data_1xce_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 1xce _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 full ' A' A ' 1' ' ' ' DG' . . . . . 0.673 ' C6 ' ' C4 ' ' A' ' 2' ' ' ' DC' . . . . . . . . 3 C2'--C1' 1.431 -6.422 5 C4'-C3'-C2' 91.715 -11.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' DC' . . . . . 0.957 " H2'" " O5'" ' A' ' 2' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.483 -4.483 6 P-O3'-C3' 135.647 13.289 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' DG' . . . . . 0.748 ' C8 ' H2'' ' A' ' 2' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.565 4.658 6 O4'-C1'-N19 100.799 -8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.438 ' C2 ' ' C4 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.441 -8.66 4 O4'-C1'-C2' 93.126 -11.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.719 " H2'" " O5'" ' A' ' 5' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.459 -6.888 9 P-O5'-C5' 103.77 -10.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' DT' . . . . . 0.61 H5'' ' OP1' ' A' ' 7' ' ' ' DG' . . . . . . . . 3 C4'--C3' 1.48 -4.778 7 O4'-C1'-C2' 77.435 -26.059 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' DG' . . . . . 0.752 " H1'" " O5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.478 -4.088 6 O4'-C1'-N19 119.145 14.181 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' DG' . . . . . 0.581 ' C8 ' " H2'" ' A' ' 7' ' ' ' DG' . . . . . . . . 3 C2'--C1' 1.45 -5.087 8 O4'-C1'-N19 118.523 13.404 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' DA' . . . . . 0.551 " H2'" " C3'" ' A' ' 10' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.459 -5.879 4 O4'-C1'-N19 117.038 11.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.551 " C3'" " H2'" ' A' ' 9' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.441 -8.701 4 O4'-C1'-N19 120.964 16.455 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . 0.752 " O5'" " H1'" ' A' ' 7' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.473 -4.699 3 C4'-C3'-C2' 88.039 -15.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . 0.734 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.5 -2.837 3 P-O3'-C3' 139.029 16.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' DG' . . . . . 0.734 ' C8 ' H2'' ' B' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.696 4 O4'-C1'-C2' 94.694 -10.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.555 " O5'" H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.484 -4.383 4 C4'-C3'-C2' 94.802 -8.398 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . 0.438 ' C6 ' ' N3 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.498 -1.65 3 O4'-C1'-N19 113.071 6.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ' DT' . . . . . 0.461 ' O2 ' " C2'" ' B' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.49 -3.816 7 O4'-C1'-C2' 92.362 -12.489 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.43 " H1'" H5'' ' A' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.429 -1.588 5 O4'-C1'-N19 115.101 9.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . 0.473 ' OP2' ' H8 ' ' B' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 2 O4'-C1'-N19 115.902 10.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.571 2 C4'-C3'-C2' 97.849 -5.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.497 -3.143 5 O4'-C1'-N19 115.983 10.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' ' DG' . . . . . 0.508 HO5' " C5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.404 -3.782 5 C4'-C3'-C2' 90.474 -12.726 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ' DC' . . . . . 0.718 H2'' ' C8 ' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.571 -2.182 3 P-O3'-C3' 136.726 14.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ' DG' . . . . . 0.718 ' C8 ' H2'' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.436 6 P-O3'-C3' 109.797 -8.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ' DG' . . . . . 0.507 " O5'" H2'' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.494 -3.38 5 C4'-C3'-C2' 96.689 -6.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.619 4 O4'-C1'-N19 113.879 7.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.424 ' O4 ' " H1'" ' C' ' 3' ' ' ' DG' . . . . . . . . 1 C2'--C1' 1.457 -4.6 5 O4'-C1'-N19 120.444 15.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.502 " H1'" " C5'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.416 -1.473 5 O4'-C1'-N19 115.497 9.622 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' ' DG' . . . . . 0.477 ' H8 ' ' OP2' ' C' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.985 3 O4'-C1'-N19 117.015 11.519 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -1.642 3 O4'-C1'-N19 112.65 6.063 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.444 1.811 3 O4'-C1'-N19 113.667 7.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.637 ' H8 ' " O5'" ' A' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.412 -3.107 2 C4'-C3'-C2' 90.42 -12.78 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.709 H2'' ' C8 ' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.502 -2.569 2 P-O3'-C3' 135.607 13.256 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.709 ' C8 ' H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.549 3.134 3 O4'-C1'-C2' 95.168 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 4' ' ' ' DG' . . . . . 0.537 " O5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.496 -3.248 4 C4'-C3'-C2' 96.933 -6.267 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.647 5 P-O5'-C5' 111.052 -6.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.521 ' O4 ' " H1'" ' D' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.486 -4.223 7 O4'-C1'-C2' 91.775 -13.022 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' D' D ' 7' ' ' ' DG' . . . . . 0.435 ' OP1' H5'' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.427 -1.718 4 O4'-C1'-N19 113.807 7.508 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 8' ' ' ' DG' . . . . . 0.457 ' OP2' ' H8 ' ' D' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.861 3 O4'-C1'-N19 116.647 11.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.659 3 O4'-C1'-N19 112.802 6.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.783 3 O4'-C1'-N19 113.701 7.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' DG' . . . . . 0.682 H2'' " H5'" ' A' ' 2' ' ' ' DC' . . . . . . . . 3 C2'--C1' 1.431 -6.422 5 C4'-C3'-C2' 91.715 -11.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' DC' . . . . . 0.919 " O5'" " H2'" ' A' ' 2' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.483 -4.483 6 P-O3'-C3' 135.647 13.289 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' DG' . . . . . 0.788 ' C8 ' H2'' ' A' ' 2' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.565 4.658 6 O4'-C1'-N19 100.799 -8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.56 " H2'" H5'' ' B' ' 10' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.441 -8.66 4 O4'-C1'-C2' 93.126 -11.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.646 " H5'" ' H71' ' A' ' 6' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.459 -6.888 9 P-O5'-C5' 103.77 -10.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' DT' . . . . . 0.646 ' H71' " H5'" ' A' ' 5' ' ' ' DT' . . . . . . . . 3 C4'--C3' 1.48 -4.778 7 O4'-C1'-C2' 77.435 -26.059 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' DG' . . . . . 0.756 " H1'" " O5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.478 -4.088 6 O4'-C1'-N19 119.145 14.181 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' DG' . . . . . 0.745 ' C8 ' " H2'" ' A' ' 7' ' ' ' DG' . . . . . . . . 3 C2'--C1' 1.45 -5.087 8 O4'-C1'-N19 118.523 13.404 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' DA' . . . . . 0.935 H2'' " H3'" ' A' ' 10' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.459 -5.879 4 O4'-C1'-N19 117.038 11.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.935 " H3'" H2'' ' A' ' 9' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.441 -8.701 4 O4'-C1'-N19 120.964 16.455 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . 0.756 " O5'" " H1'" ' A' ' 7' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.473 -4.699 3 C4'-C3'-C2' 88.039 -15.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . 0.891 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.5 -2.837 3 P-O3'-C3' 139.029 16.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' DG' . . . . . 0.891 ' C8 ' H2'' ' B' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.696 4 O4'-C1'-C2' 94.694 -10.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.583 " O5'" H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.484 -4.383 4 C4'-C3'-C2' 94.802 -8.398 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . 0.438 ' C6 ' ' N3 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.498 -1.65 3 O4'-C1'-N19 113.071 6.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ' DT' . . . . . 0.461 ' O2 ' " C2'" ' B' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.49 -3.816 7 O4'-C1'-C2' 92.362 -12.489 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.421 ' N1 ' ' C6 ' ' B' ' 8' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.429 -1.588 5 O4'-C1'-N19 115.101 9.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . 0.461 ' H8 ' ' OP2' ' B' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 2 O4'-C1'-N19 115.902 10.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.571 2 C4'-C3'-C2' 97.849 -5.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DT' . . . . . 0.56 H5'' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.497 -3.143 5 O4'-C1'-N19 115.983 10.229 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 1' ' ' ' DG' . . . . . 0.494 ' H8 ' " O5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.404 -3.782 5 C4'-C3'-C2' 90.474 -12.726 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ' DC' . . . . . 0.847 H2'' ' C8 ' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.571 -2.182 3 P-O3'-C3' 136.726 14.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ' DG' . . . . . 0.847 ' C8 ' H2'' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.436 6 P-O3'-C3' 109.797 -8.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ' DG' . . . . . 0.509 " O5'" H2'' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.494 -3.38 5 C4'-C3'-C2' 96.689 -6.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.619 4 O4'-C1'-N19 113.879 7.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.503 ' O4 ' " H1'" ' C' ' 3' ' ' ' DG' . . . . . . . . 1 C2'--C1' 1.457 -4.6 5 O4'-C1'-N19 120.444 15.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.458 " H1'" " C5'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.416 -1.473 5 O4'-C1'-N19 115.497 9.622 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 8' ' ' ' DG' . . . . . 0.47 ' H8 ' ' OP2' ' C' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.985 3 O4'-C1'-N19 117.015 11.519 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -1.642 3 O4'-C1'-N19 112.65 6.063 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 10' ' ' ' DT' . . . . . 0.42 H5'' " H2'" ' D' ' 4' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.811 3 O4'-C1'-N19 113.667 7.333 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.619 ' H8 ' " O5'" ' A' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.412 -3.107 2 C4'-C3'-C2' 90.42 -12.78 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 2' ' ' ' DC' . . . . . 0.811 H2'' ' C8 ' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.502 -2.569 2 P-O3'-C3' 135.607 13.256 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 3' ' ' ' DG' . . . . . 0.811 ' C8 ' H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.549 3.134 3 O4'-C1'-C2' 95.168 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 4' ' ' ' DG' . . . . . 0.558 " O5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.496 -3.248 4 C4'-C3'-C2' 96.933 -6.267 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.647 5 P-O5'-C5' 111.052 -6.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.523 ' O4 ' " H1'" ' D' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.486 -4.223 7 O4'-C1'-C2' 91.775 -13.022 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' D' D ' 7' ' ' ' DG' . . . . . 0.417 ' N3 ' ' OP2' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.427 -1.718 4 O4'-C1'-N19 113.807 7.508 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 8' ' ' ' DG' . . . . . 0.451 ' OP2' ' H8 ' ' D' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.861 3 O4'-C1'-N19 116.647 11.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.659 3 O4'-C1'-N19 112.802 6.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.783 3 O4'-C1'-N19 113.701 7.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' DG' . . . . . 0.682 H2'' " H5'" ' A' ' 2' ' ' ' DC' . . . . . . . . 3 C2'--C1' 1.431 -6.422 5 C4'-C3'-C2' 91.715 -11.485 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' DC' . . . . . 0.919 " O5'" " H2'" ' A' ' 2' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.483 -4.483 6 P-O3'-C3' 135.647 13.289 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' DG' . . . . . 0.788 ' C8 ' H2'' ' A' ' 2' ' ' ' DC' . . . . . . . . 2 C3'--C2' 1.565 4.658 6 O4'-C1'-N19 100.799 -8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.56 " H2'" H5'' ' B' ' 10' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.441 -8.66 4 O4'-C1'-C2' 93.126 -11.795 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.646 " H5'" ' H71' ' A' ' 6' ' ' ' DT' . . . . . . . . 2 C4'--C3' 1.459 -6.888 9 P-O5'-C5' 103.77 -10.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' DT' . . . . . 0.646 ' H71' " H5'" ' A' ' 5' ' ' ' DT' . . . . . . . . 3 C4'--C3' 1.48 -4.778 7 O4'-C1'-C2' 77.435 -26.059 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' DG' . . . . . 0.756 " H1'" " O5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.478 -4.088 6 O4'-C1'-N19 119.145 14.181 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' DG' . . . . . 0.745 ' C8 ' " H2'" ' A' ' 7' ' ' ' DG' . . . . . . . . 3 C2'--C1' 1.45 -5.087 8 O4'-C1'-N19 118.523 13.404 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' DA' . . . . . 0.935 H2'' " H3'" ' A' ' 10' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.459 -5.879 4 O4'-C1'-N19 117.038 11.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.935 " H3'" H2'' ' A' ' 9' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.441 -8.701 4 O4'-C1'-N19 120.964 16.455 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . 0.756 " O5'" " H1'" ' A' ' 7' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.473 -4.699 3 C4'-C3'-C2' 88.039 -15.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . 0.891 H2'' ' C8 ' ' B' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.5 -2.837 3 P-O3'-C3' 139.029 16.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' DG' . . . . . 0.891 ' C8 ' H2'' ' B' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.696 4 O4'-C1'-C2' 94.694 -10.369 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.583 " O5'" H2'' ' B' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.484 -4.383 4 C4'-C3'-C2' 94.802 -8.398 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . 0.438 ' C6 ' ' N3 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.498 -1.65 3 O4'-C1'-N19 113.071 6.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ' DT' . . . . . 0.461 ' O2 ' " C2'" ' B' ' 6' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.49 -3.816 7 O4'-C1'-C2' 92.362 -12.489 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.421 ' N1 ' ' C6 ' ' B' ' 8' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.429 -1.588 5 O4'-C1'-N19 115.101 9.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . 0.461 ' H8 ' ' OP2' ' B' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.609 1.639 2 O4'-C1'-N19 115.902 10.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -1.571 2 C4'-C3'-C2' 97.849 -5.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DT' . . . . . 0.56 H5'' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.497 -3.143 5 O4'-C1'-N19 115.983 10.229 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' ' DG' . . . . . 0.494 ' H8 ' " O5'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.404 -3.782 5 C4'-C3'-C2' 90.474 -12.726 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ' DC' . . . . . 0.847 H2'' ' C8 ' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 P--O5' 1.571 -2.182 3 P-O3'-C3' 136.726 14.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ' DG' . . . . . 0.847 ' C8 ' H2'' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.436 6 P-O3'-C3' 109.797 -8.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ' DG' . . . . . 0.509 " O5'" H2'' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.494 -3.38 5 C4'-C3'-C2' 96.689 -6.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.619 4 O4'-C1'-N19 113.879 7.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.503 ' O4 ' " H1'" ' C' ' 3' ' ' ' DG' . . . . . . . . 1 C2'--C1' 1.457 -4.6 5 O4'-C1'-N19 120.444 15.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.458 " H1'" " C5'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.416 -1.473 5 O4'-C1'-N19 115.497 9.622 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' ' DG' . . . . . 0.47 ' H8 ' ' OP2' ' C' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.985 3 O4'-C1'-N19 117.015 11.519 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.428 -1.642 3 O4'-C1'-N19 112.65 6.063 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' ' DT' . . . . . 0.42 H5'' " H2'" ' D' ' 4' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.811 3 O4'-C1'-N19 113.667 7.333 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.619 ' H8 ' " O5'" ' A' ' 1' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.412 -3.107 2 C4'-C3'-C2' 90.42 -12.78 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.811 H2'' ' C8 ' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.502 -2.569 2 P-O3'-C3' 135.607 13.256 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.811 ' C8 ' H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.549 3.134 3 O4'-C1'-C2' 95.168 -9.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 4' ' ' ' DG' . . . . . 0.558 " O5'" H2'' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.496 -3.248 4 C4'-C3'-C2' 96.933 -6.267 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.647 5 P-O5'-C5' 111.052 -6.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.523 ' O4 ' " H1'" ' D' ' 3' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.486 -4.223 7 O4'-C1'-C2' 91.775 -13.022 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' D' D ' 7' ' ' ' DG' . . . . . 0.417 ' N3 ' ' OP2' ' C' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.427 -1.718 4 O4'-C1'-N19 113.807 7.508 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 8' ' ' ' DG' . . . . . 0.451 ' OP2' ' H8 ' ' D' ' 8' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.861 3 O4'-C1'-N19 116.647 11.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.659 3 O4'-C1'-N19 112.802 6.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.783 3 O4'-C1'-N19 113.701 7.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_