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C5'-C4'-O4' 108.229 -0.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 120.526 0.203 . . . . 10.0 111.16 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -167.73 151.17 6.11 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.587 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.429 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.538 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.402 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.496 ' CZ ' " H2'" ' B' ' 9' ' ' ' DT' . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . 0.405 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.1 m-80 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.405 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.587 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.423 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.559 HD12 ' N6 ' ' C' ' 30' ' ' ' DA' . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.607 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.5 ' HB3' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.482 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.56 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.482 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.408 ' O ' HD23 ' A' ' 163' ' ' LEU . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.469 ' HG3' ' C7 ' ' B' ' 15' ' ' ' DT' . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.539 ' HZ1' " H3'" ' C' ' 24' ' ' ' DA' . 29.1 tttp -66.89 -8.21 27.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 160' ' ' LYS . 0.5 OUTLIER -55.61 -8.28 0.36 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.369 0.507 . . . . 10.0 112.369 -177.566 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -59.96 -28.13 67.4 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 4.8 p -49.64 161.48 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 123.893 0.746 . . . . 10.0 112.087 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.953 -178.694 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.448 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.027 -1.909 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.657 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C3'-C2'-C1' 100.493 -1.576 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.657 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 99.495 -2.289 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.645 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.756 -2.103 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.513 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 99.173 -2.519 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.469 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.506 -1.101 0 C3'-C2'-C1' 98.311 -3.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.439 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.955 0 O4'-C1'-C2' 104.211 -1.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.475 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.735 0 O4'-C1'-N19 108.81 1.262 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.475 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 99.306 -2.424 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.559 ' N6 ' HD12 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 C3'-C2'-C1' 99.854 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.54 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.704 0 C3'-C2'-C1' 100.023 -1.912 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.54 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 99.47 -2.307 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.538 ' H42' HH21 ' A' ' 124' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 C3'-C2'-C1' 99.474 -2.304 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.557 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.63 0 O4'-C1'-C2' 104.109 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.63 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.385 -1.654 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.63 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.945 0 C3'-C2'-C1' 100.446 -1.61 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.512 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C3'-C2'-C1' 99.599 -2.215 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.505 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 100.298 -1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.423 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.403 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C3'-C2'-C1' 101.775 -0.66 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.505 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 C3'-C2'-C1' 100.654 -1.461 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.505 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.494 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.616 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.69 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 100.093 -1.862 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.581 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.618 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.618 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C3'-C2'-C1' 99.05 -2.607 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.417 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C3'-C2'-C1' 98.736 -2.831 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.596 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 O4'-C1'-C2' 103.948 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.848 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.607 ' C7 ' ' HD3' ' A' ' 144' ' ' ARG . . . . . . . . 0 O4'--C4' 1.457 0.961 0 C3'-C2'-C1' 98.057 -3.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.626 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.563 -1.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.626 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.957 0 C3'-C2'-C1' 100.739 -1.401 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.429 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.837 0 C3'-C2'-C1' 100.215 -1.775 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.469 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.437 ' C7 ' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 99.92 -1.986 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.523 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.928 0 C3'-C2'-C1' 100.058 -1.887 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.621 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 C4'-C3'-C2' 103.875 0.675 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.621 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.502 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-O4' 108.254 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.42 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 -89.33 -98.06 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.897 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.52 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.581 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.581 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.509 ' HB2' ' C7 ' ' C' ' 31' ' ' ' DT' . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.616 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.506 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' CYS . . . . . 0.415 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.561 HG23 ' C4 ' ' C' ' 29' ' ' ' DT' . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 0.476 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.413 ' HD2' ' HD2' ' A' ' 151' ' ' PRO . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.469 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.477 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.477 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.413 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.425 ' HB3' ' H41' ' B' ' 13' ' ' ' DC' . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . 0.417 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.546 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' TYR . . . . . 0.55 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' GLN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.543 HH12 ' H71' ' B' ' 16' ' ' ' DT' . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.497 ' C ' ' H ' ' A' ' 164' ' ' LYS . 13.0 mtpt -93.45 -2.76 54.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.636 ' C ' ' H ' ' A' ' 165' ' ' VAL . 15.2 mt -43.41 22.46 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 117.585 2.439 . . . . 10.0 117.585 -177.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 162' ' ' LYS . 15.4 mtmt -66.7 23.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.892 0.877 . . . . 10.0 110.866 177.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . 0.636 ' H ' ' C ' ' A' ' 163' ' ' LEU . 29.3 m -74.14 -165.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.284 -178.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.361 -179.941 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.489 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.434 -0.389 0 C3'-C2'-C1' 99.994 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.638 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.798 0 O4'-C1'-N19 108.894 1.368 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . 0.638 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.013 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.658 0 C3'-C2'-C1' 99.681 -2.156 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' ' DA' . . . . . 0.505 ' C2 ' ' C5 ' ' C' ' 26' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 C3'-C2'-C1' 99.126 -2.553 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' ' DA' . . . . . 0.55 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.034 -2.619 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' ' DA' . . . . . 0.433 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.963 0 O4'-C1'-C2' 103.599 -2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' ' DG' . . . . . 0.548 " C2'" ' H73' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 O4'-C1'-C2' 104.477 -1.475 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' ' DT' . . . . . 0.561 ' C4 ' HG23 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.495 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' ' DA' . . . . . 0.665 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.934 0 C3'-C2'-C1' 100.331 -1.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' ' DT' . . . . . 0.665 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 99.218 -2.487 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' ' DA' . . . . . 0.642 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.772 0 C3'-C2'-C1' 99.122 -2.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' ' DC' . . . . . 0.642 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.059 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' ' DT' . . . . . 0.492 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 O4'-C1'-C2' 104.473 -1.479 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' ' DT' . . . . . 0.513 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.806 -1.353 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' ' DT' . . . . . 0.654 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 C3'-C2'-C1' 100.769 -1.379 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' ' DT' . . . . . 0.654 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 100.261 -1.742 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' ' DC' . . . . . 0.519 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.373 -1.662 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.173 -1.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' ' DG' . . . . . 0.442 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C4'-C3'-O3' 108.079 -1.009 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . 0.572 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 100.478 -1.587 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.572 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.59 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.589 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.56 0 C3'-C2'-C1' 101.088 -1.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . 0.593 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.649 -1.465 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.593 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 C3'-C2'-C1' 99.598 -2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.574 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 99.669 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ' DA' . . . . . 0.45 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 C3'-C2'-C1' 98.642 -2.898 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.464 " C2'" ' H72' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.874 0 C3'-C2'-C1' 99.502 -2.285 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . 0.507 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 99.821 -2.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.602 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C5'-C4'-C3' 115.907 0.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ' DT' . . . . . 0.602 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.657 -2.174 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ' DA' . . . . . 0.546 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 100.394 -1.647 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.492 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.943 -1.96 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . 0.556 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.99 0 C3'-C2'-C1' 99.688 -2.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ' DT' . . . . . 0.556 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 100.208 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . 0.543 ' H71' HH12 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.505 -1.118 0 C3'-C2'-C1' 100.235 -1.761 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.6 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.959 0 C3'-C2'-C1' 100.119 -1.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.6 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 100.758 -1.387 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ' DC' . . . . . 0.549 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.769 0 C3'-C2'-C1' 100.254 -1.747 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.522 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C5'-C4'-O4' 108.483 -0.573 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.502 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.713 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.713 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.514 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.602 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.522 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.515 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.449 ' HG2' ' HG2' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.44 HD21 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.44 ' HD3' HD21 ' A' ' 156' ' ' ASN . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 161' ' ' ARG . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 110.297 -0.26 . . . . 10.0 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.516 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.716 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.408 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.716 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.858 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.599 ' HE3' HD22 ' A' ' 127' ' ' ASN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.599 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.8 m120 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 126' ' ' ARG . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.858 HE22 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.58 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 146' ' ' TYR . . . . . 0.473 ' HB2' ' HA ' ' A' ' 143' ' ' GLN . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 161' ' ' ARG . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp . . . . . 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.355 -0.239 . . . . 10.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.583 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.639 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.639 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.609 HG21 ' HA ' ' A' ' 136' ' ' CYS . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.581 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.4 HG23 ' O ' ' A' ' 128' ' ' ILE . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.405 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.613 ' H ' ' HA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.609 ' HA ' HG21 ' A' ' 122' ' ' THR . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' HG12 ' A' ' 141' ' ' ILE . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.639 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 144' ' ' ARG . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.639 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 141' ' ' ILE . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.61 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 CA--C 1.539 0.521 0 CA-C-O 120.0 -0.047 . . . . 10.0 110.982 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.415 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.562 ' HA ' ' H ' ' A' ' 135' ' ' GLN . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.444 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.415 ' HA ' ' HG3' ' A' ' 113' ' ' GLN . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.73 ' HE3' HD22 ' A' ' 127' ' ' ASN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.73 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.1 m120 -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 128' ' ' ILE . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.517 ' CA ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.501 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.63 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 26.5 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 144' ' ' ARG . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.404 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.533 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.727 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.727 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.494 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.642 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.469 HD21 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.561 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.643 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.459 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 137' ' ' ASN . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.643 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 141' ' ' ILE . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.463 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.463 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 157' ' ' LYS . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 72.4 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 . . . . . 0 CA--C 1.536 0.428 0 CA-C-O 119.568 -0.253 . . . . 10.0 111.307 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.436 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.656 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.656 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.563 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.409 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.744 ' HE3' HD22 ' A' ' 127' ' ' ASN . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.693 HH21 HD12 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.744 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.3 m120 -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.693 HD12 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.484 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.532 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 137' ' ' ASN . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.624 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.587 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.409 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.414 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 157' ' ' LYS . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 22.3 tttm . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.342 0.115 . . . . 10.0 111.198 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.548 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.696 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.696 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.414 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.685 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.405 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.41 ' H ' ' HB2' ' A' ' 130' ' ' SER . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.555 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.521 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.405 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.521 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.402 ' O ' ' HB ' ' A' ' 155' ' ' VAL . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.638 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.638 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.445 ' OE1' ' HE3' ' A' ' 162' ' ' LYS . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 159' ' ' GLN . 1.7 ttpp . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.366 -0.235 . . . . 10.0 110.366 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.671 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.458 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.671 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.564 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.426 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 2.5 m-80 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.409 ' O ' HG23 ' A' ' 128' ' ' ILE . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.426 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.478 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.599 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.599 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.663 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.663 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 161' ' ' ARG . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 118' ' ' SER . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.61 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.437 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 113' ' ' GLN . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.461 ' HD3' ' HA ' ' A' ' 124' ' ' ARG . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 126' ' ' ARG . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASN . . . . . 0.421 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.3 m120 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.421 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.61 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.465 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.506 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 161' ' ' ARG . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 29.1 tttp . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 119.806 -0.14 . . . . 10.0 110.897 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.534 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.644 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.644 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.472 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.639 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 134' ' ' ILE . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.454 HG23 ' SG ' ' A' ' 114' ' ' CYS . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 136' ' ' CYS . . . . . 0.445 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.432 ' HD2' ' HD2' ' A' ' 151' ' ' PRO . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASN . . . . . 0.481 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.481 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.432 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.475 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' TYR . . . . . 0.475 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ARG . . . . . 0.46 ' HE ' ' HB3' ' A' ' 161' ' ' ARG . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 159' ' ' GLN . 13.0 mtpt . . . . . 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.43 -106.3 0.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.502 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.713 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.713 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.514 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ILE . . . . . 0.455 HG12 ' C7 ' ' C' ' 31' ' ' ' DT' . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.423 ' HG2' ' H71' ' C' ' 31' ' ' ' DT' . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.602 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.522 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.515 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.6 HD13 ' N6 ' ' C' ' 30' ' ' ' DA' . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.599 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.449 ' HG2' ' HG2' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.44 HD21 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.625 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.719 HH22 ' H71' ' B' ' 16' ' ' ' DT' . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -66.2 -11.54 50.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 70.9 mt -93.82 -13.21 27.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.715 -0.394 . . . . 10.0 110.703 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 161' ' ' ARG . 47.9 mtmt -84.73 -52.62 5.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.845 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.99 144.34 34.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.453 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.51 179.825 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.669 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 100.908 -1.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.669 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 100.792 -1.363 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.638 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.935 -1.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 99.806 -2.067 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.625 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.242 -2.47 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.449 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.506 -1.098 0 C3'-C2'-C1' 99.309 -2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.505 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.794 0 O4'-C1'-C2' 103.989 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.511 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 O4'-C1'-N19 109.01 1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.511 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 98.931 -2.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.6 ' N6 ' HD13 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.636 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 99.411 -2.35 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.636 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.638 0 C3'-C2'-C1' 99.732 -2.12 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 C3'-C2'-C1' 99.509 -2.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.489 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.189 -1.737 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.664 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 O4'-C1'-C2' 104.546 -1.413 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.664 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.68 -1.443 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.595 H2'' ' C5 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.722 0 C3'-C2'-C1' 99.772 -2.091 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.595 ' C5 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.604 0 C3'-C2'-C1' 101.586 -0.796 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.631 H2'' ' N7 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.857 -1.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.631 ' N7 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C5'-C4'-O4' 108.227 -0.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.548 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.549 -1.536 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.549 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 99.594 -2.218 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.574 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C3'-C2'-C1' 100.397 -1.645 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.574 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C3'-C2'-C1' 100.797 -1.359 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.59 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.284 -1.726 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.59 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 99.695 -2.146 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 98.79 -2.793 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.484 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.618 0 C3'-C2'-C1' 98.606 -2.924 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.508 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.417 0 O4'-C1'-N19 109.807 2.509 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.613 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 100.998 -1.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.613 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.865 0 C3'-C2'-C1' 97.755 -3.532 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.713 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 OP1-P-O3' 110.263 0.895 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.713 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 N19-C1'-C2' 116.359 1.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.664 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 100.158 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.489 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.719 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 100.22 -1.771 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.656 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 100.339 -1.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.656 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 O4'-C1'-C2' 104.598 -1.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.543 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 100.227 -1.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.543 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 OP1-P-O3' 109.292 0.591 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.781 0.324 . . . . 10.0 110.625 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 -105.81 -96.76 0.34 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.297 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.516 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.716 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.408 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.716 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.858 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.613 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.599 ' HE3' HD22 ' A' ' 127' ' ' ASN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.599 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.8 m120 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.435 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.858 HE22 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.58 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.636 ' HB ' ' H72' ' C' ' 29' ' ' ' DT' . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.497 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' TYR . . . . . 0.473 ' HB2' ' HA ' ' A' ' 143' ' ' GLN . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.417 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.495 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.52 ' CE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.421 ' NZ ' " H3'" ' B' ' 13' ' ' ' DC' . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.809 HH22 ' H71' ' B' ' 16' ' ' ' DT' . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -73.79 -8.71 57.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 6.1 tp -69.15 7.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -60.25 -45.41 93.34 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.23 108.67 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.268 -1.333 . . . . 10.0 109.109 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.379 -178.553 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.615 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.658 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 100.401 -1.642 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.658 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.77 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 99.993 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.649 0 C3'-C2'-C1' 98.939 -2.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.52 ' N6 ' ' CE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 98.956 -2.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.477 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.047 0 O4'-C1'-C2' 104.142 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.477 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C1'-O4'-C4' 107.476 -1.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.636 ' H72' ' HB ' ' A' ' 141' ' ' ILE . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 98.964 -2.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.585 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 100.274 -1.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.634 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 99.412 -2.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 99.162 -2.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.613 ' H42' ' NH2' ' A' ' 124' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 99.263 -2.455 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.519 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 O4'-C1'-C2' 103.987 -1.921 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.628 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.785 0 O4'-C1'-C2' 104.852 -1.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.628 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 100.879 -1.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.477 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 100.132 -1.834 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.692 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.75 0 O4'-C1'-C2' 104.752 -1.225 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.692 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.013 -1.92 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 OP1-P-O3' 109.573 0.679 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.569 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 100.364 -1.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.569 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 99.54 -2.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.436 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 99.981 -1.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.576 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.665 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 99.526 -2.267 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.668 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.515 ' N6 ' HH21 ' A' ' 124' ' ' ARG . . . . . . . . 0 C2'--C1' 1.511 -0.698 0 C3'-C2'-C1' 98.036 -3.331 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.435 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.642 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.256 0 O4'-C1'-C2' 103.998 -1.911 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.642 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 100.503 -1.569 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.578 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 98.293 -3.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.557 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.698 0 C3'-C2'-C1' 99.88 -2.014 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.784 H2'' ' H71' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 O4'-C1'-C2' 104.457 -1.494 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.784 ' H71' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 100.003 -1.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.509 ' C7 ' H2'' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C3'-C2'-C1' 99.591 -2.221 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.809 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.515 -2.275 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.642 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 100.304 -1.711 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.642 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.96 -1.037 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.544 ' C5 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.421 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.521 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 OP1-P-O3' 109.444 0.639 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 m . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.461 0.648 . . . . 10.0 110.501 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -94.96 -95.56 0.17 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.355 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.583 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.639 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.639 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.609 HG21 ' HA ' ' A' ' 136' ' ' CYS . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ILE . . . . . 0.405 HG23 ' H73' ' C' ' 31' ' ' ' DT' . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.551 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.581 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.444 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.405 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.613 ' H ' ' HA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.609 ' HA ' HG21 ' A' ' 122' ' ' THR . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' HG12 ' A' ' 141' ' ' ILE . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.639 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.618 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.639 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.489 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.419 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.49 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.61 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.495 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.54 ' CZ ' ' H71' ' B' ' 15' ' ' ' DT' . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.435 ' C ' ' H ' ' A' ' 164' ' ' LYS . 1.5 mtpt -92.65 -8.53 43.82 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.3 mt -53.81 8.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.34 1.607 . . . . 10.0 115.34 -176.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.435 ' H ' ' C ' ' A' ' 162' ' ' LYS . 10.6 ptmt -65.89 -17.18 64.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 118.226 0.467 . . . . 10.0 110.669 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 29.1 m -65.57 -18.66 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.945 0.72 . . . . 10.0 112.945 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' GLN . . . . . 0.409 ' OE1' HD22 ' A' ' 163' ' ' LEU . 37.5 mt-30 . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 111.133 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.551 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 100.065 -1.882 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.707 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 100.102 -1.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.707 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 99.565 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 99.039 -2.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.465 H2'' ' C8 ' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.33 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.485 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.952 0 O4'-C1'-C2' 104.324 -1.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.542 " C2'" ' H71' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C1'-O4'-C4' 107.781 -1.371 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.542 ' H71' " C2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 98.906 -2.71 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.618 ' H62' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.426 -0.89 0 C3'-C2'-C1' 100.418 -1.63 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.615 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C3'-C2'-C1' 99.65 -2.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.634 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.455 0.797 0 C3'-C2'-C1' 99.166 -2.524 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.634 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.682 H2'' ' H71' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.697 0 N19-C1'-C2' 116.459 1.412 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.682 ' H71' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 101.152 -1.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.642 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 99.938 -1.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.642 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.639 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C3'-C2'-C1' 100.558 -1.53 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.546 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 C3'-C2'-C1' 100.841 -1.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 C3'-C2'-C1' 101.757 -0.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.511 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 100.334 -1.69 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.529 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 100.483 -1.584 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.529 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 100.485 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.578 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.117 -1.131 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.637 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C3'-C2'-C1' 99.283 -2.441 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.637 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 98.342 -3.113 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.444 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 100.551 -1.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.873 -2.019 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.878 0 O4'-C1'-C2' 104.724 -1.251 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.598 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 99.749 -2.108 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.49 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 98.669 -2.879 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.436 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.929 0 O4'-C1'-C2' 104.442 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.436 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 100.436 -1.617 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.54 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.239 -2.472 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.6 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.008 0 O4'-C1'-C2' 104.346 -1.595 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.726 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.74 0 C3'-C2'-C1' 100.753 -1.391 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.726 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 C5'-C4'-C3' 116.336 1.09 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.614 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 100.051 -1.892 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.504 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-O3' 108.981 -0.599 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.3 m . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.356 0.598 . . . . 10.0 111.37 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.429 ' H ' ' HH2' ' A' ' 125' ' ' TRP . 47.9 t80 -84.0 -99.32 0.05 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.982 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.415 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.562 ' HA ' ' H ' ' A' ' 135' ' ' GLN . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.444 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.415 ' HA ' ' HG3' ' A' ' 113' ' ' GLN . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.582 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.73 ' HE3' HD22 ' A' ' 127' ' ' ASN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.73 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.1 m120 -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 128' ' ' ILE . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.517 ' CA ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.501 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.64 HG21 ' N6 ' ' C' ' 30' ' ' ' DA' . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.63 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 26.5 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.519 ' HD3' ' H72' ' B' ' 11' ' ' ' DT' . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.404 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.5 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.521 ' HG3' " H3'" ' B' ' 12' ' ' ' DA' . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.73 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm -81.04 -10.16 59.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.4 tp -83.89 9.38 12.3 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -175.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.21 -33.16 69.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.416 0.627 . . . . 10.0 109.843 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 60.7 t -140.35 89.32 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.968 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' GLN . . . . . 0.427 ' NE2' ' HA ' ' A' ' 166' ' ' GLN . 10.7 mm-40 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.534 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 100.084 -1.868 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.669 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 100.542 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.669 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.452 0.587 0 C3'-C2'-C1' 99.898 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.575 H2'' ' C8 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.579 0 C3'-C2'-C1' 99.837 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.575 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.511 -0.714 0 C3'-C2'-C1' 99.21 -2.493 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.518 ' C5 ' ' C2 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.178 0 C3'-C2'-C1' 99.941 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.411 ' C8 ' H2'' ' C' ' 26' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 C3'-C2'-C1' 99.985 -1.939 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.41 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 O4'-C1'-N19 109.032 1.54 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.621 ' H71' HG22 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 98.98 -2.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.644 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.639 0 C3'-C2'-C1' 100.728 -1.409 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.644 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.623 0 C3'-C2'-C1' 99.928 -1.98 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.63 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.742 0 C3'-C2'-C1' 98.757 -2.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.63 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 C3'-C2'-C1' 100.543 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.521 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 100.053 -1.891 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.579 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.746 0 C3'-C2'-C1' 100.603 -1.498 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.639 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.088 -1.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.639 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 100.262 -1.741 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.658 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-C2' 104.796 -1.186 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.658 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.314 -2.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.416 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C5'-C4'-C3' 115.728 0.685 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.524 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.168 -1.809 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.662 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.452 -2.32 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.662 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.599 -1.501 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.658 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 100.109 -1.851 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 100.187 -1.795 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.565 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.164 -1.811 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 98.631 -2.906 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.413 " C2'" ' H72' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.756 0 C3'-C2'-C1' 99.858 -2.03 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.434 ' H73' ' HB2' ' A' ' 126' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 99.441 -2.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.578 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 O4'-C1'-C2' 104.828 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.578 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 98.377 -3.088 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.521 " H3'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.503 -1.29 0 C3'-C2'-C1' 100.278 -1.73 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.5 ' N4 ' ' HB1' ' A' ' 154' ' ' ALA . . . . . . . . 0 C2'--C1' 1.508 -0.933 0 O4'-C1'-C2' 104.391 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.739 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.56 0 C3'-C2'-C1' 100.275 -1.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.739 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C3'-C2'-C1' 98.718 -2.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.614 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.121 0 C1'-O4'-C4' 106.851 -2.035 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.614 ' C6 ' H2'' ' B' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.463 -2.312 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.583 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.707 0 O4'-C1'-C2' 104.788 -1.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.645 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 100.582 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.645 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 OP1-P-O3' 109.963 0.801 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 120.651 0.262 . . . . 10.0 110.52 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 -82.77 -97.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.533 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.727 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.727 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.494 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.498 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.642 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.469 HD21 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.561 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.643 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.459 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.732 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.643 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.479 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.467 ' HE2' ' OP2' ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.463 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.516 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.527 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 72.4 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.687 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp -65.84 -13.49 59.65 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 mt -93.3 -11.94 31.26 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.814 -0.354 . . . . 10.0 111.316 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -90.66 -84.47 0.24 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.911 -0.316 . . . . 10.0 110.352 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 9.5 p -173.51 147.4 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 120.471 -0.492 . . . . 10.0 111.556 -178.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.607 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.661 0 C3'-C2'-C1' 100.036 -1.903 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.607 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.645 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.701 0 C3'-C2'-C1' 100.389 -1.651 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.645 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 99.824 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.536 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.509 -0.935 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.509 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C3'-C2'-C1' 99.145 -2.539 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.504 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.713 0 O4'-C1'-C2' 103.761 -2.127 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.637 H2'' ' H71' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.537 0.89 0 O4'-C1'-N19 108.746 1.183 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.637 ' H71' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.151 -2.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.732 ' H62' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C3'-C2'-C1' 100.868 -1.309 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.614 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.903 0 C3'-C2'-C1' 100.316 -1.703 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.536 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.455 0.782 0 C3'-C2'-C1' 98.587 -2.938 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 99.838 -2.044 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.584 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 O4'-C1'-C2' 104.102 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.615 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.826 0 O4'-C1'-C2' 104.762 -1.217 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.615 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.08 0 N19-C1'-C2' 116.64 1.525 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.619 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.984 0 C3'-C2'-C1' 100.282 -1.727 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.638 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.907 0 C3'-C2'-C1' 100.028 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.638 ' C5 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 100.646 -1.467 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.501 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 103.981 0.781 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.608 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 100.754 -1.39 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.615 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.635 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 100.94 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.536 0.757 0 C3'-C2'-C1' 99.359 -2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.581 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.452 0.537 0 C3'-C2'-C1' 100.352 -1.677 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.581 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.111 0 C3'-C2'-C1' 98.2 -3.214 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -1.02 0 C3'-C2'-C1' 100.003 -1.927 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.604 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.166 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.604 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-C2' 104.593 -1.37 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.413 H2'' ' C8 ' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.914 0 C3'-C2'-C1' 99.04 -2.614 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.527 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.024 0 C3'-C2'-C1' 98.784 -2.797 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.536 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.501 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.687 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 99.767 -2.095 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.622 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.538 1.039 0 C3'-C2'-C1' 99.338 -2.402 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.541 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.001 0 O4'-C1'-C2' 103.91 -1.991 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.562 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 100.277 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.562 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 100.641 -1.471 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.55 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.083 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.55 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 110.772 0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.083 0.468 . . . . 10.0 110.863 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 -77.08 -99.58 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.307 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.436 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.656 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.656 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.563 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ILE . . . . . 0.494 HG23 ' C7 ' ' C' ' 31' ' ' ' DT' . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.501 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.744 ' HE3' HD22 ' A' ' 127' ' ' ASN . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.693 HH21 HD12 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.744 HD22 ' HE3' ' A' ' 125' ' ' TRP . 1.3 m120 -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.407 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.693 HD12 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.484 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.532 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.842 HG22 ' H71' ' C' ' 29' ' ' ' DT' . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.624 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.524 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.587 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.409 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.519 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.414 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.543 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.535 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.601 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 22.3 tttm -92.73 -6.04 49.97 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.5 mt -54.09 16.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.869 1.803 . . . . 10.0 115.869 -175.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' A' ' 162' ' ' LYS . 59.2 mttm -62.16 -37.09 83.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.794 0.724 . . . . 10.0 109.534 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 3.9 p -153.22 116.61 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.496 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.595 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.654 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 100.592 -1.506 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.724 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.212 -1.777 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.724 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 98.917 -2.702 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.598 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.542 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 C3'-C2'-C1' 99.157 -2.531 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.535 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.342 -2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.428 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.785 -2.104 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.518 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 O4'-C1'-N19 109.091 1.614 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.842 ' H71' HG22 ' A' ' 141' ' ' ILE . . . . . . . . 0 P--O3' 1.617 0.815 0 C3'-C2'-C1' 98.895 -2.718 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.619 ' N6 ' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.42 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.575 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 C3'-C2'-C1' 99.652 -2.177 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.554 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.566 0 C3'-C2'-C1' 99.284 -2.44 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.509 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 99.568 -2.237 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.569 H2'' ' H71' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 99.715 -2.132 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.63 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 100.622 -1.484 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.63 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 O4'-C1'-C2' 104.237 -1.693 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.511 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 N19-C1'-C2' 116.946 1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.594 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.769 0 C3'-C2'-C1' 101.292 -1.006 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.594 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 OP1-P-O3' 109.063 0.52 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.471 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 100.222 -1.77 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.618 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 P--O3' 1.615 0.657 0 C3'-C2'-C1' 100.958 -1.244 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.618 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 100.912 -1.277 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.59 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 100.667 -1.452 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.59 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 100.443 -1.612 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.644 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C3'-C2'-C1' 100.697 -1.431 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.644 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.828 0 C3'-C2'-C1' 99.097 -2.574 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.421 ' C6 ' ' C6 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.736 0 C3'-C2'-C1' 99.998 -1.93 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.438 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C3'-C2'-C1' 99.084 -2.583 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 101.298 -1.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.495 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.953 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.543 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.841 -2.042 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.519 ' N4 ' ' HB1' ' A' ' 154' ' ' ALA . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 O4'-C1'-C2' 104.276 -1.658 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.601 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.871 -2.021 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.574 ' H72' ' C6 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 100.134 -1.833 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.514 ' H71' HH12 ' A' ' 161' ' ' ARG . . . . . . . . 0 C4'--C3' 1.537 0.912 0 C3'-C2'-C1' 99.908 -1.994 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.807 0 C3'-C2'-C1' 99.638 -2.187 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.59 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 O4'-C1'-C2' 105.029 -0.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.656 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.268 -1.023 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.656 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 OP1-P-O3' 109.625 0.695 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.625 0.25 . . . . 10.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -121.9 -102.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.198 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.548 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.696 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.696 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.414 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ILE . . . . . 0.404 HD13 " H2'" ' C' ' 30' ' ' ' DA' . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.53 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.685 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.405 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.51 HD22 ' HE3' ' A' ' 125' ' ' TRP . 5.7 m120 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.41 ' H ' ' HB2' ' A' ' 130' ' ' SER . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.555 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.521 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.405 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.535 HD11 ' N6 ' ' B' ' 10' ' ' ' DA' . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.521 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.402 ' O ' ' HB ' ' A' ' 155' ' ' VAL . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.638 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.53 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.638 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.508 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 163' ' ' LEU . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.733 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 159' ' ' GLN . 1.7 ttpp -77.41 -9.86 59.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 40.5 mt -68.39 16.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.173 0.805 . . . . 10.0 113.173 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 162' ' ' LYS . 12.8 ttpt -62.07 -33.59 74.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.9 0.381 . . . . 10.0 110.026 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 2.7 p -147.69 121.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.114 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.774 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.502 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.556 0 C3'-C2'-C1' 100.094 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.53 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.692 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 C3'-C2'-C1' 99.517 -2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.692 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.511 -0.716 0 C3'-C2'-C1' 100.276 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.488 -2.294 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.462 ' C8 ' " H1'" ' C' ' 25' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 100.028 -1.909 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.464 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.029 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.464 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 O4'-C1'-N19 109.134 1.667 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.439 -2.329 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.519 ' C8 ' H2'' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.664 0 C3'-C2'-C1' 99.708 -2.137 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.624 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.691 0 O4'-C1'-C2' 104.249 -1.683 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.624 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.511 -0.731 0 C3'-C2'-C1' 99.537 -2.26 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.566 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 C3'-C2'-C1' 100.157 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.603 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 100.113 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.603 ' C6 ' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.082 0 C3'-C2'-C1' 100.442 -1.613 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.59 ' H71' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 100.43 -1.621 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.593 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 100.923 -1.269 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.593 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 105.027 -0.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.531 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 C3'-C2'-C1' 100.491 -1.578 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.531 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C1'-O4'-C4' 110.556 0.611 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.548 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 100.471 -1.592 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.548 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.729 0 C3'-C2'-C1' 99.856 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.489 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C5'-C4'-C3' 116.451 1.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.582 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.791 0 C3'-C2'-C1' 99.771 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.585 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.592 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C3'-C2'-C1' 99.456 -2.317 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.592 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.673 -2.877 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.43 -2.336 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.502 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 C3'-C2'-C1' 99.761 -2.099 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.628 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 100.308 -1.709 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.628 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.547 -2.966 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.695 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C3'-C2'-C1' 100.365 -1.668 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.695 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.733 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 100.593 -1.505 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.514 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.506 -1.104 0 C3'-C2'-C1' 100.107 -1.852 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.659 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 C3'-C2'-C1' 98.702 -2.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.649 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 C3'-C2'-C1' 100.716 -1.417 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.649 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 101.364 -0.954 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.587 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 99.976 -1.946 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.565 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C4'-C3'-C2' 103.8 0.6 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.208 0.528 . . . . 10.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -91.84 -94.78 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.366 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.671 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.458 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.671 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ILE . . . . . 0.522 HG23 ' C7 ' ' C' ' 31' ' ' ' DT' . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.485 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.626 ' HE3' HD22 ' A' ' 127' ' ' ASN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.413 ' HB2' ' H73' ' B' ' 9' ' ' ' DT' . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.626 HD22 ' HE3' ' A' ' 125' ' ' TRP . 2.6 m120 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.439 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.426 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.478 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.599 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.496 HG21 ' N6 ' ' C' ' 30' ' ' ' DA' . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.599 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.427 ' HD3' ' H71' ' B' ' 11' ' ' ' DT' . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.706 ' HZ2' " H2'" ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.53 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.663 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.531 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.663 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.677 ' HB2' ' H72' ' B' ' 14' ' ' ' DT' . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt -88.35 -39.32 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 18.9 mt -42.19 -39.62 2.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 114.678 -1.146 . . . . 10.0 112.698 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -71.66 -86.0 0.03 OUTLIER 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.518 -0.473 . . . . 10.0 110.922 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 79.2 t -149.82 114.25 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.372 0.129 . . . . 10.0 110.934 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 C--N 1.327 -0.399 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 177.844 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.537 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 100.226 -1.767 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.693 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 99.797 -2.073 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.693 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 100.413 -1.634 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.678 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.067 -1.881 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.531 -2.263 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.521 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 O4'--C4' 1.455 0.809 0 C3'-C2'-C1' 98.369 -3.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.706 " H2'" ' HZ2' ' A' ' 145' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 O4'-C1'-C2' 104.755 -1.222 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.86 0 O4'-C1'-C2' 104.303 -1.633 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.505 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 99.525 -2.268 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.571 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.626 0 C3'-C2'-C1' 100.194 -1.79 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.571 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.912 0 C3'-C2'-C1' 99.293 -2.434 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.493 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.944 0 C3'-C2'-C1' 98.896 -2.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.493 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.726 -2.124 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.467 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 C3'-C2'-C1' 99.866 -2.024 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.568 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.831 0 C3'-C2'-C1' 100.326 -1.696 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.568 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.751 0 N19-C1'-C2' 115.771 0.982 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.564 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.568 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.847 -1.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 100.861 -1.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.568 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C5'-C4'-C3' 116.049 0.9 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.718 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 100.141 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.718 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 100.138 -1.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.643 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 C3'-C2'-C1' 99.904 -1.997 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.643 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.672 -2.163 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.58 0 C3'-C2'-C1' 99.63 -2.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.566 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C3'-C2'-C1' 99.326 -2.41 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 98.505 -2.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.439 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.573 -2.233 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.508 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.816 0 C3'-C2'-C1' 99.479 -2.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.508 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.803 0 C3'-C2'-C1' 100.714 -1.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.516 H2'' ' C8 ' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.133 0 C3'-C2'-C1' 99.689 -2.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.531 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 100.063 -1.884 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.763 H2'' ' H71' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.906 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.763 ' H71' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.8 0 C3'-C2'-C1' 99.204 -2.497 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.565 ' H72' ' NH1' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.506 -1.075 0 C3'-C2'-C1' 99.435 -2.332 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.478 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.783 -2.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.592 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.834 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.592 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 101.407 -0.923 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.622 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 101.381 -0.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.622 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C5'-C4'-O4' 108.229 -0.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 120.526 0.203 . . . . 10.0 111.16 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -167.73 151.17 6.11 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 118' ' ' SER . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.61 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.437 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 113' ' ' GLN . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.556 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.515 ' CZ ' " H2'" ' B' ' 9' ' ' ' DT' . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.421 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.3 m120 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.421 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.61 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.465 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.506 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.629 HD13 ' N6 ' ' C' ' 30' ' ' ' DA' . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.632 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.512 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.565 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.407 ' O ' HD22 ' A' ' 163' ' ' LEU . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.642 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 29.1 tttp -66.89 -8.21 27.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 160' ' ' LYS . 0.5 OUTLIER -55.61 -8.28 0.36 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.369 0.507 . . . . 10.0 112.369 -177.566 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -59.96 -28.13 67.4 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 4.8 p -49.64 161.48 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 123.893 0.746 . . . . 10.0 112.087 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.953 -178.694 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.47 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.027 -1.909 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.679 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C3'-C2'-C1' 100.493 -1.576 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.689 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 99.495 -2.289 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.689 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.756 -2.103 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 99.173 -2.519 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.489 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.506 -1.101 0 C3'-C2'-C1' 98.311 -3.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.449 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.955 0 O4'-C1'-C2' 104.211 -1.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.482 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.735 0 O4'-C1'-N19 108.81 1.262 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.482 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 99.306 -2.424 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.629 ' N6 ' HD13 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 C3'-C2'-C1' 99.854 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.566 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.704 0 C3'-C2'-C1' 100.023 -1.912 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.566 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 99.47 -2.307 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.559 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 C3'-C2'-C1' 99.474 -2.304 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.566 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.63 0 O4'-C1'-C2' 104.109 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.641 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.385 -1.654 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.641 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.945 0 C3'-C2'-C1' 100.446 -1.61 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.534 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C3'-C2'-C1' 99.599 -2.215 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.534 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 100.298 -1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.433 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C3'-C2'-C1' 101.775 -0.66 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.527 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 C3'-C2'-C1' 100.654 -1.461 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.527 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.494 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.625 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.69 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.625 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 100.093 -1.862 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.639 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.639 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C3'-C2'-C1' 99.05 -2.607 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.417 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C3'-C2'-C1' 98.736 -2.831 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.63 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 O4'-C1'-C2' 103.948 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.848 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.632 ' C7 ' ' HD3' ' A' ' 144' ' ' ARG . . . . . . . . 0 O4'--C4' 1.457 0.961 0 C3'-C2'-C1' 98.057 -3.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.643 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.563 -1.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.643 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.957 0 C3'-C2'-C1' 100.739 -1.401 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.642 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.837 0 C3'-C2'-C1' 100.215 -1.775 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.483 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.573 ' H73' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 99.92 -1.986 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.543 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.928 0 C3'-C2'-C1' 100.058 -1.887 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.626 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 C4'-C3'-C2' 103.875 0.675 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.626 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.536 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-O4' 108.254 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 -89.33 -98.06 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.897 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.534 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.644 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.644 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.472 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.519 ' HB2' ' C7 ' ' C' ' 31' ' ' ' DT' . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.639 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.425 ' HB2' ' H73' ' B' ' 9' ' ' ' DT' . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.454 HG23 ' SG ' ' A' ' 114' ' ' CYS . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' CYS . . . . . 0.445 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.607 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.446 ' HD3' ' H72' ' B' ' 11' ' ' ' DT' . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.481 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.481 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.432 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' H41' ' B' ' 13' ' ' ' DC' . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.475 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.572 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' TYR . . . . . 0.571 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.622 ' CZ ' ' H71' ' B' ' 15' ' ' ' DT' . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 159' ' ' GLN . 13.0 mtpt -93.45 -2.76 54.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.593 ' C ' ' H ' ' A' ' 165' ' ' VAL . 15.2 mt -43.41 22.46 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 117.585 2.439 . . . . 10.0 117.585 -177.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.471 ' H ' ' C ' ' A' ' 162' ' ' LYS . 15.4 mtmt -66.7 23.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.892 0.877 . . . . 10.0 110.866 177.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' VAL . . . . . 0.593 ' H ' ' C ' ' A' ' 163' ' ' LEU . 29.3 m -74.14 -165.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.284 -178.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.361 -179.941 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.526 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.434 -0.389 0 C3'-C2'-C1' 99.994 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.647 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.798 0 O4'-C1'-N19 108.894 1.368 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . 0.647 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.013 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.658 0 C3'-C2'-C1' 99.681 -2.156 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 25' ' ' ' DA' . . . . . 0.514 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 C3'-C2'-C1' 99.126 -2.553 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' ' DA' . . . . . 0.571 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.034 -2.619 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 27' ' ' ' DA' . . . . . 0.466 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.963 0 O4'-C1'-C2' 103.599 -2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 28' ' ' ' DG' . . . . . 0.466 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 O4'-C1'-C2' 104.477 -1.475 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 29' ' ' ' DT' . . . . . 0.465 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.495 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 30' ' ' ' DA' . . . . . 0.682 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.934 0 C3'-C2'-C1' 100.331 -1.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 31' ' ' ' DT' . . . . . 0.682 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 99.218 -2.487 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 32' ' ' ' DA' . . . . . 0.689 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.772 0 C3'-C2'-C1' 99.122 -2.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 33' ' ' ' DC' . . . . . 0.689 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.059 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 34' ' ' ' DT' . . . . . 0.499 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 O4'-C1'-C2' 104.473 -1.479 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 35' ' ' ' DT' . . . . . 0.557 H2'' ' H71' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.806 -1.353 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 36' ' ' ' DT' . . . . . 0.669 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 C3'-C2'-C1' 100.769 -1.379 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 37' ' ' ' DT' . . . . . 0.669 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 100.261 -1.742 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 38' ' ' ' DC' . . . . . 0.532 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.373 -1.662 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 39' ' ' ' DC' . . . . . 0.48 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.173 -1.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 40' ' ' ' DG' . . . . . 0.46 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C4'-C3'-O3' 108.079 -1.009 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . 0.593 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 100.478 -1.587 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.593 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.59 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.606 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.56 0 C3'-C2'-C1' 101.088 -1.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . 0.616 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.649 -1.465 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 C3'-C2'-C1' 99.598 -2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 99.669 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ' DA' . . . . . 0.482 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 C3'-C2'-C1' 98.642 -2.898 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.874 0 C3'-C2'-C1' 99.502 -2.285 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . 0.533 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 99.821 -2.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.604 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C5'-C4'-C3' 115.907 0.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ' DT' . . . . . 0.604 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.657 -2.174 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ' DA' . . . . . 0.572 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 100.394 -1.647 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.511 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.943 -1.96 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.662 ' C6 ' ' H72' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.99 0 C3'-C2'-C1' 99.688 -2.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ' DT' . . . . . 0.662 ' H72' ' C6 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 100.208 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.47 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.118 0 C3'-C2'-C1' 100.235 -1.761 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ' DT' . . . . . 0.617 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.959 0 C3'-C2'-C1' 100.119 -1.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.617 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 100.758 -1.387 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.769 0 C3'-C2'-C1' 100.254 -1.747 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.54 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C5'-C4'-O4' 108.483 -0.573 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.502 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.713 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.713 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.514 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.602 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.522 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.515 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.449 ' HG2' ' HG2' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.44 HD21 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.44 ' HD3' HD21 ' A' ' 156' ' ' ASN . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 161' ' ' ARG . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 110.297 -0.26 . . . . 10.0 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.516 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.716 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.408 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.716 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.858 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.528 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 126' ' ' ARG . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.858 HE22 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.58 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . 0.473 ' HB2' ' HA ' ' A' ' 143' ' ' GLN . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 161' ' ' ARG . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp . . . . . 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 110.355 -0.239 . . . . 10.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.583 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.639 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.639 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.609 HG21 ' HA ' ' A' ' 136' ' ' CYS . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.581 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.4 HG23 ' O ' ' A' ' 128' ' ' ILE . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.405 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.613 ' H ' ' HA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.609 ' HA ' HG21 ' A' ' 122' ' ' THR . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' HG12 ' A' ' 141' ' ' ILE . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.639 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 144' ' ' ARG . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.639 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 141' ' ' ILE . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.61 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 CA--C 1.539 0.521 0 CA-C-O 120.0 -0.047 . . . . 10.0 110.982 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.415 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.562 ' HA ' ' H ' ' A' ' 135' ' ' GLN . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.444 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.415 ' HA ' ' HG3' ' A' ' 113' ' ' GLN . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.586 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . 0.454 HD21 ' HB3' ' A' ' 125' ' ' TRP . 0.7 OUTLIER -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 128' ' ' ILE . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.517 ' CA ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.501 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.63 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 5.4 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 144' ' ' ARG . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.404 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.533 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.727 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.727 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.494 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.642 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . 0.469 HD21 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.561 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.643 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.459 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 137' ' ' ASN . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.643 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 141' ' ' ILE . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.463 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.463 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 157' ' ' LYS . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 22.8 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 . . . . . 0 CA--C 1.536 0.428 0 CA-C-O 119.568 -0.253 . . . . 10.0 111.307 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.436 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.656 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.656 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.563 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.409 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.563 ' CD1' ' HB ' ' A' ' 122' ' ' THR . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.693 HH21 HD12 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . 0.445 HD21 ' HB3' ' A' ' 125' ' ' TRP . 0.8 OUTLIER -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.693 HD12 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.484 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.532 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 137' ' ' ASN . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.624 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.587 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.409 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.414 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 157' ' ' LYS . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 22.3 tttm . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.342 0.115 . . . . 10.0 111.198 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.548 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.696 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.696 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.414 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.685 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.405 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.41 ' H ' ' HB2' ' A' ' 130' ' ' SER . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.555 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.521 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.405 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.521 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.402 ' O ' ' HB ' ' A' ' 155' ' ' VAL . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.638 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.638 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.445 ' OE1' ' HE3' ' A' ' 162' ' ' LYS . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 159' ' ' GLN . 1.7 ttpp . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.453 -0.309 0 N-CA-C 110.366 -0.235 . . . . 10.0 110.366 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.671 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.458 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.671 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.564 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . 0.426 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 2.5 m-80 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.409 ' O ' HG23 ' A' ' 128' ' ' ILE . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.426 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.478 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.599 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.599 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.663 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.663 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 161' ' ' ARG . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 118' ' ' SER . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.61 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.437 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 113' ' ' GLN . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.461 ' HD3' ' HA ' ' A' ' 124' ' ' ARG . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 126' ' ' ARG . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . 0.421 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.1 m-80 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.421 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.61 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.465 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.506 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 161' ' ' ARG . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 29.1 tttp . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 119.806 -0.14 . . . . 10.0 110.897 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.534 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.644 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.644 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.472 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 124' ' ' ARG . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.639 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 134' ' ' ILE . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.454 HG23 ' SG ' ' A' ' 114' ' ' CYS . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' CYS . . . . . 0.445 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.432 ' HD2' ' HD2' ' A' ' 151' ' ' PRO . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.481 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.481 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.432 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.475 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 160' ' ' LYS . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' TYR . . . . . 0.475 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . 0.46 ' HE ' ' HB3' ' A' ' 161' ' ' ARG . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 159' ' ' GLN . 13.0 mtpt . . . . . 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.43 -106.3 0.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.679 0.276 . . . . 10.0 111.298 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.502 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 2.6 tp-100 174.29 157.7 0.15 Allowed 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 107.431 -1.322 . . . . 10.0 107.431 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.713 ' HB3' ' H ' ' A' ' 118' ' ' SER . 15.1 t -84.5 171.61 12.38 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 106.539 -1.652 . . . . 10.0 106.539 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.506 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 20.2 m -106.3 22.5 15.65 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -159.86 -41.39 0.05 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.584 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 71.3 m -90.59 -73.4 0.53 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.675 0.991 . . . . 10.0 113.675 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.713 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 5.0 m 82.65 82.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 O-C-N 124.311 1.007 . . . . 10.0 110.598 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -149.26 100.48 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.298 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.17 -34.74 23.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.619 -1.173 . . . . 10.0 112.823 -177.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -88.26 79.15 7.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 10.0 110.766 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.514 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.3 109.53 22.27 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.63 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.455 HG12 ' C7 ' ' C' ' 31' ' ' ' DT' . 1.8 tt -44.07 -33.7 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-N 114.702 -1.136 . . . . 10.0 111.795 179.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.423 ' HG2' ' H71' ' C' ' 31' ' ' ' DT' . 3.8 mmt-85 -160.34 121.04 2.96 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.601 -1.999 . . . . 10.0 105.601 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.602 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 36.1 m95 -75.91 -176.94 3.61 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.153 0.797 . . . . 10.0 113.153 -176.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' A' ' 134' ' ' ILE . 9.1 tpt180 -165.71 17.37 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.751 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -44.77 -39.77 5.51 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.606 -0.725 . . . . 10.0 112.371 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 tt 45.98 83.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.6 1.16 . . . . 10.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -34.72 96.09 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.031 -0.986 . . . . 10.0 113.477 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.4 m -153.33 -78.53 0.11 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.5 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -144.54 -66.63 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.669 0.271 . . . . 10.0 110.423 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -77.54 172.82 12.78 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.658 -1.238 . . . . 10.0 107.658 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.87 90.87 0.22 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.064 -1.065 . . . . 10.0 111.077 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.522 ' O ' ' HB3' ' A' ' 126' ' ' ARG . 21.1 mt -84.72 73.6 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.296 0.569 . . . . 10.0 109.659 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG3' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -50.55 -45.3 56.87 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.137 -0.938 . . . . 10.0 113.34 -179.15 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.515 ' N ' HE21 ' A' ' 135' ' ' GLN . 6.7 p -68.15 174.25 4.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 122.676 1.227 . . . . 10.0 113.142 -177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -112.73 -8.09 13.78 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 113.82 -1.536 . . . . 10.0 108.928 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.57 -50.25 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.149 -0.932 . . . . 10.0 112.552 -178.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 76.0 m -58.18 -45.53 87.36 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -54.37 8.47 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.6 HD13 ' N6 ' ' C' ' 30' ' ' ' DA' . 83.3 mt -70.27 -38.73 75.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 114.202 1.186 . . . . 10.0 114.202 -176.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.72 -31.34 70.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.295 0.569 . . . . 10.0 110.339 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -63.9 -13.46 45.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.126 0.787 . . . . 10.0 113.126 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.599 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 85.1 mtm180 -44.38 -50.01 9.37 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.449 ' HG2' ' HG2' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.96 -30.62 21.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.313 0.578 . . . . 10.0 110.997 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -79.5 0.51 29.35 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 113.052 0.76 . . . . 10.0 113.052 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -120.93 -38.66 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -162.67 -163.9 0.94 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.859 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.12 101.17 3.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.764 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -45.39 137.6 5.14 Favored Pre-proline 0 C--O 1.235 0.307 0 CA-C-N 115.676 -0.693 . . . . 10.0 111.572 178.257 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.92 128.73 31.12 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.157 1.905 . . . . 10.0 111.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.17 -9.95 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.572 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -52.47 63.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.886 -0.143 . . . . 10.0 110.649 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.92 -28.25 68.79 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.2 t -71.61 -43.17 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.206 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.44 HD21 ' HD3' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.5 -44.4 46.1 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.304 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.625 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -82.23 -24.41 34.86 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.581 -0.448 . . . . 10.0 110.565 178.409 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.6 t80 -51.69 -40.2 59.67 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.993 -0.744 . . . . 10.0 108.993 177.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -26.41 0.92 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 114.07 -1.423 . . . . 10.0 111.85 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -49.12 -31.78 8.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.411 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.719 HH22 ' H71' ' B' ' 16' ' ' ' DT' . 1.2 tmt_? -86.51 -47.66 9.07 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.216 0.531 . . . . 10.0 110.379 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -66.2 -11.54 50.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.269 -0.878 . . . . 10.0 113.322 -178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 70.9 mt -93.82 -13.21 27.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.715 -0.394 . . . . 10.0 110.703 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 161' ' ' ARG . 47.9 mtmt -84.73 -52.62 5.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.845 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.99 144.34 34.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.453 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.51 179.825 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.669 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 100.908 -1.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.669 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 C3'-C2'-C1' 100.792 -1.363 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.638 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.935 -1.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 99.806 -2.067 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.625 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.242 -2.47 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.449 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.506 -1.098 0 C3'-C2'-C1' 99.309 -2.422 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.505 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.794 0 O4'-C1'-C2' 103.989 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.511 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 O4'-C1'-N19 109.01 1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.511 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 98.931 -2.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.6 ' N6 ' HD13 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.636 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 99.411 -2.35 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.636 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.638 0 C3'-C2'-C1' 99.732 -2.12 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 C3'-C2'-C1' 99.509 -2.28 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.489 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.189 -1.737 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.664 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 O4'-C1'-C2' 104.546 -1.413 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.664 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.68 -1.443 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.595 H2'' ' C5 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.722 0 C3'-C2'-C1' 99.772 -2.091 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.595 ' C5 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.604 0 C3'-C2'-C1' 101.586 -0.796 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.631 H2'' ' N7 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.857 -1.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.631 ' N7 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C5'-C4'-O4' 108.227 -0.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.548 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.549 -1.536 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.549 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 99.594 -2.218 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.574 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C3'-C2'-C1' 100.397 -1.645 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.574 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C3'-C2'-C1' 100.797 -1.359 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.59 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.284 -1.726 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.59 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 99.695 -2.146 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 98.79 -2.793 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.484 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.618 0 C3'-C2'-C1' 98.606 -2.924 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.508 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.417 0 O4'-C1'-N19 109.807 2.509 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.613 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 100.998 -1.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.613 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.865 0 C3'-C2'-C1' 97.755 -3.532 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.713 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 OP1-P-O3' 110.263 0.895 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.713 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 N19-C1'-C2' 116.359 1.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.664 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 100.158 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.489 ' C7 ' ' HG3' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.719 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 100.22 -1.771 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.656 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 100.339 -1.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.656 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 O4'-C1'-C2' 104.598 -1.365 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.543 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 100.227 -1.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.543 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 OP1-P-O3' 109.292 0.591 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.781 0.324 . . . . 10.0 110.625 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 49.1 m-85 -105.81 -96.76 0.34 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.297 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.516 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 165.59 160.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.716 ' HB3' ' H ' ' A' ' 118' ' ' SER . 35.4 t -86.52 165.58 16.13 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.001 -1.851 . . . . 10.0 106.001 178.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.407 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.0 OUTLIER -101.65 25.71 8.2 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.463 -0.94 . . . . 10.0 108.463 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.408 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 5.1 m-80 -160.0 -42.44 0.05 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 118' ' ' SER . 77.2 m -92.88 -76.96 0.45 Allowed 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.16 0.8 . . . . 10.0 113.16 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.716 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 50.3 m 90.4 84.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.823 1.327 . . . . 10.0 110.052 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.858 HG23 HE22 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -140.8 95.45 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.549 -1.205 . . . . 10.0 109.474 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -52.53 -23.73 6.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.824 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -104.52 82.37 1.91 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 10.0 110.851 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -99.61 116.12 30.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.02 0.438 . . . . 10.0 111.653 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 12.2 tt -60.76 -9.24 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.945 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.613 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.9 OUTLIER -173.7 108.25 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.827 -1.175 . . . . 10.0 107.827 179.522 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.528 ' CZ3' ' HG3' ' A' ' 135' ' ' GLN . 41.8 m95 -77.07 175.64 9.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.154 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 140' ' ' PHE . 54.9 ttt180 -168.96 22.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.363 0.602 . . . . 10.0 110.891 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -44.21 -41.69 5.99 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.829 -1.078 . . . . 10.0 112.152 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.435 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 8.1 tp 38.75 75.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 O-C-N 124.656 1.222 . . . . 10.0 111.573 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -31.98 92.16 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.334 -1.303 . . . . 10.0 114.306 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 7.5 m -130.99 -73.42 0.54 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.62 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -131.66 -64.56 0.79 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.721 -0.844 . . . . 10.0 108.721 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -92.5 -157.74 0.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.38 89.43 0.13 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.542 -0.837 . . . . 10.0 111.272 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.9 mt -80.69 79.95 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 122.163 0.982 . . . . 10.0 109.946 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.858 HE22 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -58.07 -42.4 85.46 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.997 -1.456 . . . . 10.0 112.47 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.58 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.8 p -69.42 175.06 4.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.431 1.11 . . . . 10.0 112.982 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -111.87 -10.69 13.98 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.75 -1.568 . . . . 10.0 109.23 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.31 -49.83 21.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.687 -0.688 . . . . 10.0 112.428 -178.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 68.3 m -59.81 -48.35 82.03 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -71.77 -36.86 70.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.636 ' HB ' ' H72' ' C' ' 29' ' ' ' DT' . 45.7 mt -89.53 -35.63 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 114.168 1.174 . . . . 10.0 114.168 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.58 -31.81 71.27 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.93 -0.482 . . . . 10.0 110.687 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.473 ' HA ' ' HB2' ' A' ' 146' ' ' TYR . 29.2 mt-30 -61.36 -12.81 15.5 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.566 0.95 . . . . 10.0 113.566 -178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.497 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 88.2 mtm180 -45.89 -51.82 12.49 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.639 0.607 . . . . 10.0 112.639 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.2 OUTLIER -86.92 -27.11 23.55 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.836 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . 0.473 ' HB2' ' HA ' ' A' ' 143' ' ' GLN . 16.5 m-85 -82.06 16.79 1.79 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -145.02 -37.79 0.28 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.989 0.424 . . . . 10.0 110.267 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -157.21 -169.17 2.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.223 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 15.5 p -70.89 109.75 5.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.032 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -46.1 133.18 7.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 123.762 0.664 . . . . 10.0 111.625 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.23 124.43 16.27 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.276 1.984 . . . . 10.0 111.099 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.5 t -61.57 -24.39 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.362 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -54.01 28.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.921 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.417 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -61.39 -31.89 71.81 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.358 0.503 . . . . 10.0 112.358 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 4.6 t -70.96 -44.76 75.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.874 0.369 . . . . 10.0 110.731 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.95 -35.11 31.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.531 177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.495 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 1.3 tptm -80.9 -23.24 39.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.848 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.52 ' CE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 47.0 t80 -53.54 -34.12 57.09 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -46.32 -27.29 1.0 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.012 -0.995 . . . . 10.0 111.621 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.421 ' NZ ' " H3'" ' B' ' 13' ' ' ' DC' . 47.9 tttt -48.65 -43.34 36.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.297 178.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.809 HH22 ' H71' ' B' ' 16' ' ' ' DT' . 0.5 OUTLIER -91.31 -33.43 15.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.872 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -73.79 -8.71 57.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 6.1 tp -69.15 7.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -60.25 -45.41 93.34 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.23 108.67 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.268 -1.333 . . . . 10.0 109.109 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.379 -178.553 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.615 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.658 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 100.401 -1.642 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.658 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.77 -2.093 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.878 0 C3'-C2'-C1' 99.993 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.649 0 C3'-C2'-C1' 98.939 -2.686 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.52 ' N6 ' ' CE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 98.956 -2.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.477 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.047 0 O4'-C1'-C2' 104.142 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.477 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C1'-O4'-C4' 107.476 -1.588 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.636 ' H72' ' HB ' ' A' ' 141' ' ' ILE . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 98.964 -2.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.585 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 100.274 -1.733 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.634 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 99.412 -2.349 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 99.162 -2.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.613 ' H42' ' NH2' ' A' ' 124' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 99.263 -2.455 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.519 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 O4'-C1'-C2' 103.987 -1.921 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.628 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.785 0 O4'-C1'-C2' 104.852 -1.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.628 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 100.879 -1.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.477 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.862 0 C3'-C2'-C1' 100.132 -1.834 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.692 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.75 0 O4'-C1'-C2' 104.752 -1.225 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.692 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.013 -1.92 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 OP1-P-O3' 109.573 0.679 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.569 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 100.364 -1.669 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.569 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 99.54 -2.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.436 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 99.981 -1.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.576 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.665 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 99.526 -2.267 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.668 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.515 ' N6 ' HH21 ' A' ' 124' ' ' ARG . . . . . . . . 0 C2'--C1' 1.511 -0.698 0 C3'-C2'-C1' 98.036 -3.331 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.435 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.642 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.256 0 O4'-C1'-C2' 103.998 -1.911 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.642 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C3'-C2'-C1' 100.503 -1.569 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.578 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 98.293 -3.148 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.557 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.698 0 C3'-C2'-C1' 99.88 -2.014 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.784 H2'' ' H71' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 O4'-C1'-C2' 104.457 -1.494 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.784 ' H71' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 100.003 -1.926 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.509 ' C7 ' H2'' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C3'-C2'-C1' 99.591 -2.221 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.809 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.515 -2.275 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.642 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 100.304 -1.711 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.642 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.96 -1.037 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.544 ' C5 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 100.421 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.521 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 OP1-P-O3' 109.444 0.639 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 m . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.461 0.648 . . . . 10.0 110.501 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -94.96 -95.56 0.17 Allowed 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.355 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.583 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 167.89 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.639 ' HB3' ' H ' ' A' ' 118' ' ' SER . 38.7 t -88.55 167.45 13.4 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 106.594 -1.632 . . . . 10.0 106.594 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 4.6 m -104.24 31.57 4.52 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -163.27 -49.36 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.316 -0.994 . . . . 10.0 108.316 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 118' ' ' SER . 65.4 m -88.09 -80.42 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 -177.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.639 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 49.3 m 93.98 78.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.827 1.33 . . . . 10.0 110.149 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -131.07 93.34 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.169 -0.923 . . . . 10.0 108.854 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -39.22 -50.15 1.93 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.591 0.96 . . . . 10.0 113.591 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -99.92 91.36 4.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.042 0.448 . . . . 10.0 110.413 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.609 HG21 ' HA ' ' A' ' 136' ' ' CYS . 2.8 m -96.38 124.76 40.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.863 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.405 HG23 ' H73' ' C' ' 31' ' ' ' DT' . 9.8 tp -57.99 -8.59 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-N 114.996 -1.002 . . . . 10.0 112.925 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.551 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.7 tpt180 177.84 107.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.709 -1.219 . . . . 10.0 107.709 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.581 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 22.1 m95 -76.5 -179.75 5.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.657 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HD2' ' HB2' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -167.74 17.39 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -41.42 -45.12 3.04 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.474 0.71 . . . . 10.0 112.883 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.444 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.8 tp 47.66 80.16 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.098 1.359 . . . . 10.0 113.237 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -27.36 95.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.219 -1.355 . . . . 10.0 113.417 177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 12.5 p -151.11 -77.59 0.13 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.067 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.99 -71.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.685 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.79 -163.21 0.91 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -153.09 84.0 0.16 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.658 -0.782 . . . . 10.0 111.188 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.405 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 50.4 mt -79.19 87.13 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 121.463 0.649 . . . . 10.0 110.333 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.613 ' H ' ' HA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -59.1 -39.0 80.89 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.958 1.095 . . . . 10.0 113.958 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.609 ' HA ' HG21 ' A' ' 122' ' ' THR . 3.5 p -72.98 179.89 3.53 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.518 1.151 . . . . 10.0 113.316 -176.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' HG12 ' A' ' 141' ' ' ILE . 23.9 p-10 -118.46 -11.15 10.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.372 -1.74 . . . . 10.0 109.679 178.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.639 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -72.78 -48.11 40.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.299 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 55.7 m -52.77 -45.68 67.21 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 126' ' ' ARG . 50.3 t80 -73.64 -55.83 5.78 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.618 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 6.5 mm -65.06 -39.08 84.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 112.349 0.499 . . . . 10.0 112.349 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.639 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.69 -33.51 75.06 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -71.83 -21.1 61.73 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.087 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.489 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 29.0 ttp180 -50.47 -39.3 47.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.888 0.375 . . . . 10.0 110.669 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.29 -38.2 17.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.23 0.538 . . . . 10.0 110.775 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -89.15 22.3 2.87 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.318 0.859 . . . . 10.0 113.318 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -132.65 -37.74 1.04 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.485 0.66 . . . . 10.0 109.736 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 165.9 28.93 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.233 -0.894 . . . . 10.0 109.974 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.5 119.82 9.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.926 0.393 . . . . 10.0 110.106 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.5 ptt85 -47.53 115.39 3.69 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.602 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.63 147.07 96.23 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.284 1.989 . . . . 10.0 112.003 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.35 -8.61 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.451 -0.795 . . . . 10.0 111.141 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -52.82 55.24 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.551 -0.295 . . . . 10.0 111.07 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.419 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -75.98 -23.69 55.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 122.307 -0.246 . . . . 10.0 110.888 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 65.0 t -68.35 -43.05 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 123.618 0.574 . . . . 10.0 110.139 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -44.88 55.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.991 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.49 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 29.9 mmtp -82.43 -23.78 34.65 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.5 -0.48 . . . . 10.0 110.293 177.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.61 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 4.8 t80 -53.86 -36.94 63.16 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.891 -1.151 . . . . 10.0 107.891 176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.495 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 23.0 mt-30 -48.7 -23.08 0.91 Allowed 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 113.885 -1.507 . . . . 10.0 111.756 176.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -45.89 -42.6 12.82 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.982 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.54 ' CZ ' ' H71' ' B' ' 15' ' ' ' DT' . 0.8 OUTLIER -92.37 -20.01 21.51 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.597 0.713 . . . . 10.0 111.23 178.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.435 ' C ' ' H ' ' A' ' 164' ' ' LYS . 1.5 mtpt -92.65 -8.53 43.82 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.496 0.925 . . . . 10.0 113.496 -177.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.3 mt -53.81 8.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.34 1.607 . . . . 10.0 115.34 -176.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.435 ' H ' ' C ' ' A' ' 162' ' ' LYS . 10.6 ptmt -65.89 -17.18 64.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 118.226 0.467 . . . . 10.0 110.669 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 29.1 m -65.57 -18.66 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.945 0.72 . . . . 10.0 112.945 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . 0.409 ' OE1' HD22 ' A' ' 163' ' ' LEU . 37.5 mt-30 . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 111.133 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.551 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 100.065 -1.882 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.707 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 100.102 -1.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.707 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.574 0 C3'-C2'-C1' 99.565 -2.239 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 99.039 -2.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.465 H2'' ' C8 ' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.33 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.485 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.952 0 O4'-C1'-C2' 104.324 -1.615 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.542 " C2'" ' H71' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C1'-O4'-C4' 107.781 -1.371 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.542 ' H71' " C2'" ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.94 0 C3'-C2'-C1' 98.906 -2.71 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.618 ' H62' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.426 -0.89 0 C3'-C2'-C1' 100.418 -1.63 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.615 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C3'-C2'-C1' 99.65 -2.179 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.634 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.455 0.797 0 C3'-C2'-C1' 99.166 -2.524 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.634 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.682 H2'' ' H71' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.697 0 N19-C1'-C2' 116.459 1.412 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.682 ' H71' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 101.152 -1.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.642 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 99.938 -1.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.642 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.639 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C3'-C2'-C1' 100.558 -1.53 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.546 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 C3'-C2'-C1' 100.841 -1.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 C3'-C2'-C1' 101.757 -0.674 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.511 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 100.334 -1.69 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.529 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 100.483 -1.584 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.529 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 100.485 -1.582 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.578 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.117 -1.131 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.637 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C3'-C2'-C1' 99.283 -2.441 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.637 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 98.342 -3.113 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.444 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 100.551 -1.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.028 0 C3'-C2'-C1' 99.873 -2.019 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.878 0 O4'-C1'-C2' 104.724 -1.251 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.598 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 99.749 -2.108 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.49 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 98.669 -2.879 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.436 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.929 0 O4'-C1'-C2' 104.442 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.436 ' C7 ' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 100.436 -1.617 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.54 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.239 -2.472 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.6 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.008 0 O4'-C1'-C2' 104.346 -1.595 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.726 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.74 0 C3'-C2'-C1' 100.753 -1.391 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.726 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 C5'-C4'-C3' 116.336 1.09 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.614 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 100.051 -1.892 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.504 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-O3' 108.981 -0.599 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.3 m . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.356 0.598 . . . . 10.0 111.37 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.429 ' H ' ' HH2' ' A' ' 125' ' ' TRP . 47.9 t80 -84.0 -99.32 0.05 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.982 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.415 ' HG3' ' HA ' ' A' ' 118' ' ' SER . 1.1 tp-100 168.94 162.36 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.562 ' HA ' ' H ' ' A' ' 135' ' ' GLN . 37.6 t -86.77 169.0 12.99 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 106.424 -1.695 . . . . 10.0 106.424 177.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.417 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.1 OUTLIER -103.01 28.51 6.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.188 -1.041 . . . . 10.0 108.188 179.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.444 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.4 m-80 -164.62 -38.73 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.946 -1.131 . . . . 10.0 107.946 -176.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 114' ' ' CYS . 71.7 m -96.23 -129.08 0.16 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.581 -0.736 . . . . 10.0 112.855 -179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.415 ' HA ' ' HG3' ' A' ' 113' ' ' GLN . 2.9 m 159.88 69.74 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.669 1.188 . . . . 10.0 109.88 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.1 t -132.49 78.25 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 p -41.48 -41.27 2.03 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.391 -0.822 . . . . 10.0 112.464 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -101.55 84.74 2.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.485 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -89.37 130.42 35.74 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.102 0.778 . . . . 10.0 113.102 -178.427 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 8.6 tp -61.29 -10.38 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 114.329 -1.305 . . . . 10.0 111.979 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.582 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 0.4 OUTLIER 176.13 110.77 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 -179.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.586 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.1 m95 -77.09 175.74 9.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.38 -178.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 0.0 OUTLIER -162.46 8.27 0.06 Allowed 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 121.228 0.537 . . . . 10.0 111.365 -178.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.454 HD21 ' HB3' ' A' ' 125' ' ' TRP . 0.7 OUTLIER -36.96 -48.71 0.78 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.287 1.035 . . . . 10.0 113.087 -179.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 128' ' ' ILE . 9.8 tp 49.87 76.81 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 O-C-N 124.559 1.162 . . . . 10.0 111.35 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -29.57 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 113.846 -1.525 . . . . 10.0 112.975 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 p -145.96 -68.57 0.28 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.29 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -140.92 -60.7 0.5 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.876 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.47 -168.98 1.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.583 -0.895 . . . . 10.0 108.583 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.43 88.59 0.14 Allowed Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.068 -1.063 . . . . 10.0 111.88 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 62.2 mt -81.4 81.48 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 CA-C-O 121.767 0.794 . . . . 10.0 109.985 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -53.86 -39.8 65.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.318 -1.31 . . . . 10.0 112.403 179.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.517 ' CA ' HE21 ' A' ' 135' ' ' GLN . 6.1 p -73.0 -178.54 2.85 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.664 1.221 . . . . 10.0 112.856 -177.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -120.1 -5.36 10.0 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.002 -1.908 . . . . 10.0 109.301 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -75.83 -50.52 14.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.774 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.63 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 86.8 m -59.86 -41.61 91.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 10.0 112.138 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.501 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 32.6 t80 -73.66 -54.3 8.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.417 0.895 . . . . 10.0 113.417 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.64 HG21 ' N6 ' ' C' ' 30' ' ' ' DA' . 5.0 mm -70.18 -39.96 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -176.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -64.49 -31.96 73.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.718 0.771 . . . . 10.0 108.947 179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.63 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 5.4 tt0 -59.9 -24.65 64.47 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.007 -0.997 . . . . 10.0 110.525 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.519 ' HD3' ' H72' ' B' ' 11' ' ' ' DT' . 35.8 ttp180 -48.87 -41.69 34.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.028 0.442 . . . . 10.0 111.23 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.39 -33.93 20.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.657 0.741 . . . . 10.0 110.142 178.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -85.31 18.85 2.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.324 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -126.74 -39.39 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.69 0.757 . . . . 10.0 109.514 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -156.36 -176.01 5.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.877 -1.056 . . . . 10.0 109.023 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 12.5 t -68.92 125.68 27.38 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.404 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -45.12 113.9 1.99 Allowed Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.628 179.155 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.16 141.83 37.45 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.276 2.651 . . . . 10.0 112.597 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.8 t -73.24 -9.88 13.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.28 0.562 . . . . 10.0 110.686 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.8 p -54.89 -51.54 65.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.5 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.45 -24.42 60.23 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.999 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 76.7 t -70.0 -43.25 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.233 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -42.3 43.9 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.521 ' HG3' " H3'" ' B' ' 12' ' ' ' DA' . 18.8 mmtp -82.01 -23.75 35.78 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 121.012 -0.275 . . . . 10.0 111.197 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 6.2 t80 -51.09 -40.37 58.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.765 0.793 . . . . 10.0 109.088 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 33.8 mt-30 -49.05 -25.68 2.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 113.908 -1.496 . . . . 10.0 111.563 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -50.09 -39.05 41.31 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.73 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.8 OUTLIER -91.49 -20.63 21.53 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.929 0.871 . . . . 10.0 110.2 179.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 32.6 tttm -81.04 -10.16 59.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.961 -1.018 . . . . 10.0 111.89 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.4 tp -83.89 9.38 12.3 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -175.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.21 -33.16 69.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.416 0.627 . . . . 10.0 109.843 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 60.7 t -140.35 89.32 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.968 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . 0.427 ' NE2' ' HA ' ' A' ' 166' ' ' GLN . 10.7 mm-40 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.534 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 100.084 -1.868 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.669 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 100.542 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.669 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.452 0.587 0 C3'-C2'-C1' 99.898 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.575 H2'' ' C8 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.579 0 C3'-C2'-C1' 99.837 -2.045 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.575 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.511 -0.714 0 C3'-C2'-C1' 99.21 -2.493 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.518 ' C5 ' ' C2 ' ' C' ' 25' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.178 0 C3'-C2'-C1' 99.941 -1.97 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.411 ' C8 ' H2'' ' C' ' 26' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 C3'-C2'-C1' 99.985 -1.939 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.41 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 O4'-C1'-N19 109.032 1.54 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.621 ' H71' HG22 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 98.98 -2.657 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.644 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.639 0 C3'-C2'-C1' 100.728 -1.409 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.644 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.623 0 C3'-C2'-C1' 99.928 -1.98 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.63 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.742 0 C3'-C2'-C1' 98.757 -2.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.63 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 C3'-C2'-C1' 100.543 -1.541 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.521 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 100.053 -1.891 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.579 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.746 0 C3'-C2'-C1' 100.603 -1.498 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.639 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 101.088 -1.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.639 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 100.262 -1.741 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.658 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-C2' 104.796 -1.186 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.658 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.314 -2.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.416 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C5'-C4'-C3' 115.728 0.685 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.524 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.168 -1.809 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.662 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 99.452 -2.32 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.662 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.599 -1.501 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.658 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 100.109 -1.851 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C3'-C2'-C1' 100.187 -1.795 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.565 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.164 -1.811 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 98.631 -2.906 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.413 " C2'" ' H72' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.756 0 C3'-C2'-C1' 99.858 -2.03 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.434 ' H73' ' HB2' ' A' ' 126' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 99.441 -2.328 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.578 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 O4'-C1'-C2' 104.828 -1.157 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.578 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 98.377 -3.088 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.521 " H3'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.503 -1.29 0 C3'-C2'-C1' 100.278 -1.73 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.5 ' N4 ' ' HB1' ' A' ' 154' ' ' ALA . . . . . . . . 0 C2'--C1' 1.508 -0.933 0 O4'-C1'-C2' 104.391 -1.554 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.739 " C2'" ' H71' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.56 0 C3'-C2'-C1' 100.275 -1.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.739 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C3'-C2'-C1' 98.718 -2.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.614 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.121 0 C1'-O4'-C4' 106.851 -2.035 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.614 ' C6 ' H2'' ' B' ' 16' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.463 -2.312 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.583 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.707 0 O4'-C1'-C2' 104.788 -1.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.645 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.797 0 C3'-C2'-C1' 100.582 -1.513 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.645 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 OP1-P-O3' 109.963 0.801 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 120.651 0.262 . . . . 10.0 110.52 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 44.9 t80 -82.77 -97.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.533 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 45.1 tt0 167.57 159.11 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.834 0.854 . . . . 10.0 108.915 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.727 ' HB3' ' H ' ' A' ' 118' ' ' SER . 7.3 t -89.98 160.01 16.6 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.289 -2.115 . . . . 10.0 105.289 178.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -98.15 32.22 2.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 107.564 -1.272 . . . . 10.0 107.564 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -162.43 -46.28 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.999 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 83.1 m -93.34 -59.46 2.02 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 -176.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.727 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 6.3 m 78.45 75.43 0.06 Allowed 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 123.448 0.699 . . . . 10.0 109.787 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.2 94.27 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.771 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.61 -46.07 39.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.478 0.548 . . . . 10.0 112.478 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -88.07 73.82 8.98 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.058 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.494 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -87.35 111.46 21.11 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.158 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.27 -8.19 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 123.652 0.595 . . . . 10.0 112.339 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.498 ' NH2' ' H42' ' C' ' 33' ' ' ' DC' . 1.0 OUTLIER -177.18 111.38 0.08 Allowed 'General case' 0 C--N 1.342 0.261 0 N-CA-C 107.903 -1.147 . . . . 10.0 107.903 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.642 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 37.5 m95 -80.65 176.76 9.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 136' ' ' CYS . 0.0 OUTLIER -167.94 17.01 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.66 0.615 . . . . 10.0 112.66 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.469 HD21 ' HE3' ' A' ' 125' ' ' TRP . 6.0 m-80 -38.89 -49.04 1.63 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.522 0.729 . . . . 10.0 112.733 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.8 tp 45.66 83.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 10.0 112.25 -178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -28.1 95.63 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 113.235 -1.802 . . . . 10.0 112.975 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.6 p -145.87 -72.01 0.25 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.69 0.757 . . . . 10.0 110.828 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -137.69 -72.67 0.42 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.633 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -82.91 -169.25 2.41 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -140.98 82.47 0.24 Allowed Glycine 0 N--CA 1.434 -1.481 0 C-N-CA 120.398 -0.906 . . . . 10.0 111.145 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.6 mt -79.41 80.12 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.304 0.573 . . . . 10.0 110.542 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.54 -41.23 76.46 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 7.1 p -70.03 175.19 4.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.388 1.09 . . . . 10.0 112.974 -175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 141' ' ' ILE . 20.6 p-10 -115.81 -9.07 11.92 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.605 -1.634 . . . . 10.0 109.625 177.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.561 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.2 -47.7 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.568 -179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.643 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 26.8 m -53.01 -51.16 62.57 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 116.127 -0.488 . . . . 10.0 112.214 -178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.459 ' HB2' ' CD ' ' A' ' 126' ' ' ARG . 51.8 t80 -72.99 -55.21 6.86 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.732 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 28.4 mm -58.82 -45.1 91.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -177.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.97 -33.32 74.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.213 0.53 . . . . 10.0 109.577 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.643 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 4.3 tt0 -63.47 -23.99 67.64 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.431 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.479 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 35.3 ttp180 -47.25 -41.16 18.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.993 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.467 ' HE2' ' OP2' ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -88.81 -36.63 15.94 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.718 -0.614 . . . . 10.0 110.972 178.902 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -81.94 21.08 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.813 1.042 . . . . 10.0 113.813 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -144.44 -42.92 0.25 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 120.966 0.412 . . . . 10.0 110.353 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 40.1 pttt -137.72 167.14 22.31 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.512 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.45 118.14 9.67 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.463 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.1 OUTLIER -50.23 119.22 10.3 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.847 179.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.61 137.74 78.88 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.835 2.357 . . . . 10.0 112.192 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.4 t -65.15 -10.71 10.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.782 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -52.4 64.65 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 121.195 -0.202 . . . . 10.0 110.669 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.516 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -63.39 -30.48 71.61 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 178.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 48.7 t -71.29 -43.04 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.041 0.448 . . . . 10.0 110.002 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.02 -44.24 51.15 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.472 177.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.527 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 12.5 mmtp -81.16 -23.95 37.9 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.608 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 31.7 t80 -53.5 -37.27 62.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.5 0.667 . . . . 10.0 109.253 178.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 22.8 mt-30 -46.05 -26.94 0.82 Allowed 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 114.298 -1.319 . . . . 10.0 111.527 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -47.11 -43.5 20.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.344 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.687 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 2.6 tmm_? -91.47 -35.94 14.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.422 0.629 . . . . 10.0 110.191 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 12.6 tttp -65.84 -13.49 59.65 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.776 -1.102 . . . . 10.0 112.788 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 mt -93.3 -11.94 31.26 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.814 -0.354 . . . . 10.0 111.316 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -90.66 -84.47 0.24 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.911 -0.316 . . . . 10.0 110.352 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 9.5 p -173.51 147.4 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.612 -0.884 . . . . 10.0 108.612 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 120.471 -0.492 . . . . 10.0 111.556 -178.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.607 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.661 0 C3'-C2'-C1' 100.036 -1.903 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.607 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.645 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.701 0 C3'-C2'-C1' 100.389 -1.651 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.645 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 99.824 -2.054 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.536 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.509 -0.935 0 C3'-C2'-C1' 99.684 -2.154 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.509 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C3'-C2'-C1' 99.145 -2.539 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.504 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.713 0 O4'-C1'-C2' 103.761 -2.127 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.637 H2'' ' H71' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.537 0.89 0 O4'-C1'-N19 108.746 1.183 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.637 ' H71' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.151 -2.535 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.732 ' H62' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C3'-C2'-C1' 100.868 -1.309 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.614 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.903 0 C3'-C2'-C1' 100.316 -1.703 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.536 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.455 0.782 0 C3'-C2'-C1' 98.587 -2.938 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 99.838 -2.044 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.584 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 O4'-C1'-C2' 104.102 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.615 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.826 0 O4'-C1'-C2' 104.762 -1.217 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.615 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.08 0 N19-C1'-C2' 116.64 1.525 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.619 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.984 0 C3'-C2'-C1' 100.282 -1.727 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.638 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.907 0 C3'-C2'-C1' 100.028 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.638 ' C5 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 100.646 -1.467 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.501 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C4'-C3'-C2' 103.981 0.781 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 100.269 -1.736 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.608 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 100.754 -1.39 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.615 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 C3'-C2'-C1' 100.517 -1.559 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.635 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 100.94 -1.257 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.536 0.757 0 C3'-C2'-C1' 99.359 -2.386 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.581 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.452 0.537 0 C3'-C2'-C1' 100.352 -1.677 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.581 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.111 0 C3'-C2'-C1' 98.2 -3.214 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -1.02 0 C3'-C2'-C1' 100.003 -1.927 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.604 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.166 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.604 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-C2' 104.593 -1.37 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.413 H2'' ' C8 ' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.914 0 C3'-C2'-C1' 99.04 -2.614 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.527 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.024 0 C3'-C2'-C1' 98.784 -2.797 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.536 H2'' ' C7 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.501 -1.454 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.687 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.953 0 C3'-C2'-C1' 99.767 -2.095 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.622 ' H71' " C2'" ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.538 1.039 0 C3'-C2'-C1' 99.338 -2.402 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.541 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.001 0 O4'-C1'-C2' 103.91 -1.991 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.562 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 100.277 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.562 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 100.641 -1.471 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.55 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.083 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.55 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 110.772 0.766 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.083 0.468 . . . . 10.0 110.863 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 16.2 t80 -77.08 -99.58 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.307 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.436 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 tp-100 168.53 159.03 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.655 -0.869 . . . . 10.0 108.655 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.656 ' HB3' ' H ' ' A' ' 118' ' ' SER . 19.5 t -86.82 163.95 16.93 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 106.442 -1.688 . . . . 10.0 106.442 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.439 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 1.1 m -99.2 24.86 7.41 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 179.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -159.73 -48.25 0.05 Allowed 'General case' 0 C--N 1.344 0.344 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.13 -81.68 0.27 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.656 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 23.5 m 96.8 83.37 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.015 1.326 . . . . 10.0 110.949 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.0 t -136.26 92.74 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.09 -0.959 . . . . 10.0 108.528 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -44.53 9.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.369 -1.287 . . . . 10.0 113.053 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -91.7 87.93 6.5 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.894 0.378 . . . . 10.0 110.047 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.563 ' HB ' ' CD1' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -100.61 119.58 38.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.411 0.625 . . . . 10.0 111.31 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.494 HG23 ' C7 ' ' C' ' 31' ' ' ' DT' . 8.5 tp -62.99 -7.94 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 114.595 -1.184 . . . . 10.0 112.242 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.501 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 1.8 tpt180 -178.15 109.68 0.06 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.563 ' CD1' ' HB ' ' A' ' 122' ' ' THR . 27.9 m95 -79.2 176.97 9.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.652 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.693 HH21 HD12 ' A' ' 134' ' ' ILE . 0.1 OUTLIER -162.68 17.62 0.08 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.873 0.844 . . . . 10.0 110.659 -178.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.445 HD21 ' HB3' ' A' ' 125' ' ' TRP . 0.8 OUTLIER -44.11 -40.29 4.82 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.025 -0.989 . . . . 10.0 113.018 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.407 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.3 tp 45.47 80.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.829 1.252 . . . . 10.0 111.992 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -30.51 92.38 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.456 1.102 . . . . 10.0 113.442 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.4 p -149.41 -80.23 0.13 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.336 -0.393 . . . . 10.0 112.043 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.64 -71.59 0.71 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.5 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -159.69 0.58 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.242 -1.022 . . . . 10.0 108.242 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.7 84.45 0.15 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.549 -0.834 . . . . 10.0 111.27 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.693 HD12 HH21 ' A' ' 126' ' ' ARG . 15.0 mt -80.26 82.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.286 0.565 . . . . 10.0 109.964 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.58 -43.87 80.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.604 -1.18 . . . . 10.0 113.289 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.484 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.5 p -66.28 173.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.961 1.362 . . . . 10.0 113.143 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.532 ' O ' HG12 ' A' ' 141' ' ' ILE . 19.6 p-10 -112.58 -14.94 13.13 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-N 112.762 -2.017 . . . . 10.0 108.783 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -69.83 -47.9 61.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.667 -0.697 . . . . 10.0 112.072 -178.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 32.2 m -54.8 -46.79 74.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 111.981 0.363 . . . . 10.0 111.981 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -72.17 -55.96 6.37 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.083 0.771 . . . . 10.0 113.083 -177.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.842 HG22 ' H71' ' C' ' 29' ' ' ' DT' . 12.2 mm -64.31 -41.61 92.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 -177.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.624 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.68 -32.56 73.3 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.878 0.37 . . . . 10.0 110.428 -179.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -66.03 -18.21 65.19 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.786 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.524 HH12 ' N6 ' ' B' ' 12' ' ' ' DA' . 41.2 ttp180 -48.49 -44.8 36.18 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.695 178.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -86.75 -30.66 21.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.108 0.48 . . . . 10.0 110.206 178.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -84.8 18.03 2.57 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.363 0.505 . . . . 10.0 112.363 -177.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -128.23 -35.79 1.98 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.501 0.667 . . . . 10.0 109.562 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -162.93 -176.68 5.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.26 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 10.3 t -67.3 123.49 20.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.153 0.502 . . . . 10.0 110.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.587 ' HB3' ' HG2' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -51.57 118.51 11.4 Favored Pre-proline 0 C--O 1.236 0.374 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.184 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -45.5 136.54 11.92 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.496 2.798 . . . . 10.0 113.478 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.409 ' H ' HG23 ' A' ' 152' ' ' VAL . 2.9 t -63.89 -16.57 18.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.001 -0.999 . . . . 10.0 112.076 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.56 -55.27 33.96 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 121.336 -0.146 . . . . 10.0 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.519 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -58.85 -32.94 69.9 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 177.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 96.2 t -66.76 -48.43 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 O-C-N 123.892 0.745 . . . . 10.0 110.781 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.414 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.45 -38.73 30.62 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.855 179.007 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.543 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 28.2 mmtp -83.3 -24.48 32.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.754 -0.378 . . . . 10.0 111.253 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.535 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 46.0 t80 -51.27 -36.71 43.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.624 0.726 . . . . 10.0 109.712 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 39.0 mt-30 -47.18 -24.94 0.79 Allowed 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 113.878 -1.51 . . . . 10.0 111.927 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -49.67 -44.47 47.83 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.121 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.601 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.5 OUTLIER -92.05 -15.65 27.54 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.652 0.739 . . . . 10.0 111.096 179.167 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 22.3 tttm -92.73 -6.04 49.97 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.442 1.097 . . . . 10.0 112.685 -178.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 13.5 mt -54.09 16.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.869 1.803 . . . . 10.0 115.869 -175.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' A' ' 162' ' ' LYS . 59.2 mttm -62.16 -37.09 83.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.794 0.724 . . . . 10.0 109.534 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 3.9 p -153.22 116.61 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.496 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.595 179.712 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.654 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 100.592 -1.506 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.724 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.212 -1.777 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.724 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 98.917 -2.702 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.598 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.542 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 C3'-C2'-C1' 99.157 -2.531 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.535 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.342 -2.398 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.428 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.785 -2.104 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.518 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 O4'-C1'-N19 109.091 1.614 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.842 ' H71' HG22 ' A' ' 141' ' ' ILE . . . . . . . . 0 P--O3' 1.617 0.815 0 C3'-C2'-C1' 98.895 -2.718 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.619 ' N6 ' HG21 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C3'-C2'-C1' 100.42 -1.628 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.575 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 C3'-C2'-C1' 99.652 -2.177 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.554 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.566 0 C3'-C2'-C1' 99.284 -2.44 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 100.197 -1.788 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.509 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 99.568 -2.237 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.569 H2'' ' H71' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 99.715 -2.132 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.63 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.733 0 C3'-C2'-C1' 100.622 -1.484 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.63 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 O4'-C1'-C2' 104.237 -1.693 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.511 H2'' ' C5 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 N19-C1'-C2' 116.946 1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.594 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.769 0 C3'-C2'-C1' 101.292 -1.006 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.594 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 OP1-P-O3' 109.063 0.52 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.471 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 100.222 -1.77 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.618 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 P--O3' 1.615 0.657 0 C3'-C2'-C1' 100.958 -1.244 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.618 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 100.912 -1.277 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.59 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 C3'-C2'-C1' 100.667 -1.452 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.59 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 100.443 -1.612 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.644 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C3'-C2'-C1' 100.697 -1.431 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.644 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.828 0 C3'-C2'-C1' 99.097 -2.574 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.421 ' C6 ' ' C6 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.736 0 C3'-C2'-C1' 99.998 -1.93 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.438 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C3'-C2'-C1' 99.084 -2.583 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.877 0 C3'-C2'-C1' 101.298 -1.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.495 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.953 -1.962 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.543 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.841 -2.042 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.519 ' N4 ' ' HB1' ' A' ' 154' ' ' ALA . . . . . . . . 0 O5'--C5' 1.426 -0.889 0 O4'-C1'-C2' 104.276 -1.658 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.601 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.871 -2.021 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.574 ' H72' ' C6 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 100.134 -1.833 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.514 ' H71' HH12 ' A' ' 161' ' ' ARG . . . . . . . . 0 C4'--C3' 1.537 0.912 0 C3'-C2'-C1' 99.908 -1.994 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.807 0 C3'-C2'-C1' 99.638 -2.187 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.59 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 O4'-C1'-C2' 105.029 -0.973 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.656 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.268 -1.023 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.656 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 OP1-P-O3' 109.625 0.695 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.625 0.25 . . . . 10.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -121.9 -102.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.198 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.548 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.8 mt-30 168.26 165.91 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.696 ' HB3' ' H ' ' A' ' 118' ' ' SER . 40.0 t -83.33 169.44 15.65 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 107.271 -1.381 . . . . 10.0 107.271 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.467 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 10.2 m -102.5 20.61 16.73 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.216 -1.031 . . . . 10.0 108.216 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -156.11 -43.41 0.08 Allowed 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.664 -0.865 . . . . 10.0 108.664 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 73.3 m -90.07 -79.03 0.35 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.862 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.696 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 8.6 m 87.76 82.08 0.01 OUTLIER 'General case' 0 C--O 1.234 0.281 0 O-C-N 124.727 1.267 . . . . 10.0 110.593 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 4.5 m -138.38 102.72 2.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 114.488 -1.233 . . . . 10.0 109.207 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 p -51.4 -31.88 24.25 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.558 -0.746 . . . . 10.0 111.895 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -94.49 79.37 3.85 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.757 0.313 . . . . 10.0 110.577 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.414 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.85 113.51 25.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.165 0.507 . . . . 10.0 111.685 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.404 HD13 " H2'" ' C' ' 30' ' ' ' DA' . 10.9 tt -51.47 -23.47 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.07 -0.968 . . . . 10.0 112.681 179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.53 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.8 tpt180 -168.27 113.16 0.64 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.512 -1.292 . . . . 10.0 107.512 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.685 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 33.3 m95 -77.84 179.94 6.39 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.511 0.507 . . . . 10.0 111.653 -177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.405 ' HD3' ' CG ' ' A' ' 140' ' ' PHE . 51.6 ttt180 -172.27 26.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.331 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -41.98 -33.92 0.62 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 114.877 -1.056 . . . . 10.0 111.845 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 6.1 tt 45.24 79.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.604 1.162 . . . . 10.0 112.493 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -33.19 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 114.62 -1.173 . . . . 10.0 113.008 177.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 4.2 m -145.95 -84.82 0.12 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.963 0.411 . . . . 10.0 110.269 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.41 ' H ' ' HB2' ' A' ' 130' ' ' SER . 7.5 ttmt -129.84 -64.28 0.88 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -88.88 -168.55 2.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -152.01 88.41 0.13 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 119.997 -1.097 . . . . 10.0 111.532 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.71 81.72 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.72 0.771 . . . . 10.0 109.117 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -57.42 -41.54 80.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.205 -1.361 . . . . 10.0 111.823 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.555 ' N ' HE21 ' A' ' 135' ' ' GLN . 1.0 OUTLIER -69.15 173.92 5.14 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 122.335 1.064 . . . . 10.0 112.726 -178.481 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -113.21 -8.57 13.53 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 113.918 -1.492 . . . . 10.0 109.707 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.521 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -74.3 -50.49 18.65 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.721 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 92.7 m -60.26 -46.31 90.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.128 0.489 . . . . 10.0 111.966 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.405 ' CG ' ' HD3' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -72.26 -47.09 52.83 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.6 0.963 . . . . 10.0 113.6 -176.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.535 HD11 ' N6 ' ' B' ' 10' ' ' ' DA' . 12.1 mt -80.04 -35.38 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.567 0.951 . . . . 10.0 113.567 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.521 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.89 -32.76 72.64 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.455 -0.498 . . . . 10.0 110.32 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.04 -12.61 19.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.794 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 53.3 mtm180 -43.41 -50.46 6.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 3.9 tmtt? -89.3 -28.46 19.86 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.137 0.494 . . . . 10.0 112.138 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -81.97 -16.25 51.02 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.318 1.229 . . . . 10.0 114.318 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -105.08 -47.1 4.08 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.324 -0.55 . . . . 10.0 109.844 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -150.99 -165.55 2.3 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.032 -0.985 . . . . 10.0 110.911 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 99.01 2.85 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.262 -0.881 . . . . 10.0 111.978 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 5.9 ptp85 -56.03 138.28 72.61 Favored Pre-proline 0 C--O 1.233 0.205 0 O-C-N 123.003 0.189 . . . . 10.0 110.814 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 37.7 Cg_exo -60.17 126.26 19.72 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.576 2.184 . . . . 10.0 112.435 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.402 ' O ' ' HB ' ' A' ' 155' ' ' VAL . 2.0 t -65.8 -11.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.481 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -52.51 47.57 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.62 -0.264 . . . . 10.0 111.623 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.29 -28.82 65.33 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.057 0.392 . . . . 10.0 112.057 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.638 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 87.5 t -68.75 -41.87 82.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.13 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.69 -46.62 50.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.802 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.53 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.3 OUTLIER -81.65 -24.71 36.15 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.458 178.811 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.638 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 1.0 OUTLIER -52.28 -41.45 62.89 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.596 178.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.508 ' O ' ' HG ' ' A' ' 163' ' ' LEU . 8.5 tp-100 -46.81 -23.62 0.46 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.827 -1.079 . . . . 10.0 112.246 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 163' ' ' LEU . 16.4 ttpt -46.71 -37.28 8.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.655 0.597 . . . . 10.0 111.215 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.733 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 1.5 tmt_? -89.54 -30.15 18.42 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.729 0.776 . . . . 10.0 110.545 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 159' ' ' GLN . 1.7 ttpp -77.41 -9.86 59.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.275 -0.875 . . . . 10.0 112.884 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 159' ' ' GLN . 40.5 mt -68.39 16.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.173 0.805 . . . . 10.0 113.173 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 162' ' ' LYS . 12.8 ttpt -62.07 -33.59 74.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.9 0.381 . . . . 10.0 110.026 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 2.7 p -147.69 121.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.114 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.774 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.502 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.513 -0.556 0 C3'-C2'-C1' 100.094 -1.861 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.53 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.314 -1.704 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.692 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 C3'-C2'-C1' 99.517 -2.274 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.692 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.511 -0.716 0 C3'-C2'-C1' 100.276 -1.731 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.488 -2.294 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.462 ' C8 ' " H1'" ' C' ' 25' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 100.028 -1.909 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.464 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.041 0 C3'-C2'-C1' 100.029 -1.908 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.464 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 O4'-C1'-N19 109.134 1.667 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.439 -2.329 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.519 ' C8 ' H2'' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.664 0 C3'-C2'-C1' 99.708 -2.137 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.624 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.691 0 O4'-C1'-C2' 104.249 -1.683 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.624 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.511 -0.731 0 C3'-C2'-C1' 99.537 -2.26 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.566 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 C3'-C2'-C1' 100.157 -1.816 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.603 H2'' ' C6 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 100.113 -1.848 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.603 ' C6 ' H2'' ' C' ' 34' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.082 0 C3'-C2'-C1' 100.442 -1.613 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.59 ' H71' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 100.43 -1.621 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.593 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 100.923 -1.269 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.593 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 105.027 -0.975 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.531 H2'' ' C8 ' ' C' ' 40' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 C3'-C2'-C1' 100.491 -1.578 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.531 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C1'-O4'-C4' 110.556 0.611 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.548 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 100.471 -1.592 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.548 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.729 0 C3'-C2'-C1' 99.856 -2.031 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.489 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C5'-C4'-C3' 116.451 1.167 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.582 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.791 0 C3'-C2'-C1' 99.771 -2.092 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.585 H2'' ' C8 ' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 C3'-C2'-C1' 100.308 -1.708 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.592 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C3'-C2'-C1' 99.456 -2.317 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.592 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.673 -2.877 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.755 0 C3'-C2'-C1' 99.43 -2.336 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.502 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 C3'-C2'-C1' 99.761 -2.099 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.628 H2'' ' C7 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 C3'-C2'-C1' 100.308 -1.709 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.628 ' C7 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 98.547 -2.966 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.695 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C3'-C2'-C1' 100.365 -1.668 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.695 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.733 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 100.593 -1.505 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.514 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.506 -1.104 0 C3'-C2'-C1' 100.107 -1.852 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.659 ' H71' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 C3'-C2'-C1' 98.702 -2.856 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.649 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 C3'-C2'-C1' 100.716 -1.417 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.649 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C3'-C2'-C1' 101.364 -0.954 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.587 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 99.976 -1.946 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.565 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C4'-C3'-C2' 103.8 0.6 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.208 0.528 . . . . 10.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -91.84 -94.78 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.366 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 1.3 mt-30 164.2 167.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.948 0.899 . . . . 10.0 109.043 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.671 ' HB3' ' H ' ' A' ' 118' ' ' SER . 18.9 t -90.51 164.29 14.3 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 106.939 -1.504 . . . . 10.0 106.939 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 35.4 m -98.59 25.64 6.26 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.458 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 3.1 m-80 -161.64 -40.07 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 118' ' ' SER . 74.4 m -98.8 -79.65 0.47 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 113.715 1.006 . . . . 10.0 113.715 -177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.671 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 70.2 m 95.26 85.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 O-C-N 125.103 1.502 . . . . 10.0 109.822 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 58.1 t -132.97 85.18 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.619 -1.173 . . . . 10.0 108.409 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -40.23 -50.06 2.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.013 -0.994 . . . . 10.0 113.405 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.58 83.35 4.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.27 126.27 37.28 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.614 0.598 . . . . 10.0 112.614 -178.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.522 HG23 ' C7 ' ' C' ' 31' ' ' ' DT' . 12.9 tt -62.53 -13.02 10.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 114.833 -1.076 . . . . 10.0 112.534 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.485 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 2.0 tpt180 -176.38 113.22 0.11 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.564 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 36.8 m95 -80.51 172.72 13.39 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.527 -178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.413 ' HB2' ' H73' ' B' ' 9' ' ' ' DT' . 0.0 OUTLIER -161.65 13.88 0.09 Allowed 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.76 0.791 . . . . 10.0 111.101 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.426 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 2.5 m-80 -38.01 -44.23 0.79 Allowed 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.633 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.439 ' H ' ' P ' ' B' ' 8' ' ' ' DG' . 7.1 tp 45.59 75.07 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 10.0 111.685 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -29.69 98.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 114.031 -1.44 . . . . 10.0 113.301 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 6.9 p -146.43 -75.03 0.21 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.873 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.71 -68.88 0.63 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -87.12 -163.53 0.94 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.335 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.15 95.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.782 -0.927 . . . . 10.0 110.782 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.426 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 57.0 mt -87.43 81.68 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.571 0.701 . . . . 10.0 109.906 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.564 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -58.97 -43.94 91.45 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.065 -0.97 . . . . 10.0 112.854 -179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.478 ' CA ' HE21 ' A' ' 135' ' ' GLN . 1.7 p -67.03 173.78 3.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.495 1.14 . . . . 10.0 113.024 -177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -113.23 -9.05 13.49 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.396 -1.729 . . . . 10.0 109.7 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.599 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.36 -49.89 24.88 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.546 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 90.0 m -59.05 -42.74 91.01 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 120.85 0.357 . . . . 10.0 111.405 -178.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -71.38 -55.58 7.69 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.159 1.17 . . . . 10.0 114.159 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.496 HG21 ' N6 ' ' C' ' 30' ' ' ' DA' . 2.7 mm -73.42 -38.27 52.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 -176.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.599 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.05 -30.86 71.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.82 0.343 . . . . 10.0 110.727 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -66.52 -16.42 64.13 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.059 0.763 . . . . 10.0 113.059 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.427 ' HD3' ' H71' ' B' ' 11' ' ' ' DT' . 69.3 mtm180 -49.02 -45.33 42.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 117.924 0.329 . . . . 10.0 111.61 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.706 ' HZ2' " H2'" ' C' ' 27' ' ' ' DA' . 0.0 OUTLIER -85.79 -28.95 24.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.704 0.288 . . . . 10.0 110.979 -179.699 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -87.36 18.34 3.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.879 0.326 . . . . 10.0 111.879 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -134.95 -39.49 0.77 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.0 pttt -149.54 179.46 7.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.25 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.7 m -64.39 121.26 13.93 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.96 127.38 3.25 Favored Pre-proline 0 N--CA 1.454 -0.24 0 O-C-N 124.246 0.966 . . . . 10.0 110.826 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.99 135.07 53.09 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.674 2.249 . . . . 10.0 113.195 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -71.59 -17.34 19.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 114.735 -1.121 . . . . 10.0 110.78 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 1.2 p -51.97 -52.65 48.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.99 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.53 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -73.28 -24.46 60.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.023 -0.535 . . . . 10.0 112.238 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.663 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 38.3 t -69.19 -42.55 81.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -47.37 54.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.16 -0.927 . . . . 10.0 111.748 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.531 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 21.5 mmtp -82.61 -22.77 34.65 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.602 -0.439 . . . . 10.0 110.477 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.663 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 3.4 t80 -50.2 -43.29 52.55 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.449 0.642 . . . . 10.0 110.399 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -49.17 -26.9 3.13 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.393 -1.276 . . . . 10.0 111.66 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 15.1 ttpt -48.5 -28.67 3.49 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 124.177 0.923 . . . . 10.0 112.026 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.677 ' HB2' ' H72' ' B' ' 14' ' ' ' DT' . 0.9 OUTLIER -77.52 -32.75 54.29 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.982 -0.449 . . . . 10.0 110.964 179.339 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.2 mtpt -88.35 -39.32 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.022 0.439 . . . . 10.0 110.998 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 18.9 mt -42.19 -39.62 2.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 114.678 -1.146 . . . . 10.0 112.698 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -71.66 -86.0 0.03 OUTLIER 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.518 -0.473 . . . . 10.0 110.922 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 79.2 t -149.82 114.25 0.66 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.372 0.129 . . . . 10.0 110.934 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 C--N 1.327 -0.399 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 177.844 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.537 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 100.226 -1.767 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.693 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C3'-C2'-C1' 99.797 -2.073 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.693 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 100.413 -1.634 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.678 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.067 -1.881 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.531 -2.263 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.521 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 O4'--C4' 1.455 0.809 0 C3'-C2'-C1' 98.369 -3.094 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.706 " H2'" ' HZ2' ' A' ' 145' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 O4'-C1'-C2' 104.755 -1.222 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.86 0 O4'-C1'-C2' 104.303 -1.633 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.505 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 99.525 -2.268 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.571 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.626 0 C3'-C2'-C1' 100.194 -1.79 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.571 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.912 0 C3'-C2'-C1' 99.293 -2.434 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.493 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.944 0 C3'-C2'-C1' 98.896 -2.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.493 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.726 -2.124 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.467 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 C3'-C2'-C1' 99.866 -2.024 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.568 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.831 0 C3'-C2'-C1' 100.326 -1.696 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.568 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.751 0 N19-C1'-C2' 115.771 0.982 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.564 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 100.522 -1.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.568 H2'' ' C6 ' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.847 -1.139 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 100.861 -1.313 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.568 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C5'-C4'-C3' 116.049 0.9 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.718 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 100.141 -1.828 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.718 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 100.138 -1.83 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.643 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 C3'-C2'-C1' 99.904 -1.997 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.643 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 99.672 -2.163 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.58 0 C3'-C2'-C1' 99.63 -2.193 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.566 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 C3'-C2'-C1' 99.326 -2.41 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 98.505 -2.996 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.439 ' P ' ' H ' ' A' ' 128' ' ' ILE . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.573 -2.233 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.508 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.816 0 C3'-C2'-C1' 99.479 -2.3 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.508 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.803 0 C3'-C2'-C1' 100.714 -1.419 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.516 H2'' ' C8 ' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.133 0 C3'-C2'-C1' 99.689 -2.151 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.531 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 100.063 -1.884 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.763 H2'' ' H71' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.906 0 O4'-C1'-C2' 104.619 -1.347 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.763 ' H71' H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.8 0 C3'-C2'-C1' 99.204 -2.497 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.565 ' H72' ' NH1' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.506 -1.075 0 C3'-C2'-C1' 99.435 -2.332 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.478 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.783 -2.106 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.592 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.834 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.592 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 101.407 -0.923 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.622 H2'' ' C8 ' ' B' ' 20' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 101.381 -0.942 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.622 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C5'-C4'-O4' 108.229 -0.732 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 120.526 0.203 . . . . 10.0 111.16 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -167.73 151.17 6.11 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.764 -0.458 . . . . 10.0 109.764 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 118' ' ' SER . 19.4 pm0 -66.46 -179.25 0.79 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.251 0.548 . . . . 10.0 111.488 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.61 ' CA ' ' HB3' ' A' ' 135' ' ' GLN . 30.9 t -77.47 -178.41 5.21 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.282 -1.007 . . . . 10.0 108.282 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.521 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 5.1 m -108.65 20.27 18.73 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.437 ' HB2' ' SG ' ' A' ' 139' ' ' CYS . 2.5 m-80 -158.96 -41.65 0.06 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 114.931 -1.031 . . . . 10.0 108.401 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 74.4 m -93.48 -131.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.398 -0.819 . . . . 10.0 112.808 -178.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 113' ' ' GLN . 0.6 OUTLIER 162.18 63.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.126 0.891 . . . . 10.0 111.269 -178.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 t -132.77 85.72 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.011 0.434 . . . . 10.0 110.94 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.61 -47.17 10.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.733 -1.121 . . . . 10.0 112.816 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.96 81.13 8.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.089 -0.708 . . . . 10.0 109.089 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.5 OUTLIER -86.72 120.62 28.21 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 113.182 0.808 . . . . 10.0 113.182 -178.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 2.0 tp -54.82 -10.93 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 114.124 -1.398 . . . . 10.0 112.24 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.556 HH21 ' H42' ' C' ' 33' ' ' ' DC' . 4.0 mmt-85 174.51 112.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 62.2 m95 -71.57 176.48 4.73 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.379 0.511 . . . . 10.0 112.379 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.515 ' CZ ' " H2'" ' B' ' 9' ' ' ' DT' . 3.2 tpt180 -162.4 14.76 0.08 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.002 0.43 . . . . 10.0 111.471 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.421 ' HA ' ' N ' ' A' ' 134' ' ' ILE . 3.1 m-80 -42.88 -38.19 2.09 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 4.4 tt 45.94 76.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 124.659 1.224 . . . . 10.0 110.794 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -28.51 91.96 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.768 1.227 . . . . 10.0 113.588 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.9 m -148.2 -77.35 0.16 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.929 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -131.71 -68.44 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.86 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -84.19 -169.06 2.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.536 -0.756 . . . . 10.0 109.575 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.07 89.07 0.17 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.783 -0.927 . . . . 10.0 110.783 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.421 ' N ' ' HA ' ' A' ' 127' ' ' ASN . 33.1 mt -78.67 71.08 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.396 0.617 . . . . 10.0 109.866 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.61 ' HB3' ' CA ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -44.26 -49.24 9.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.403 -1.271 . . . . 10.0 113.467 -179.682 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.465 ' CA ' HE21 ' A' ' 135' ' ' GLN . 2.4 p -71.24 177.92 3.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 122.714 1.245 . . . . 10.0 113.873 -176.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -115.6 -9.46 12.0 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.388 -1.733 . . . . 10.0 110.231 177.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.506 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.46 -48.93 29.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.24 -178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 116' ' ' ASN . 57.5 m -53.79 -49.48 68.2 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.27 0.841 . . . . 10.0 113.27 -177.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -46.75 38.05 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 -177.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.629 HD13 ' N6 ' ' C' ' 30' ' ' ' DA' . 74.6 mt -75.69 -38.13 37.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 113.732 1.012 . . . . 10.0 113.732 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.11 -31.88 70.89 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.753 -0.592 . . . . 10.0 110.225 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -60.6 -14.77 22.21 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.632 ' HD3' ' C7 ' ' B' ' 11' ' ' ' DT' . 78.7 mtm180 -45.74 -50.9 13.35 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 111.992 0.367 . . . . 10.0 111.992 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.43 -30.58 19.34 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.578 -0.449 . . . . 10.0 111.336 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -80.78 5.24 16.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.559 0.948 . . . . 10.0 113.559 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -134.43 -35.11 0.92 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.941 0.4 . . . . 10.0 110.164 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -150.61 -173.63 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.123 0.487 . . . . 10.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 3.2 m -71.95 104.73 3.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.077 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 151' ' ' PRO . 8.5 ptt180 -43.8 135.72 3.68 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 115.609 -0.723 . . . . 10.0 112.727 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 150' ' ' ARG . 38.2 Cg_exo -56.63 124.2 15.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.895 2.396 . . . . 10.0 111.435 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 4.8 t -65.04 -18.6 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.884 -0.598 . . . . 10.0 111.717 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -52.01 49.98 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.819 0.342 . . . . 10.0 111.506 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.512 ' HB1' ' N4 ' ' B' ' 13' ' ' ' DC' . . . -64.17 -28.09 69.52 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 25.8 t -71.6 -44.2 70.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 123.509 0.506 . . . . 10.0 110.104 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -36.38 44.88 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.563 0.221 . . . . 10.0 110.734 178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.565 ' HG2' " H3'" ' B' ' 12' ' ' ' DA' . 0.8 OUTLIER -81.87 -24.11 35.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.671 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' A' ' 155' ' ' VAL . 44.8 t80 -52.66 -35.43 55.05 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 162' ' ' LYS . 5.7 tp-100 -45.55 -28.24 0.9 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.752 -1.113 . . . . 10.0 111.774 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.407 ' O ' HD22 ' A' ' 163' ' ' LEU . 0.8 OUTLIER -50.0 -44.09 50.88 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.813 178.377 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.642 ' HB2' ' H73' ' B' ' 14' ' ' ' DT' . 0.7 OUTLIER -89.58 -33.66 16.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.365 0.602 . . . . 10.0 109.723 179.025 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 159' ' ' GLN . 29.1 tttp -66.89 -8.21 27.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.137 -0.938 . . . . 10.0 111.942 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 160' ' ' LYS . 0.5 OUTLIER -55.61 -8.28 0.36 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.369 0.507 . . . . 10.0 112.369 -177.566 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -59.96 -28.13 67.4 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 4.8 p -49.64 161.48 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 123.893 0.746 . . . . 10.0 112.087 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.953 -178.694 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.47 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.027 -1.909 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.679 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C3'-C2'-C1' 100.493 -1.576 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.689 H2'' ' C8 ' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 99.495 -2.289 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.689 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.756 -2.103 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 99.173 -2.519 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.489 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.506 -1.101 0 C3'-C2'-C1' 98.311 -3.135 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.449 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.955 0 O4'-C1'-C2' 104.211 -1.717 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.482 H2'' ' C6 ' ' C' ' 29' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.735 0 O4'-C1'-N19 108.81 1.262 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.482 ' C6 ' H2'' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 99.306 -2.424 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.629 ' N6 ' HD13 ' A' ' 141' ' ' ILE . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 C3'-C2'-C1' 99.854 -2.033 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.566 H2'' ' C8 ' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.704 0 C3'-C2'-C1' 100.023 -1.912 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.566 ' C8 ' H2'' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 99.47 -2.307 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.559 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.795 0 C3'-C2'-C1' 99.474 -2.304 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.566 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.63 0 O4'-C1'-C2' 104.109 -1.81 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.641 H2'' ' C6 ' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 C3'-C2'-C1' 100.385 -1.654 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.641 ' C6 ' H2'' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.945 0 C3'-C2'-C1' 100.446 -1.61 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.534 H2'' ' C6 ' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C3'-C2'-C1' 99.599 -2.215 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.534 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C3'-C2'-C1' 100.298 -1.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 99.775 -2.089 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.433 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C3'-C2'-C1' 101.775 -0.66 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.527 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 C3'-C2'-C1' 100.654 -1.461 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.527 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 99.494 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.625 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.69 0 C3'-C2'-C1' 101.514 -0.847 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.625 ' C8 ' H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 100.093 -1.862 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 99.934 -1.976 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.639 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 99.896 -2.003 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.639 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C3'-C2'-C1' 99.05 -2.607 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.417 ' C5 ' ' C2 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C3'-C2'-C1' 98.736 -2.831 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.63 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 O4'-C1'-C2' 103.948 -1.956 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' B' ' 9' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.726 0 O4'-C1'-C2' 104.848 -1.138 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.632 ' C7 ' ' HD3' ' A' ' 144' ' ' ARG . . . . . . . . 0 O4'--C4' 1.457 0.961 0 C3'-C2'-C1' 98.057 -3.316 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.643 H2'' ' C6 ' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.563 -1.527 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.643 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.957 0 C3'-C2'-C1' 100.739 -1.401 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.642 ' H73' ' HB2' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.837 0 C3'-C2'-C1' 100.215 -1.775 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.483 ' H71' ' CZ ' ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 100.172 -1.806 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.573 ' H73' HH22 ' A' ' 161' ' ' ARG . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 99.92 -1.986 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.543 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.928 0 C3'-C2'-C1' 100.058 -1.887 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.626 H2'' ' C6 ' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 C4'-C3'-C2' 103.875 0.675 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.626 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C3'-C2'-C1' 99.899 -2.001 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.536 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-O4' 108.254 -0.716 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 113' ' ' GLN . 25.6 t80 -89.33 -98.06 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.897 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.534 ' C ' ' HB3' ' A' ' 135' ' ' GLN . 0.4 OUTLIER 165.52 165.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.058 -1.089 . . . . 10.0 108.058 -178.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.644 ' HB3' ' H ' ' A' ' 118' ' ' SER . 41.7 t -86.59 166.86 15.07 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 107.123 -1.436 . . . . 10.0 107.123 179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.436 ' N ' ' SG ' ' A' ' 114' ' ' CYS . 0.9 OUTLIER -103.17 25.72 9.13 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -159.86 -44.46 0.05 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.746 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 61.4 m -93.82 -78.21 0.44 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.551 0.945 . . . . 10.0 113.551 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.644 ' H ' ' HB3' ' A' ' 114' ' ' CYS . 22.7 m 93.26 83.89 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 O-C-N 124.806 1.316 . . . . 10.0 109.84 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 49.4 t -135.4 91.5 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.977 -1.011 . . . . 10.0 108.931 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -46.92 -40.41 14.11 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.822 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -90.93 77.05 6.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.367 0.603 . . . . 10.0 110.304 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.472 HG21 ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -92.62 112.26 24.14 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.729 -179.298 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.02 -11.02 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 115.298 -0.864 . . . . 10.0 112.964 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.519 ' HB2' ' C7 ' ' C' ' 31' ' ' ' DT' . 1.5 tpt180 -176.5 111.9 0.1 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.062 -1.088 . . . . 10.0 108.062 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.639 ' HA ' ' O ' ' A' ' 135' ' ' GLN . 34.5 m95 -78.9 176.42 9.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.923 -0.581 . . . . 10.0 112.139 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.425 ' HB2' ' H73' ' B' ' 9' ' ' ' DT' . 0.1 OUTLIER -164.55 16.55 0.05 Allowed 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.393 0.615 . . . . 10.0 111.362 -179.441 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -42.3 -42.83 3.25 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 114.909 -1.041 . . . . 10.0 112.154 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 128' ' ' ILE . 8.8 tp 47.15 78.73 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 124.452 1.095 . . . . 10.0 111.752 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -30.34 96.82 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.771 -1.104 . . . . 10.0 112.738 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.0 p -146.92 -82.79 0.13 Allowed 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.055 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.19 -55.86 0.81 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.478 -0.934 . . . . 10.0 108.478 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -91.0 -173.6 3.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.928 -1.138 . . . . 10.0 107.928 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -155.22 78.71 0.19 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.356 -1.098 . . . . 10.0 110.356 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.454 HG23 ' SG ' ' A' ' 114' ' ' CYS . 81.8 mt -80.38 86.45 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.683 0.754 . . . . 10.0 110.705 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -56.17 -43.57 78.51 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.46 -1.246 . . . . 10.0 113.614 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' CYS . . . . . 0.445 ' CA ' HE21 ' A' ' 135' ' ' GLN . 0.8 OUTLIER -65.98 172.97 3.26 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.432 1.11 . . . . 10.0 112.736 -176.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -113.26 -8.97 13.48 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.683 -1.599 . . . . 10.0 109.897 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 142' ' ' TYR . . . -73.41 -48.66 32.11 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.744 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 143' ' ' GLN . 57.1 m -56.01 -48.04 76.65 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -72.15 -55.25 7.6 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.88 0.696 . . . . 10.0 112.88 -178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.607 HG21 ' H62' ' C' ' 30' ' ' ' DA' . 12.2 mm -62.51 -44.74 99.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 113.546 0.943 . . . . 10.0 113.546 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.86 -33.05 74.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.144 0.497 . . . . 10.0 110.512 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 139' ' ' CYS . 2.5 mt-30 -62.44 -21.38 65.38 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.074 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.446 ' HD3' ' H72' ' B' ' 11' ' ' ' DT' . 24.0 ttp180 -47.59 -44.24 26.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.264 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 145' ' ' LYS . 0.0 OUTLIER -86.75 -31.69 20.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.188 0.518 . . . . 10.0 110.664 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -88.44 20.15 3.49 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.481 ' OD1' ' HG2' ' A' ' 148' ' ' LYS . 18.2 t-20 -134.17 -40.77 0.82 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.419 0.628 . . . . 10.0 109.314 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.481 ' HG2' ' OD1' ' A' ' 147' ' ' ASN . 1.7 pttm -154.45 -177.67 6.63 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.284 -0.871 . . . . 10.0 109.663 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 9.1 t -71.7 119.77 16.35 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.407 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 150' ' ' ARG . 0.0 OUTLIER -52.86 126.1 41.05 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.627 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.432 ' HD2' ' HD2' ' A' ' 144' ' ' ARG . 72.7 Cg_exo -50.18 137.93 37.26 Favored 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 123.172 2.581 . . . . 10.0 113.448 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 18.2 t -61.89 -18.29 19.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.922 -1.036 . . . . 10.0 111.485 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 17.2 p -58.47 -53.49 57.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.255 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' H41' ' B' ' 13' ' ' ' DC' . . . -57.51 -35.96 70.93 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.446 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.475 ' O ' ' HB3' ' A' ' 158' ' ' TYR . 61.9 t -69.04 -44.61 81.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.928 0.394 . . . . 10.0 110.156 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' A' ' 157' ' ' LYS . 0.0 OUTLIER -49.24 -41.76 38.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.718 177.179 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.572 ' HG3' " O5'" ' B' ' 12' ' ' ' DA' . 28.3 mmtp -82.39 -23.43 34.95 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.739 -0.384 . . . . 10.0 110.93 178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' TYR . . . . . 0.571 ' HE2' ' N6 ' ' C' ' 26' ' ' ' DA' . 45.5 t80 -51.91 -38.02 54.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.624 -0.88 . . . . 10.0 108.624 177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.53 ' HA ' ' HB2' ' A' ' 162' ' ' LYS . 41.1 mt-30 -47.12 -25.0 0.77 Allowed 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 113.618 -1.628 . . . . 10.0 111.699 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 157' ' ' LYS . 32.8 tttt -50.24 -38.73 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.959 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.622 ' CZ ' ' H71' ' B' ' 15' ' ' ' DT' . 0.4 OUTLIER -92.11 -17.78 24.48 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.893 0.854 . . . . 10.0 110.851 179.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 159' ' ' GLN . 13.0 mtpt -93.45 -2.76 54.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.418 -1.265 . . . . 10.0 112.578 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.593 ' C ' ' H ' ' A' ' 165' ' ' VAL . 15.2 mt -43.41 22.46 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 117.585 2.439 . . . . 10.0 117.585 -177.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.471 ' H ' ' C ' ' A' ' 162' ' ' LYS . 15.4 mtmt -66.7 23.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.892 0.877 . . . . 10.0 110.866 177.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . 0.593 ' H ' ' C ' ' A' ' 163' ' ' LEU . 29.3 m -74.14 -165.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.284 -178.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.361 -179.941 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.526 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.434 -0.389 0 C3'-C2'-C1' 99.994 -1.933 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.647 H2'' ' C8 ' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.798 0 O4'-C1'-N19 108.894 1.368 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . 0.647 ' C8 ' H2'' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 C3'-C2'-C1' 100.013 -1.919 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' C' ' 23' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.453 0.658 0 C3'-C2'-C1' 99.681 -2.156 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' ' DA' . . . . . 0.514 ' C8 ' H2'' ' C' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.829 0 C3'-C2'-C1' 99.126 -2.553 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' ' DA' . . . . . 0.571 ' N6 ' ' HE2' ' A' ' 158' ' ' TYR . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.034 -2.619 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' ' DA' . . . . . 0.466 H2'' ' C8 ' ' C' ' 28' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.963 0 O4'-C1'-C2' 103.599 -2.273 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' ' DG' . . . . . 0.466 ' C8 ' H2'' ' C' ' 27' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 O4'-C1'-C2' 104.477 -1.475 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' ' DT' . . . . . 0.465 H2'' ' C8 ' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.495 -2.29 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' ' DA' . . . . . 0.682 H2'' ' C6 ' ' C' ' 31' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.934 0 C3'-C2'-C1' 100.331 -1.692 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' ' DT' . . . . . 0.682 ' C6 ' H2'' ' C' ' 30' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 99.218 -2.487 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' ' DA' . . . . . 0.689 H2'' ' C6 ' ' C' ' 33' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.772 0 C3'-C2'-C1' 99.122 -2.556 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' ' DC' . . . . . 0.689 ' C6 ' H2'' ' C' ' 32' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.059 -1.886 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' ' DT' . . . . . 0.499 H2'' ' C7 ' ' C' ' 35' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 O4'-C1'-C2' 104.473 -1.479 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' ' DT' . . . . . 0.557 H2'' ' H71' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 100.806 -1.353 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' ' DT' . . . . . 0.669 H2'' ' C6 ' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 C3'-C2'-C1' 100.769 -1.379 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' ' DT' . . . . . 0.669 ' C6 ' H2'' ' C' ' 36' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 100.261 -1.742 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' ' DC' . . . . . 0.532 ' C6 ' H2'' ' C' ' 37' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 C3'-C2'-C1' 100.373 -1.662 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' ' DC' . . . . . 0.48 ' C6 ' H2'' ' C' ' 38' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.173 -1.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' ' DG' . . . . . 0.46 ' C8 ' H2'' ' C' ' 39' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C4'-C3'-O3' 108.079 -1.009 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . 0.593 H2'' ' C8 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 100.478 -1.587 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.593 ' C8 ' H2'' ' B' ' 1' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 100.59 -1.507 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.606 H2'' ' C8 ' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.56 0 C3'-C2'-C1' 101.088 -1.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . 0.616 H2'' ' C8 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.649 -1.465 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 C3'-C2'-C1' 99.598 -2.216 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 5' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 99.669 -2.165 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.482 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.702 0 C3'-C2'-C1' 98.642 -2.898 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.874 0 C3'-C2'-C1' 99.502 -2.285 . . . . 10.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . 0.533 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 99.821 -2.057 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.604 H2'' ' C6 ' ' B' ' 11' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.846 0 C5'-C4'-C3' 115.907 0.805 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ' DT' . . . . . 0.604 ' C6 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.657 -2.174 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ' DA' . . . . . 0.572 " O5'" ' HG3' ' A' ' 157' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 100.394 -1.647 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.511 ' C6 ' H2'' ' B' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 O4'-C1'-C2' 103.943 -1.96 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.662 ' C6 ' ' H72' ' B' ' 15' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.99 0 C3'-C2'-C1' 99.688 -2.152 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ' DT' . . . . . 0.662 ' H72' ' C6 ' ' B' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 100.208 -1.78 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.47 H2'' ' C6 ' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.118 0 C3'-C2'-C1' 100.235 -1.761 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.617 H2'' ' C6 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.959 0 C3'-C2'-C1' 100.119 -1.844 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.617 ' C6 ' H2'' ' B' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 100.758 -1.387 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.454 0.769 0 C3'-C2'-C1' 100.254 -1.747 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.54 ' C8 ' H2'' ' B' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C5'-C4'-O4' 108.483 -0.573 . . . . 10.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_