data_Remediated_restraints_file_for_PDB_entry_1xwp # This BMRB archive file contains, for PDB entry 1xwp: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process, minor modifications could # have occurred to the NMR restraints information, or data could have been lost # because of parsing or conversion errors. The PDB file remains the # authoritative reference for the atomic coordinates and the originally deposited # restraints files remain the primary reference for these data. # # This file is generated as part of the wwPDB at the BioMagResBank (BMRB) in # collaboration with the PDBe (formerly MSD) group at the European # Bioinformatics Institute (EBI) and the CMBI/IMM group at the Radboud # University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389-396. ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID rr_1xwp _Entry.Title 'wwPDB remediated NMR restraints for PDB entry 1xwp' _Entry.Version_type original _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Contains the remediated restraint lists and coordinates for PDB entry 1xwp' _Entry.PDB_coordinate_file_version 3.20 loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1xwp 'Master copy' rr_1xwp stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_1xwp _Assembly.ID 1 _Assembly.Name 1xwp _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 4854.9422 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 '5 R GP GP AP GP AP UP CP GP CP AP CP UP CP CP A 3' 1 $5__R__GP_GP_AP_GP_AP_UP_CP_GP_CP_AP_CP_UP_CP_CP_A__3_ A . no . . . . . . rr_1xwp 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_5__R__GP_GP_AP_GP_AP_UP_CP_GP_CP_AP_CP_UP_CP_CP_A__3_ _Entity.Sf_category entity _Entity.Sf_framecode 5__R__GP_GP_AP_GP_AP_UP_CP_GP_CP_AP_CP_UP_CP_CP_A__3_ _Entity.Entry_ID rr_1xwp _Entity.ID 1 _Entity.Name 5__R__GP_GP_AP_GP_AP_UP_CP_GP_CP_AP_CP_UP_CP_CP_A__3_ _Entity.Type polymer _Entity.Polymer_type polyribonucleotide _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code GGAGAUCGCACUCCA _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality yes _Entity.Nstd_linkage no _Entity.Number_of_monomers 15 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Parent_entity_ID 1 _Entity.Formula_weight 4854.9422 loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . G . rr_1xwp 1 2 . G . rr_1xwp 1 3 . A . rr_1xwp 1 4 . G . rr_1xwp 1 5 . A . rr_1xwp 1 6 . U . rr_1xwp 1 7 . C . rr_1xwp 1 8 . G . rr_1xwp 1 9 . C . rr_1xwp 1 10 . A . rr_1xwp 1 11 . C . rr_1xwp 1 12 . U . rr_1xwp 1 13 . C . rr_1xwp 1 14 . C . rr_1xwp 1 15 . A . rr_1xwp 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . G 1 1 rr_1xwp 1 . G 2 2 rr_1xwp 1 . A 3 3 rr_1xwp 1 . G 4 4 rr_1xwp 1 . A 5 5 rr_1xwp 1 . U 6 6 rr_1xwp 1 . C 7 7 rr_1xwp 1 . G 8 8 rr_1xwp 1 . C 9 9 rr_1xwp 1 . A 10 10 rr_1xwp 1 . C 11 11 rr_1xwp 1 . U 12 12 rr_1xwp 1 . C 13 13 rr_1xwp 1 . C 14 14 rr_1xwp 1 . A 15 15 rr_1xwp 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID rr_1xwp _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 1 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID rr_1xwp _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . rr_1xwp 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . rr_1xwp 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 G C1' C -3.094 0.882 -11.859 . . . 1.0 . . . . . . . . . . . . A . 1 G C1' . . . . . . . . . rr_1xwp 1 . 1 . 2 . 1 1 1 G C2 C -0.434 3.418 -9.464 . . . 1.0 . . . . . . . . . . . . A . 1 G C2 . . . . . . . . . rr_1xwp 1 . 1 . 3 . 1 1 1 G C2' C -2.448 -0.511 -11.756 . . . 1.0 . . . . . . . . . . . . A . 1 G C2' . . . . . . . . . rr_1xwp 1 . 1 . 4 . 1 1 1 G C3' C -3.568 -1.451 -12.219 . . . 1.0 . . . . . . . . . . . . A . 1 G C3' . . . . . . . . . rr_1xwp 1 . 1 . 5 . 1 1 1 G C4 C -2.364 2.284 -9.868 . . . 1.0 . . . . . . . . . . . . A . 1 G C4 . . . . . . . . . rr_1xwp 1 . 1 . 6 . 1 1 1 G C4' C -4.330 -0.533 -13.176 . . . 1.0 . . . . . . . . . . . . A . 1 G C4' . . . . . . . . . rr_1xwp 1 . 1 . 7 . 1 1 1 G C5 C -2.968 2.704 -8.702 . . . 1.0 . . . . . . . . . . . . A . 1 G C5 . . . . . . . . . rr_1xwp 1 . 1 . 8 . 1 1 1 G C5' C -5.753 -1.032 -13.460 . . . 1.0 . . . . . . . . . . . . A . 1 G C5' . . . . . . . . . rr_1xwp 1 . 1 . 9 . 1 1 1 G C6 C -2.258 3.588 -7.824 . . . 1.0 . . . . . . . . . . . . A . 1 G C6 . . . . . . . . . rr_1xwp 1 . 1 . 10 . 1 1 1 G C8 C -4.374 1.457 -9.689 . . . 1.0 . . . . . . . . . . . . A . 1 G C8 . . . . . . . . . rr_1xwp 1 . 1 . 11 . 1 1 1 G H1 H -0.420 4.520 -7.701 . . . 1.0 . . . . . . . . . . . . A . 1 G H1 . . . . . . . . . rr_1xwp 1 . 1 . 12 . 1 1 1 G H1' H -2.474 1.545 -12.468 . . . 1.0 . . . . . . . . . . . . A . 1 G H1' . . . . . . . . . rr_1xwp 1 . 1 . 13 . 1 1 1 G H2' H -2.145 -0.752 -10.738 . . . 1.0 . . . . . . . . . . . . A . 1 G H2' . . . . . . . . . rr_1xwp 1 . 1 . 14 . 1 1 1 G H21 H 1.334 4.376 -9.132 . . . 1.0 . . . . . . . . . . . . A . 1 G H21 . . . . . . . . . rr_1xwp 1 . 1 . 15 . 1 1 1 G H22 H 1.242 3.432 -10.606 . . . 1.0 . . . . . . . . . . . . A . 1 G H22 . . . . . . . . . rr_1xwp 1 . 1 . 16 . 1 1 1 G H3' H -4.214 -1.697 -11.373 . . . 1.0 . . . . . . . . . . . . A . 1 G H3' . . . . . . . . . rr_1xwp 1 . 1 . 17 . 1 1 1 G H4' H -3.776 -0.437 -14.113 . . . 1.0 . . . . . . . . . . . . A . 1 G H4' . . . . . . . . . rr_1xwp 1 . 1 . 18 . 1 1 1 G H5' H -5.710 -2.040 -13.876 . . . 1.0 . . . . . . . . . . . . A . 1 G H5' . . . . . . . . . rr_1xwp 1 . 1 . 19 . 1 1 1 G H5'' H -6.336 -1.054 -12.539 . . . 1.0 . . . . . . . . . . . . A . 1 G H5'' . . . . . . . . . rr_1xwp 1 . 1 . 20 . 1 1 1 G H8 H -5.272 0.901 -9.919 . . . 1.0 . . . . . . . . . . . . A . 1 G H8 . . . . . . . . . rr_1xwp 1 . 1 . 21 . 1 1 1 G HO2' H -0.933 -1.448 -12.536 . . . 1.0 . . . . . . . . . . . . A . 1 G HO2' . . . . . . . . . rr_1xwp 1 . 1 . 22 . 1 1 1 G HO5' H -7.277 -0.527 -14.556 . . . 1.0 . . . . . . . . . . . . A . 1 G HO5' . . . . . . . . . rr_1xwp 1 . 1 . 23 . 1 1 1 G N1 N -0.974 3.906 -8.283 . . . 1.0 . . . . . . . . . . . . A . 1 G N1 . . . . . . . . . rr_1xwp 1 . 1 . 24 . 1 1 1 G N2 N 0.816 3.777 -9.759 . . . 1.0 . . . . . . . . . . . . A . 1 G N2 . . . . . . . . . rr_1xwp 1 . 1 . 25 . 1 1 1 G N3 N -1.105 2.601 -10.298 . . . 1.0 . . . . . . . . . . . . A . 1 G N3 . . . . . . . . . rr_1xwp 1 . 1 . 26 . 1 1 1 G N7 N -4.244 2.159 -8.598 . . . 1.0 . . . . . . . . . . . . A . 1 G N7 . . . . . . . . . rr_1xwp 1 . 1 . 27 . 1 1 1 G N9 N -3.284 1.502 -10.525 . . . 1.0 . . . . . . . . . . . . A . 1 G N9 . . . . . . . . . rr_1xwp 1 . 1 . 28 . 1 1 1 G O2' O -1.325 -0.574 -12.619 . . . 1.0 . . . . . . . . . . . . A . 1 G O2' . . . . . . . . . rr_1xwp 1 . 1 . 29 . 1 1 1 G O3' O -3.125 -2.626 -12.886 . . . 1.0 . . . . . . . . . . . . A . 1 G O3' . . . . . . . . . rr_1xwp 1 . 1 . 30 . 1 1 1 G O4' O -4.341 0.719 -12.515 . . . 1.0 . . . . . . . . . . . . A . 1 G O4' . . . . . . . . . rr_1xwp 1 . 1 . 31 . 1 1 1 G O5' O -6.393 -0.189 -14.395 . . . 1.0 . . . . . . . . . . . . A . 1 G O5' . . . . . . . . . rr_1xwp 1 . 1 . 32 . 1 1 1 G O6 O -2.649 4.071 -6.765 . . . 1.0 . . . . . . . . . . . . A . 1 G O6 . . . . . . . . . rr_1xwp 1 . 1 . 33 . 1 1 2 G C1' C 1.126 -0.220 -9.216 . . . 1.0 . . . . . . . . . . . . A . 2 G C1' . . . . . . . . . rr_1xwp 1 . 1 . 34 . 1 1 2 G C2 C 1.930 2.744 -6.070 . . . 1.0 . . . . . . . . . . . . A . 2 G C2 . . . . . . . . . rr_1xwp 1 . 1 . 35 . 1 1 2 G C2' C 2.154 -1.222 -8.677 . . . 1.0 . . . . . . . . . . . . A . 2 G C2' . . . . . . . . . rr_1xwp 1 . 1 . 36 . 1 1 2 G C3' C 1.359 -2.525 -8.770 . . . 1.0 . . . . . . . . . . . . A . 2 G C3' . . . . . . . . . rr_1xwp 1 . 1 . 37 . 1 1 2 G C4 C 0.644 1.221 -7.170 . . . 1.0 . . . . . . . . . . . . A . 2 G C4 . . . . . . . . . rr_1xwp 1 . 1 . 38 . 1 1 2 G C4' C 0.666 -2.316 -10.119 . . . 1.0 . . . . . . . . . . . . A . 2 G C4' . . . . . . . . . rr_1xwp 1 . 1 . 39 . 1 1 2 G C5 C -0.444 1.404 -6.342 . . . 1.0 . . . . . . . . . . . . A . 2 G C5 . . . . . . . . . rr_1xwp 1 . 1 . 40 . 1 1 2 G C5' C -0.593 -3.183 -10.279 . . . 1.0 . . . . . . . . . . . . A . 2 G C5' . . . . . . . . . rr_1xwp 1 . 1 . 41 . 1 1 2 G C6 C -0.367 2.373 -5.285 . . . 1.0 . . . . . . . . . . . . A . 2 G C6 . . . . . . . . . rr_1xwp 1 . 1 . 42 . 1 1 2 G C8 C -1.018 -0.060 -7.768 . . . 1.0 . . . . . . . . . . . . A . 2 G C8 . . . . . . . . . rr_1xwp 1 . 1 . 43 . 1 1 2 G H1 H 0.990 3.702 -4.479 . . . 1.0 . . . . . . . . . . . . A . 2 G H1 . . . . . . . . . rr_1xwp 1 . 1 . 44 . 1 1 2 G H1' H 1.605 0.632 -9.702 . . . 1.0 . . . . . . . . . . . . A . 2 G H1' . . . . . . . . . rr_1xwp 1 . 1 . 45 . 1 1 2 G H2' H 2.471 -1.003 -7.659 . . . 1.0 . . . . . . . . . . . . A . 2 G H2' . . . . . . . . . rr_1xwp 1 . 1 . 46 . 1 1 2 G H21 H 3.144 4.048 -5.081 . . . 1.0 . . . . . . . . . . . . A . 2 G H21 . . . . . . . . . rr_1xwp 1 . 1 . 47 . 1 1 2 G H22 H 3.867 3.218 -6.446 . . . 1.0 . . . . . . . . . . . . A . 2 G H22 . . . . . . . . . rr_1xwp 1 . 1 . 48 . 1 1 2 G H3' H 0.598 -2.557 -7.986 . . . 1.0 . . . . . . . . . . . . A . 2 G H3' . . . . . . . . . rr_1xwp 1 . 1 . 49 . 1 1 2 G H4' H 1.374 -2.545 -10.918 . . . 1.0 . . . . . . . . . . . . A . 2 G H4' . . . . . . . . . rr_1xwp 1 . 1 . 50 . 1 1 2 G H5' H -0.371 -4.201 -9.953 . . . 1.0 . . . . . . . . . . . . A . 2 G H5' . . . . . . . . . rr_1xwp 1 . 1 . 51 . 1 1 2 G H5'' H -1.389 -2.782 -9.649 . . . 1.0 . . . . . . . . . . . . A . 2 G H5'' . . . . . . . . . rr_1xwp 1 . 1 . 52 . 1 1 2 G H8 H -1.602 -0.788 -8.310 . . . 1.0 . . . . . . . . . . . . A . 2 G H8 . . . . . . . . . rr_1xwp 1 . 1 . 53 . 1 1 2 G HO2' H 3.783 -2.046 -9.345 . . . 1.0 . . . . . . . . . . . . A . 2 G HO2' . . . . . . . . . rr_1xwp 1 . 1 . 54 . 1 1 2 G N1 N 0.875 3.011 -5.210 . . . 1.0 . . . . . . . . . . . . A . 2 G N1 . . . . . . . . . rr_1xwp 1 . 1 . 55 . 1 1 2 G N2 N 3.075 3.392 -5.846 . . . 1.0 . . . . . . . . . . . . A . 2 G N2 . . . . . . . . . rr_1xwp 1 . 1 . 56 . 1 1 2 G N3 N 1.853 1.855 -7.081 . . . 1.0 . . . . . . . . . . . . A . 2 G N3 . . . . . . . . . rr_1xwp 1 . 1 . 57 . 1 1 2 G N7 N -1.489 0.574 -6.731 . . . 1.0 . . . . . . . . . . . . A . 2 G N7 . . . . . . . . . rr_1xwp 1 . 1 . 58 . 1 1 2 G N9 N 0.269 0.285 -8.108 . . . 1.0 . . . . . . . . . . . . A . 2 G N9 . . . . . . . . . rr_1xwp 1 . 1 . 59 . 1 1 2 G O2' O 3.287 -1.244 -9.526 . . . 1.0 . . . . . . . . . . . . A . 2 G O2' . . . . . . . . . rr_1xwp 1 . 1 . 60 . 1 1 2 G O3' O 2.177 -3.689 -8.763 . . . 1.0 . . . . . . . . . . . . A . 2 G O3' . . . . . . . . . rr_1xwp 1 . 1 . 61 . 1 1 2 G O4' O 0.355 -0.929 -10.179 . . . 1.0 . . . . . . . . . . . . A . 2 G O4' . . . . . . . . . rr_1xwp 1 . 1 . 62 . 1 1 2 G O5' O -0.980 -3.229 -11.644 . . . 1.0 . . . . . . . . . . . . A . 2 G O5' . . . . . . . . . rr_1xwp 1 . 1 . 63 . 1 1 2 G O6 O -1.242 2.680 -4.482 . . . 1.0 . . . . . . . . . . . . A . 2 G O6 . . . . . . . . . rr_1xwp 1 . 1 . 64 . 1 1 2 G OP1 O -2.105 -4.895 -13.140 . . . 1.0 . . . . . . . . . . . . A . 2 G OP1 . . . . . . . . . rr_1xwp 1 . 1 . 65 . 1 1 2 G OP2 O -3.203 -4.199 -10.937 . . . 1.0 . . . . . . . . . . . . A . 2 G OP2 . . . . . . . . . rr_1xwp 1 . 1 . 66 . 1 1 2 G P P -2.394 -3.855 -12.129 . . . 1.0 . . . . . . . . . . . . A . 2 G P . . . . . . . . . rr_1xwp 1 . 1 . 67 . 1 1 3 A C1' C 4.595 -0.078 -4.965 . . . 1.0 . . . . . . . . . . . . A . 3 A C1' . . . . . . . . . rr_1xwp 1 . 1 . 68 . 1 1 3 A C2 C 2.887 2.512 -1.903 . . . 1.0 . . . . . . . . . . . . A . 3 A C2 . . . . . . . . . rr_1xwp 1 . 1 . 69 . 1 1 3 A C2' C 5.470 -0.852 -3.966 . . . 1.0 . . . . . . . . . . . . A . 3 A C2' . . . . . . . . . rr_1xwp 1 . 1 . 70 . 1 1 3 A C3' C 5.325 -2.276 -4.505 . . . 1.0 . . . . . . . . . . . . A . 3 A C3' . . . . . . . . . rr_1xwp 1 . 1 . 71 . 1 1 3 A C4 C 2.806 0.895 -3.452 . . . 1.0 . . . . . . . . . . . . A . 3 A C4 . . . . . . . . . rr_1xwp 1 . 1 . 72 . 1 1 3 A C4' C 5.381 -1.990 -6.009 . . . 1.0 . . . . . . . . . . . . A . 3 A C4' . . . . . . . . . rr_1xwp 1 . 1 . 73 . 1 1 3 A C5 C 1.479 0.622 -3.200 . . . 1.0 . . . . . . . . . . . . A . 3 A C5 . . . . . . . . . rr_1xwp 1 . 1 . 74 . 1 1 3 A C5' C 4.844 -3.132 -6.884 . . . 1.0 . . . . . . . . . . . . A . 3 A C5' . . . . . . . . . rr_1xwp 1 . 1 . 75 . 1 1 3 A C6 C 0.861 1.419 -2.199 . . . 1.0 . . . . . . . . . . . . A . 3 A C6 . . . . . . . . . rr_1xwp 1 . 1 . 76 . 1 1 3 A C8 C 2.093 -0.735 -4.710 . . . 1.0 . . . . . . . . . . . . A . 3 A C8 . . . . . . . . . rr_1xwp 1 . 1 . 77 . 1 1 3 A H1' H 4.981 0.931 -5.125 . . . 1.0 . . . . . . . . . . . . A . 3 A H1' . . . . . . . . . rr_1xwp 1 . 1 . 78 . 1 1 3 A H2 H 3.432 3.273 -1.366 . . . 1.0 . . . . . . . . . . . . A . 3 A H2 . . . . . . . . . rr_1xwp 1 . 1 . 79 . 1 1 3 A H2' H 5.126 -0.768 -2.934 . . . 1.0 . . . . . . . . . . . . A . 3 A H2' . . . . . . . . . rr_1xwp 1 . 1 . 80 . 1 1 3 A H3' H 4.333 -2.661 -4.255 . . . 1.0 . . . . . . . . . . . . A . 3 A H3' . . . . . . . . . rr_1xwp 1 . 1 . 81 . 1 1 3 A H4' H 6.416 -1.792 -6.294 . . . 1.0 . . . . . . . . . . . . A . 3 A H4' . . . . . . . . . rr_1xwp 1 . 1 . 82 . 1 1 3 A H5' H 4.963 -2.858 -7.933 . . . 1.0 . . . . . . . . . . . . A . 3 A H5' . . . . . . . . . rr_1xwp 1 . 1 . 83 . 1 1 3 A H5'' H 5.432 -4.031 -6.689 . . . 1.0 . . . . . . . . . . . . A . 3 A H5'' . . . . . . . . . rr_1xwp 1 . 1 . 84 . 1 1 3 A H61 H -0.811 1.880 -1.112 . . . 1.0 . . . . . . . . . . . . A . 3 A H61 . . . . . . . . . rr_1xwp 1 . 1 . 85 . 1 1 3 A H62 H -1.000 0.598 -2.291 . . . 1.0 . . . . . . . . . . . . A . 3 A H62 . . . . . . . . . rr_1xwp 1 . 1 . 86 . 1 1 3 A H8 H 2.078 -1.533 -5.435 . . . 1.0 . . . . . . . . . . . . A . 3 A H8 . . . . . . . . . rr_1xwp 1 . 1 . 87 . 1 1 3 A HO2' H 6.846 0.498 -3.685 . . . 1.0 . . . . . . . . . . . . A . 3 A HO2' . . . . . . . . . rr_1xwp 1 . 1 . 88 . 1 1 3 A N1 N 1.603 2.358 -1.566 . . . 1.0 . . . . . . . . . . . . A . 3 A N1 . . . . . . . . . rr_1xwp 1 . 1 . 89 . 1 1 3 A N3 N 3.575 1.842 -2.830 . . . 1.0 . . . . . . . . . . . . A . 3 A N3 . . . . . . . . . rr_1xwp 1 . 1 . 90 . 1 1 3 A N6 N -0.422 1.290 -1.838 . . . 1.0 . . . . . . . . . . . . A . 3 A N6 . . . . . . . . . rr_1xwp 1 . 1 . 91 . 1 1 3 A N7 N 1.038 -0.417 -4.012 . . . 1.0 . . . . . . . . . . . . A . 3 A N7 . . . . . . . . . rr_1xwp 1 . 1 . 92 . 1 1 3 A N9 N 3.208 0.024 -4.437 . . . 1.0 . . . . . . . . . . . . A . 3 A N9 . . . . . . . . . rr_1xwp 1 . 1 . 93 . 1 1 3 A O2' O 6.808 -0.391 -4.046 . . . 1.0 . . . . . . . . . . . . A . 3 A O2' . . . . . . . . . rr_1xwp 1 . 1 . 94 . 1 1 3 A O3' O 6.343 -3.167 -4.073 . . . 1.0 . . . . . . . . . . . . A . 3 A O3' . . . . . . . . . rr_1xwp 1 . 1 . 95 . 1 1 3 A O4' O 4.639 -0.792 -6.196 . . . 1.0 . . . . . . . . . . . . A . 3 A O4' . . . . . . . . . rr_1xwp 1 . 1 . 96 . 1 1 3 A O5' O 3.480 -3.374 -6.586 . . . 1.0 . . . . . . . . . . . . A . 3 A O5' . . . . . . . . . rr_1xwp 1 . 1 . 97 . 1 1 3 A OP1 O 3.454 -5.594 -7.757 . . . 1.0 . . . . . . . . . . . . A . 3 A OP1 . . . . . . . . . rr_1xwp 1 . 1 . 98 . 1 1 3 A OP2 O 1.351 -4.688 -6.620 . . . 1.0 . . . . . . . . . . . . A . 3 A OP2 . . . . . . . . . rr_1xwp 1 . 1 . 99 . 1 1 3 A P P 2.589 -4.449 -7.396 . . . 1.0 . . . . . . . . . . . . A . 3 A P . . . . . . . . . rr_1xwp 1 . 1 . 100 . 1 1 4 G C1' C 6.089 0.420 0.588 . . . 1.0 . . . . . . . . . . . . A . 4 G C1' . . . . . . . . . rr_1xwp 1 . 1 . 101 . 1 1 4 G C2 C 2.680 1.317 3.204 . . . 1.0 . . . . . . . . . . . . A . 4 G C2 . . . . . . . . . rr_1xwp 1 . 1 . 102 . 1 1 4 G C2' C 6.666 -0.334 1.795 . . . 1.0 . . . . . . . . . . . . A . 4 G C2' . . . . . . . . . rr_1xwp 1 . 1 . 103 . 1 1 4 G C3' C 7.166 -1.618 1.135 . . . 1.0 . . . . . . . . . . . . A . 4 G C3' . . . . . . . . . rr_1xwp 1 . 1 . 104 . 1 1 4 G C4 C 3.651 0.510 1.310 . . . 1.0 . . . . . . . . . . . . A . 4 G C4 . . . . . . . . . rr_1xwp 1 . 1 . 105 . 1 1 4 G C4' C 7.696 -1.064 -0.191 . . . 1.0 . . . . . . . . . . . . A . 4 G C4' . . . . . . . . . rr_1xwp 1 . 1 . 106 . 1 1 4 G C5 C 2.454 0.125 0.745 . . . 1.0 . . . . . . . . . . . . A . 4 G C5 . . . . . . . . . rr_1xwp 1 . 1 . 107 . 1 1 4 G C5' C 7.802 -2.128 -1.295 . . . 1.0 . . . . . . . . . . . . A . 4 G C5' . . . . . . . . . rr_1xwp 1 . 1 . 108 . 1 1 4 G C6 C 1.231 0.407 1.438 . . . 1.0 . . . . . . . . . . . . A . 4 G C6 . . . . . . . . . rr_1xwp 1 . 1 . 109 . 1 1 4 G C8 C 3.976 -0.519 -0.585 . . . 1.0 . . . . . . . . . . . . A . 4 G C8 . . . . . . . . . rr_1xwp 1 . 1 . 110 . 1 1 4 G H1 H 0.618 1.153 3.265 . . . 1.0 . . . . . . . . . . . . A . 4 G H1 . . . . . . . . . rr_1xwp 1 . 1 . 111 . 1 1 4 G H1' H 6.206 1.499 0.709 . . . 1.0 . . . . . . . . . . . . A . 4 G H1' . . . . . . . . . rr_1xwp 1 . 1 . 112 . 1 1 4 G H2' H 5.929 -0.546 2.569 . . . 1.0 . . . . . . . . . . . . A . 4 G H2' . . . . . . . . . rr_1xwp 1 . 1 . 113 . 1 1 4 G H21 H 1.867 1.950 4.966 . . . 1.0 . . . . . . . . . . . . A . 4 G H21 . . . . . . . . . rr_1xwp 1 . 1 . 114 . 1 1 4 G H22 H 3.607 2.107 4.825 . . . 1.0 . . . . . . . . . . . . A . 4 G H22 . . . . . . . . . rr_1xwp 1 . 1 . 115 . 1 1 4 G H3' H 6.315 -2.275 0.936 . . . 1.0 . . . . . . . . . . . . A . 4 G H3' . . . . . . . . . rr_1xwp 1 . 1 . 116 . 1 1 4 G H4' H 8.686 -0.632 -0.029 . . . 1.0 . . . . . . . . . . . . A . 4 G H4' . . . . . . . . . rr_1xwp 1 . 1 . 117 . 1 1 4 G H5' H 8.208 -1.673 -2.199 . . . 1.0 . . . . . . . . . . . . A . 4 G H5' . . . . . . . . . rr_1xwp 1 . 1 . 118 . 1 1 4 G H5'' H 8.489 -2.905 -0.955 . . . 1.0 . . . . . . . . . . . . A . 4 G H5'' . . . . . . . . . rr_1xwp 1 . 1 . 119 . 1 1 4 G H8 H 4.475 -0.960 -1.434 . . . 1.0 . . . . . . . . . . . . A . 4 G H8 . . . . . . . . . rr_1xwp 1 . 1 . 120 . 1 1 4 G HO2' H 8.387 0.584 1.694 . . . 1.0 . . . . . . . . . . . . A . 4 G HO2' . . . . . . . . . rr_1xwp 1 . 1 . 121 . 1 1 4 G N1 N 1.435 0.975 2.700 . . . 1.0 . . . . . . . . . . . . A . 4 G N1 . . . . . . . . . rr_1xwp 1 . 1 . 122 . 1 1 4 G N2 N 2.716 1.850 4.427 . . . 1.0 . . . . . . . . . . . . A . 4 G N2 . . . . . . . . . rr_1xwp 1 . 1 . 123 . 1 1 4 G N3 N 3.825 1.122 2.521 . . . 1.0 . . . . . . . . . . . . A . 4 G N3 . . . . . . . . . rr_1xwp 1 . 1 . 124 . 1 1 4 G N7 N 2.680 -0.544 -0.452 . . . 1.0 . . . . . . . . . . . . A . 4 G N7 . . . . . . . . . rr_1xwp 1 . 1 . 125 . 1 1 4 G N9 N 4.638 0.135 0.427 . . . 1.0 . . . . . . . . . . . . A . 4 G N9 . . . . . . . . . rr_1xwp 1 . 1 . 126 . 1 1 4 G O2' O 7.724 0.418 2.368 . . . 1.0 . . . . . . . . . . . . A . 4 G O2' . . . . . . . . . rr_1xwp 1 . 1 . 127 . 1 1 4 G O3' O 8.176 -2.259 1.902 . . . 1.0 . . . . . . . . . . . . A . 4 G O3' . . . . . . . . . rr_1xwp 1 . 1 . 128 . 1 1 4 G O4' O 6.822 -0.004 -0.556 . . . 1.0 . . . . . . . . . . . . A . 4 G O4' . . . . . . . . . rr_1xwp 1 . 1 . 129 . 1 1 4 G O5' O 6.526 -2.690 -1.556 . . . 1.0 . . . . . . . . . . . . A . 4 G O5' . . . . . . . . . rr_1xwp 1 . 1 . 130 . 1 1 4 G O6 O 0.083 0.203 1.057 . . . 1.0 . . . . . . . . . . . . A . 4 G O6 . . . . . . . . . rr_1xwp 1 . 1 . 131 . 1 1 4 G OP1 O 7.461 -4.801 -2.541 . . . 1.0 . . . . . . . . . . . . A . 4 G OP1 . . . . . . . . . rr_1xwp 1 . 1 . 132 . 1 1 4 G OP2 O 4.937 -4.419 -2.418 . . . 1.0 . . . . . . . . . . . . A . 4 G OP2 . . . . . . . . . rr_1xwp 1 . 1 . 133 . 1 1 4 G P P 6.302 -3.885 -2.622 . . . 1.0 . . . . . . . . . . . . A . 4 G P . . . . . . . . . rr_1xwp 1 . 1 . 134 . 1 1 5 A C1' C 3.143 -1.739 4.977 . . . 1.0 . . . . . . . . . . . . A . 5 A C1' . . . . . . . . . rr_1xwp 1 . 1 . 135 . 1 1 5 A C2 C -0.938 -2.193 3.412 . . . 1.0 . . . . . . . . . . . . A . 5 A C2 . . . . . . . . . rr_1xwp 1 . 1 . 136 . 1 1 5 A C2' C 3.207 -2.849 6.039 . . . 1.0 . . . . . . . . . . . . A . 5 A C2' . . . . . . . . . rr_1xwp 1 . 1 . 137 . 1 1 5 A C3' C 4.656 -3.316 5.905 . . . 1.0 . . . . . . . . . . . . A . 5 A C3' . . . . . . . . . rr_1xwp 1 . 1 . 138 . 1 1 5 A C4 C 1.299 -2.345 3.324 . . . 1.0 . . . . . . . . . . . . A . 5 A C4 . . . . . . . . . rr_1xwp 1 . 1 . 139 . 1 1 5 A C4' C 5.365 -1.992 5.602 . . . 1.0 . . . . . . . . . . . . A . 5 A C4' . . . . . . . . . rr_1xwp 1 . 1 . 140 . 1 1 5 A C5 C 1.282 -2.761 2.010 . . . 1.0 . . . . . . . . . . . . A . 5 A C5 . . . . . . . . . rr_1xwp 1 . 1 . 141 . 1 1 5 A C5' C 6.737 -2.184 4.930 . . . 1.0 . . . . . . . . . . . . A . 5 A C5' . . . . . . . . . rr_1xwp 1 . 1 . 142 . 1 1 5 A C6 C 0.003 -2.849 1.401 . . . 1.0 . . . . . . . . . . . . A . 5 A C6 . . . . . . . . . rr_1xwp 1 . 1 . 143 . 1 1 5 A C8 C 3.320 -2.697 2.581 . . . 1.0 . . . . . . . . . . . . A . 5 A C8 . . . . . . . . . rr_1xwp 1 . 1 . 144 . 1 1 5 A H1' H 2.500 -0.922 5.310 . . . 1.0 . . . . . . . . . . . . A . 5 A H1' . . . . . . . . . rr_1xwp 1 . 1 . 145 . 1 1 5 A H2 H -1.850 -1.983 3.944 . . . 1.0 . . . . . . . . . . . . A . 5 A H2 . . . . . . . . . rr_1xwp 1 . 1 . 146 . 1 1 5 A H2' H 2.502 -3.661 5.852 . . . 1.0 . . . . . . . . . . . . A . 5 A H2' . . . . . . . . . rr_1xwp 1 . 1 . 147 . 1 1 5 A H3' H 4.721 -3.978 5.038 . . . 1.0 . . . . . . . . . . . . A . 5 A H3' . . . . . . . . . rr_1xwp 1 . 1 . 148 . 1 1 5 A H4' H 5.502 -1.436 6.532 . . . 1.0 . . . . . . . . . . . . A . 5 A H4' . . . . . . . . . rr_1xwp 1 . 1 . 149 . 1 1 5 A H5' H 7.156 -1.213 4.663 . . . 1.0 . . . . . . . . . . . . A . 5 A H5' . . . . . . . . . rr_1xwp 1 . 1 . 150 . 1 1 5 A H5'' H 7.400 -2.669 5.648 . . . 1.0 . . . . . . . . . . . . A . 5 A H5'' . . . . . . . . . rr_1xwp 1 . 1 . 151 . 1 1 5 A H61 H -1.120 -3.343 -0.211 . . . 1.0 . . . . . . . . . . . . A . 5 A H61 . . . . . . . . . rr_1xwp 1 . 1 . 152 . 1 1 5 A H62 H 0.618 -3.440 -0.452 . . . 1.0 . . . . . . . . . . . . A . 5 A H62 . . . . . . . . . rr_1xwp 1 . 1 . 153 . 1 1 5 A H8 H 4.394 -2.766 2.543 . . . 1.0 . . . . . . . . . . . . A . 5 A H8 . . . . . . . . . rr_1xwp 1 . 1 . 154 . 1 1 5 A HO2' H 3.232 -2.948 7.980 . . . 1.0 . . . . . . . . . . . . A . 5 A HO2' . . . . . . . . . rr_1xwp 1 . 1 . 155 . 1 1 5 A N1 N -1.095 -2.566 2.139 . . . 1.0 . . . . . . . . . . . . A . 5 A N1 . . . . . . . . . rr_1xwp 1 . 1 . 156 . 1 1 5 A N3 N 0.205 -2.041 4.091 . . . 1.0 . . . . . . . . . . . . A . 5 A N3 . . . . . . . . . rr_1xwp 1 . 1 . 157 . 1 1 5 A N6 N -0.177 -3.210 0.127 . . . 1.0 . . . . . . . . . . . . A . 5 A N6 . . . . . . . . . rr_1xwp 1 . 1 . 158 . 1 1 5 A N7 N 2.574 -3.002 1.558 . . . 1.0 . . . . . . . . . . . . A . 5 A N7 . . . . . . . . . rr_1xwp 1 . 1 . 159 . 1 1 5 A N9 N 2.625 -2.258 3.684 . . . 1.0 . . . . . . . . . . . . A . 5 A N9 . . . . . . . . . rr_1xwp 1 . 1 . 160 . 1 1 5 A O2' O 2.963 -2.301 7.323 . . . 1.0 . . . . . . . . . . . . A . 5 A O2' . . . . . . . . . rr_1xwp 1 . 1 . 161 . 1 1 5 A O3' O 5.159 -3.918 7.090 . . . 1.0 . . . . . . . . . . . . A . 5 A O3' . . . . . . . . . rr_1xwp 1 . 1 . 162 . 1 1 5 A O4' O 4.466 -1.244 4.797 . . . 1.0 . . . . . . . . . . . . A . 5 A O4' . . . . . . . . . rr_1xwp 1 . 1 . 163 . 1 1 5 A O5' O 6.599 -3.002 3.779 . . . 1.0 . . . . . . . . . . . . A . 5 A O5' . . . . . . . . . rr_1xwp 1 . 1 . 164 . 1 1 5 A OP1 O 9.018 -3.696 3.770 . . . 1.0 . . . . . . . . . . . . A . 5 A OP1 . . . . . . . . . rr_1xwp 1 . 1 . 165 . 1 1 5 A OP2 O 7.378 -4.620 2.040 . . . 1.0 . . . . . . . . . . . . A . 5 A OP2 . . . . . . . . . rr_1xwp 1 . 1 . 166 . 1 1 5 A P P 7.850 -3.500 2.883 . . . 1.0 . . . . . . . . . . . . A . 5 A P . . . . . . . . . rr_1xwp 1 . 1 . 167 . 1 1 6 U C1' C 0.106 -6.463 5.666 . . . 1.0 . . . . . . . . . . . . A . 6 U C1' . . . . . . . . . rr_1xwp 1 . 1 . 168 . 1 1 6 U C2 C -0.602 -5.937 3.326 . . . 1.0 . . . . . . . . . . . . A . 6 U C2 . . . . . . . . . rr_1xwp 1 . 1 . 169 . 1 1 6 U C2' C 0.295 -7.956 6.012 . . . 1.0 . . . . . . . . . . . . A . 6 U C2' . . . . . . . . . rr_1xwp 1 . 1 . 170 . 1 1 6 U C3' C 1.615 -7.961 6.786 . . . 1.0 . . . . . . . . . . . . A . 6 U C3' . . . . . . . . . rr_1xwp 1 . 1 . 171 . 1 1 6 U C4 C 1.021 -6.026 1.459 . . . 1.0 . . . . . . . . . . . . A . 6 U C4 . . . . . . . . . rr_1xwp 1 . 1 . 172 . 1 1 6 U C4' C 1.505 -6.607 7.497 . . . 1.0 . . . . . . . . . . . . A . 6 U C4' . . . . . . . . . rr_1xwp 1 . 1 . 173 . 1 1 6 U C5 C 2.061 -6.168 2.466 . . . 1.0 . . . . . . . . . . . . A . 6 U C5 . . . . . . . . . rr_1xwp 1 . 1 . 174 . 1 1 6 U C5' C 2.841 -6.079 8.038 . . . 1.0 . . . . . . . . . . . . A . 6 U C5' . . . . . . . . . rr_1xwp 1 . 1 . 175 . 1 1 6 U C6 C 1.752 -6.237 3.788 . . . 1.0 . . . . . . . . . . . . A . 6 U C6 . . . . . . . . . rr_1xwp 1 . 1 . 176 . 1 1 6 U H1' H -0.916 -6.166 5.901 . . . 1.0 . . . . . . . . . . . . A . 6 U H1' . . . . . . . . . rr_1xwp 1 . 1 . 177 . 1 1 6 U H2' H 0.349 -8.586 5.125 . . . 1.0 . . . . . . . . . . . . A . 6 U H2' . . . . . . . . . rr_1xwp 1 . 1 . 178 . 1 1 6 U H3 H -1.012 -5.702 1.322 . . . 1.0 . . . . . . . . . . . . A . 6 U H3 . . . . . . . . . rr_1xwp 1 . 1 . 179 . 1 1 6 U H3' H 2.448 -7.940 6.082 . . . 1.0 . . . . . . . . . . . . A . 6 U H3' . . . . . . . . . rr_1xwp 1 . 1 . 180 . 1 1 6 U H4' H 0.797 -6.689 8.325 . . . 1.0 . . . . . . . . . . . . A . 6 U H4' . . . . . . . . . rr_1xwp 1 . 1 . 181 . 1 1 6 U H5 H 3.094 -6.224 2.155 . . . 1.0 . . . . . . . . . . . . A . 6 U H5 . . . . . . . . . rr_1xwp 1 . 1 . 182 . 1 1 6 U H5' H 2.693 -5.074 8.438 . . . 1.0 . . . . . . . . . . . . A . 6 U H5' . . . . . . . . . rr_1xwp 1 . 1 . 183 . 1 1 6 U H5'' H 3.172 -6.735 8.845 . . . 1.0 . . . . . . . . . . . . A . 6 U H5'' . . . . . . . . . rr_1xwp 1 . 1 . 184 . 1 1 6 U H6 H 2.558 -6.345 4.499 . . . 1.0 . . . . . . . . . . . . A . 6 U H6 . . . . . . . . . rr_1xwp 1 . 1 . 185 . 1 1 6 U HO2' H -1.596 -8.261 6.390 . . . 1.0 . . . . . . . . . . . . A . 6 U HO2' . . . . . . . . . rr_1xwp 1 . 1 . 186 . 1 1 6 U N1 N 0.444 -6.177 4.234 . . . 1.0 . . . . . . . . . . . . A . 6 U N1 . . . . . . . . . rr_1xwp 1 . 1 . 187 . 1 1 6 U N3 N -0.264 -5.888 1.977 . . . 1.0 . . . . . . . . . . . . A . 6 U N3 . . . . . . . . . rr_1xwp 1 . 1 . 188 . 1 1 6 U O2 O -1.769 -5.768 3.667 . . . 1.0 . . . . . . . . . . . . A . 6 U O2 . . . . . . . . . rr_1xwp 1 . 1 . 189 . 1 1 6 U O2' O -0.761 -8.400 6.846 . . . 1.0 . . . . . . . . . . . . A . 6 U O2' . . . . . . . . . rr_1xwp 1 . 1 . 190 . 1 1 6 U O3' O 1.768 -9.038 7.703 . . . 1.0 . . . . . . . . . . . . A . 6 U O3' . . . . . . . . . rr_1xwp 1 . 1 . 191 . 1 1 6 U O4 O 1.201 -5.998 0.245 . . . 1.0 . . . . . . . . . . . . A . 6 U O4 . . . . . . . . . rr_1xwp 1 . 1 . 192 . 1 1 6 U O4' O 0.948 -5.724 6.536 . . . 1.0 . . . . . . . . . . . . A . 6 U O4' . . . . . . . . . rr_1xwp 1 . 1 . 193 . 1 1 6 U O5' O 3.814 -6.065 7.008 . . . 1.0 . . . . . . . . . . . . A . 6 U O5' . . . . . . . . . rr_1xwp 1 . 1 . 194 . 1 1 6 U OP1 O 5.719 -5.810 8.631 . . . 1.0 . . . . . . . . . . . . A . 6 U OP1 . . . . . . . . . rr_1xwp 1 . 1 . 195 . 1 1 6 U OP2 O 6.155 -5.996 6.117 . . . 1.0 . . . . . . . . . . . . A . 6 U OP2 . . . . . . . . . rr_1xwp 1 . 1 . 196 . 1 1 6 U P P 5.316 -5.517 7.238 . . . 1.0 . . . . . . . . . . . . A . 6 U P . . . . . . . . . rr_1xwp 1 . 1 . 197 . 1 1 7 C C1' C -2.622 -12.480 5.191 . . . 1.0 . . . . . . . . . . . . A . 7 C C1' . . . . . . . . . rr_1xwp 1 . 1 . 198 . 1 1 7 C C2 C -5.008 -11.996 5.768 . . . 1.0 . . . . . . . . . . . . A . 7 C C2 . . . . . . . . . rr_1xwp 1 . 1 . 199 . 1 1 7 C C2' C -2.258 -11.662 3.941 . . . 1.0 . . . . . . . . . . . . A . 7 C C2' . . . . . . . . . rr_1xwp 1 . 1 . 200 . 1 1 7 C C3' C -0.730 -11.525 3.997 . . . 1.0 . . . . . . . . . . . . A . 7 C C3' . . . . . . . . . rr_1xwp 1 . 1 . 201 . 1 1 7 C C4 C -5.558 -10.386 7.411 . . . 1.0 . . . . . . . . . . . . A . 7 C C4 . . . . . . . . . rr_1xwp 1 . 1 . 202 . 1 1 7 C C4' C -0.341 -12.618 4.995 . . . 1.0 . . . . . . . . . . . . A . 7 C C4' . . . . . . . . . rr_1xwp 1 . 1 . 203 . 1 1 7 C C5 C -4.167 -10.084 7.638 . . . 1.0 . . . . . . . . . . . . A . 7 C C5 . . . . . . . . . rr_1xwp 1 . 1 . 204 . 1 1 7 C C5' C 0.986 -12.333 5.718 . . . 1.0 . . . . . . . . . . . . A . 7 C C5' . . . . . . . . . rr_1xwp 1 . 1 . 205 . 1 1 7 C C6 C -3.259 -10.779 6.904 . . . 1.0 . . . . . . . . . . . . A . 7 C C6 . . . . . . . . . rr_1xwp 1 . 1 . 206 . 1 1 7 C H1' H -2.972 -13.476 4.909 . . . 1.0 . . . . . . . . . . . . A . 7 C H1' . . . . . . . . . rr_1xwp 1 . 1 . 207 . 1 1 7 C H2' H -2.695 -10.667 4.000 . . . 1.0 . . . . . . . . . . . . A . 7 C H2' . . . . . . . . . rr_1xwp 1 . 1 . 208 . 1 1 7 C H3' H -0.493 -10.555 4.433 . . . 1.0 . . . . . . . . . . . . A . 7 C H3' . . . . . . . . . rr_1xwp 1 . 1 . 209 . 1 1 7 C H4' H -0.276 -13.579 4.478 . . . 1.0 . . . . . . . . . . . . A . 7 C H4' . . . . . . . . . rr_1xwp 1 . 1 . 210 . 1 1 7 C H41 H -7.477 -9.945 7.894 . . . 1.0 . . . . . . . . . . . . A . 7 C H41 . . . . . . . . . rr_1xwp 1 . 1 . 211 . 1 1 7 C H42 H -6.259 -9.028 8.761 . . . 1.0 . . . . . . . . . . . . A . 7 C H42 . . . . . . . . . rr_1xwp 1 . 1 . 212 . 1 1 7 C H5 H -3.825 -9.331 8.334 . . . 1.0 . . . . . . . . . . . . A . 7 C H5 . . . . . . . . . rr_1xwp 1 . 1 . 213 . 1 1 7 C H5' H 1.178 -13.136 6.433 . . . 1.0 . . . . . . . . . . . . A . 7 C H5' . . . . . . . . . rr_1xwp 1 . 1 . 214 . 1 1 7 C H5'' H 1.788 -12.322 4.977 . . . 1.0 . . . . . . . . . . . . A . 7 C H5'' . . . . . . . . . rr_1xwp 1 . 1 . 215 . 1 1 7 C H6 H -2.209 -10.547 6.997 . . . 1.0 . . . . . . . . . . . . A . 7 C H6 . . . . . . . . . rr_1xwp 1 . 1 . 216 . 1 1 7 C HO2' H -2.467 -11.787 2.014 . . . 1.0 . . . . . . . . . . . . A . 7 C HO2' . . . . . . . . . rr_1xwp 1 . 1 . 217 . 1 1 7 C N1 N -3.644 -11.756 6.008 . . . 1.0 . . . . . . . . . . . . A . 7 C N1 . . . . . . . . . rr_1xwp 1 . 1 . 218 . 1 1 7 C N3 N -5.934 -11.295 6.495 . . . 1.0 . . . . . . . . . . . . A . 7 C N3 . . . . . . . . . rr_1xwp 1 . 1 . 219 . 1 1 7 C N4 N -6.509 -9.732 8.082 . . . 1.0 . . . . . . . . . . . . A . 7 C N4 . . . . . . . . . rr_1xwp 1 . 1 . 220 . 1 1 7 C O2 O -5.372 -12.812 4.924 . . . 1.0 . . . . . . . . . . . . A . 7 C O2 . . . . . . . . . rr_1xwp 1 . 1 . 221 . 1 1 7 C O2' O -2.718 -12.319 2.774 . . . 1.0 . . . . . . . . . . . . A . 7 C O2' . . . . . . . . . rr_1xwp 1 . 1 . 222 . 1 1 7 C O3' O -0.068 -11.692 2.749 . . . 1.0 . . . . . . . . . . . . A . 7 C O3' . . . . . . . . . rr_1xwp 1 . 1 . 223 . 1 1 7 C O4' O -1.417 -12.681 5.911 . . . 1.0 . . . . . . . . . . . . A . 7 C O4' . . . . . . . . . rr_1xwp 1 . 1 . 224 . 1 1 7 C O5' O 0.939 -11.083 6.393 . . . 1.0 . . . . . . . . . . . . A . 7 C O5' . . . . . . . . . rr_1xwp 1 . 1 . 225 . 1 1 7 C OP1 O 2.335 -11.360 8.449 . . . 1.0 . . . . . . . . . . . . A . 7 C OP1 . . . . . . . . . rr_1xwp 1 . 1 . 226 . 1 1 7 C OP2 O 3.350 -10.401 6.308 . . . 1.0 . . . . . . . . . . . . A . 7 C OP2 . . . . . . . . . rr_1xwp 1 . 1 . 227 . 1 1 7 C P P 2.202 -10.527 7.234 . . . 1.0 . . . . . . . . . . . . A . 7 C P . . . . . . . . . rr_1xwp 1 . 1 . 228 . 1 1 8 G C1' C -5.137 -8.656 2.832 . . . 1.0 . . . . . . . . . . . . A . 8 G C1' . . . . . . . . . rr_1xwp 1 . 1 . 229 . 1 1 8 G C2 C -7.365 -6.869 6.179 . . . 1.0 . . . . . . . . . . . . A . 8 G C2 . . . . . . . . . rr_1xwp 1 . 1 . 230 . 1 1 8 G C2' C -5.422 -7.537 1.822 . . . 1.0 . . . . . . . . . . . . A . 8 G C2' . . . . . . . . . rr_1xwp 1 . 1 . 231 . 1 1 8 G C3' C -4.029 -7.344 1.223 . . . 1.0 . . . . . . . . . . . . A . 8 G C3' . . . . . . . . . rr_1xwp 1 . 1 . 232 . 1 1 8 G C4 C -5.480 -7.565 5.113 . . . 1.0 . . . . . . . . . . . . A . 8 G C4 . . . . . . . . . rr_1xwp 1 . 1 . 233 . 1 1 8 G C4' C -3.522 -8.788 1.152 . . . 1.0 . . . . . . . . . . . . A . 8 G C4' . . . . . . . . . rr_1xwp 1 . 1 . 234 . 1 1 8 G C5 C -4.657 -7.254 6.176 . . . 1.0 . . . . . . . . . . . . A . 8 G C5 . . . . . . . . . rr_1xwp 1 . 1 . 235 . 1 1 8 G C5' C -1.988 -8.834 1.227 . . . 1.0 . . . . . . . . . . . . A . 8 G C5' . . . . . . . . . rr_1xwp 1 . 1 . 236 . 1 1 8 G C6 C -5.233 -6.752 7.391 . . . 1.0 . . . . . . . . . . . . A . 8 G C6 . . . . . . . . . rr_1xwp 1 . 1 . 237 . 1 1 8 G C8 C -3.406 -8.047 4.663 . . . 1.0 . . . . . . . . . . . . A . 8 G C8 . . . . . . . . . rr_1xwp 1 . 1 . 238 . 1 1 8 G H1 H -7.075 -6.167 8.110 . . . 1.0 . . . . . . . . . . . . A . 8 G H1 . . . . . . . . . rr_1xwp 1 . 1 . 239 . 1 1 8 G H1' H -6.028 -9.261 3.010 . . . 1.0 . . . . . . . . . . . . A . 8 G H1' . . . . . . . . . rr_1xwp 1 . 1 . 240 . 1 1 8 G H2' H -5.804 -6.632 2.294 . . . 1.0 . . . . . . . . . . . . A . 8 G H2' . . . . . . . . . rr_1xwp 1 . 1 . 241 . 1 1 8 G H21 H -9.081 -6.234 7.081 . . . 1.0 . . . . . . . . . . . . A . 8 G H21 . . . . . . . . . rr_1xwp 1 . 1 . 242 . 1 1 8 G H22 H -9.257 -6.849 5.450 . . . 1.0 . . . . . . . . . . . . A . 8 G H22 . . . . . . . . . rr_1xwp 1 . 1 . 243 . 1 1 8 G H3' H -3.419 -6.796 1.944 . . . 1.0 . . . . . . . . . . . . A . 8 G H3' . . . . . . . . . rr_1xwp 1 . 1 . 244 . 1 1 8 G H4' H -3.862 -9.261 0.229 . . . 1.0 . . . . . . . . . . . . A . 8 G H4' . . . . . . . . . rr_1xwp 1 . 1 . 245 . 1 1 8 G H5' H -1.567 -8.360 0.338 . . . 1.0 . . . . . . . . . . . . A . 8 G H5' . . . . . . . . . rr_1xwp 1 . 1 . 246 . 1 1 8 G H5'' H -1.669 -8.273 2.103 . . . 1.0 . . . . . . . . . . . . A . 8 G H5'' . . . . . . . . . rr_1xwp 1 . 1 . 247 . 1 1 8 G H8 H -2.526 -8.389 4.146 . . . 1.0 . . . . . . . . . . . . A . 8 G H8 . . . . . . . . . rr_1xwp 1 . 1 . 248 . 1 1 8 G HO2' H -6.010 -8.783 0.442 . . . 1.0 . . . . . . . . . . . . A . 8 G HO2' . . . . . . . . . rr_1xwp 1 . 1 . 249 . 1 1 8 G N1 N -6.613 -6.553 7.301 . . . 1.0 . . . . . . . . . . . . A . 8 G N1 . . . . . . . . . rr_1xwp 1 . 1 . 250 . 1 1 8 G N2 N -8.677 -6.633 6.247 . . . 1.0 . . . . . . . . . . . . A . 8 G N2 . . . . . . . . . rr_1xwp 1 . 1 . 251 . 1 1 8 G N3 N -6.836 -7.397 5.057 . . . 1.0 . . . . . . . . . . . . A . 8 G N3 . . . . . . . . . rr_1xwp 1 . 1 . 252 . 1 1 8 G N7 N -3.339 -7.551 5.865 . . . 1.0 . . . . . . . . . . . . A . 8 G N7 . . . . . . . . . rr_1xwp 1 . 1 . 253 . 1 1 8 G N9 N -4.674 -8.104 4.136 . . . 1.0 . . . . . . . . . . . . A . 8 G N9 . . . . . . . . . rr_1xwp 1 . 1 . 254 . 1 1 8 G O2' O -6.354 -7.987 0.854 . . . 1.0 . . . . . . . . . . . . A . 8 G O2' . . . . . . . . . rr_1xwp 1 . 1 . 255 . 1 1 8 G O3' O -4.033 -6.702 -0.044 . . . 1.0 . . . . . . . . . . . . A . 8 G O3' . . . . . . . . . rr_1xwp 1 . 1 . 256 . 1 1 8 G O4' O -4.128 -9.469 2.244 . . . 1.0 . . . . . . . . . . . . A . 8 G O4' . . . . . . . . . rr_1xwp 1 . 1 . 257 . 1 1 8 G O5' O -1.520 -10.168 1.325 . . . 1.0 . . . . . . . . . . . . A . 8 G O5' . . . . . . . . . rr_1xwp 1 . 1 . 258 . 1 1 8 G O6 O -4.665 -6.509 8.452 . . . 1.0 . . . . . . . . . . . . A . 8 G O6 . . . . . . . . . rr_1xwp 1 . 1 . 259 . 1 1 8 G OP1 O 0.646 -11.060 0.430 . . . 1.0 . . . . . . . . . . . . A . 8 G OP1 . . . . . . . . . rr_1xwp 1 . 1 . 260 . 1 1 8 G OP2 O 0.645 -9.331 2.316 . . . 1.0 . . . . . . . . . . . . A . 8 G OP2 . . . . . . . . . rr_1xwp 1 . 1 . 261 . 1 1 8 G P P 0.029 -10.504 1.654 . . . 1.0 . . . . . . . . . . . . A . 8 G P . . . . . . . . . rr_1xwp 1 . 1 . 262 . 1 1 9 C C1' C -6.404 -3.682 4.650 . . . 1.0 . . . . . . . . . . . . A . 9 C C1' . . . . . . . . . rr_1xwp 1 . 1 . 263 . 1 1 9 C C2 C -5.538 -3.503 6.977 . . . 1.0 . . . . . . . . . . . . A . 9 C C2 . . . . . . . . . rr_1xwp 1 . 1 . 264 . 1 1 9 C C2' C -6.905 -2.251 4.421 . . . 1.0 . . . . . . . . . . . . A . 9 C C2' . . . . . . . . . rr_1xwp 1 . 1 . 265 . 1 1 9 C C3' C -6.108 -1.836 3.185 . . . 1.0 . . . . . . . . . . . . A . 9 C C3' . . . . . . . . . rr_1xwp 1 . 1 . 266 . 1 1 9 C C4 C -3.251 -3.804 7.483 . . . 1.0 . . . . . . . . . . . . A . 9 C C4 . . . . . . . . . rr_1xwp 1 . 1 . 267 . 1 1 9 C C4' C -6.149 -3.148 2.394 . . . 1.0 . . . . . . . . . . . . A . 9 C C4' . . . . . . . . . rr_1xwp 1 . 1 . 268 . 1 1 9 C C5 C -2.923 -3.961 6.089 . . . 1.0 . . . . . . . . . . . . A . 9 C C5 . . . . . . . . . rr_1xwp 1 . 1 . 269 . 1 1 9 C C5' C -5.003 -3.264 1.378 . . . 1.0 . . . . . . . . . . . . A . 9 C C5' . . . . . . . . . rr_1xwp 1 . 1 . 270 . 1 1 9 C C6 C -3.949 -3.904 5.201 . . . 1.0 . . . . . . . . . . . . A . 9 C C6 . . . . . . . . . rr_1xwp 1 . 1 . 271 . 1 1 9 C H1' H -7.207 -4.308 5.044 . . . 1.0 . . . . . . . . . . . . A . 9 C H1' . . . . . . . . . rr_1xwp 1 . 1 . 272 . 1 1 9 C H2' H -6.708 -1.598 5.263 . . . 1.0 . . . . . . . . . . . . A . 9 C H2' . . . . . . . . . rr_1xwp 1 . 1 . 273 . 1 1 9 C H3' H -5.069 -1.633 3.458 . . . 1.0 . . . . . . . . . . . . A . 9 C H3' . . . . . . . . . rr_1xwp 1 . 1 . 274 . 1 1 9 C H4' H -7.110 -3.239 1.881 . . . 1.0 . . . . . . . . . . . . A . 9 C H4' . . . . . . . . . rr_1xwp 1 . 1 . 275 . 1 1 9 C H41 H -2.547 -3.769 9.384 . . . 1.0 . . . . . . . . . . . . A . 9 C H41 . . . . . . . . . rr_1xwp 1 . 1 . 276 . 1 1 9 C H42 H -1.340 -4.062 8.145 . . . 1.0 . . . . . . . . . . . . A . 9 C H42 . . . . . . . . . rr_1xwp 1 . 1 . 277 . 1 1 9 C H5 H -1.912 -4.089 5.733 . . . 1.0 . . . . . . . . . . . . A . 9 C H5 . . . . . . . . . rr_1xwp 1 . 1 . 278 . 1 1 9 C H5' H -5.100 -2.484 0.621 . . . 1.0 . . . . . . . . . . . . A . 9 C H5' . . . . . . . . . rr_1xwp 1 . 1 . 279 . 1 1 9 C H5'' H -4.054 -3.134 1.902 . . . 1.0 . . . . . . . . . . . . A . 9 C H5'' . . . . . . . . . rr_1xwp 1 . 1 . 280 . 1 1 9 C H6 H -3.724 -4.018 4.151 . . . 1.0 . . . . . . . . . . . . A . 9 C H6 . . . . . . . . . rr_1xwp 1 . 1 . 281 . 1 1 9 C HO2' H -8.752 -2.547 4.967 . . . 1.0 . . . . . . . . . . . . A . 9 C HO2' . . . . . . . . . rr_1xwp 1 . 1 . 282 . 1 1 9 C N1 N -5.256 -3.706 5.613 . . . 1.0 . . . . . . . . . . . . A . 9 C N1 . . . . . . . . . rr_1xwp 1 . 1 . 283 . 1 1 9 C N3 N -4.511 -3.560 7.880 . . . 1.0 . . . . . . . . . . . . A . 9 C N3 . . . . . . . . . rr_1xwp 1 . 1 . 284 . 1 1 9 C N4 N -2.297 -3.887 8.414 . . . 1.0 . . . . . . . . . . . . A . 9 C N4 . . . . . . . . . rr_1xwp 1 . 1 . 285 . 1 1 9 C O2 O -6.687 -3.292 7.362 . . . 1.0 . . . . . . . . . . . . A . 9 C O2 . . . . . . . . . rr_1xwp 1 . 1 . 286 . 1 1 9 C O2' O -8.299 -2.267 4.168 . . . 1.0 . . . . . . . . . . . . A . 9 C O2' . . . . . . . . . rr_1xwp 1 . 1 . 287 . 1 1 9 C O3' O -6.702 -0.735 2.509 . . . 1.0 . . . . . . . . . . . . A . 9 C O3' . . . . . . . . . rr_1xwp 1 . 1 . 288 . 1 1 9 C O4' O -6.061 -4.185 3.365 . . . 1.0 . . . . . . . . . . . . A . 9 C O4' . . . . . . . . . rr_1xwp 1 . 1 . 289 . 1 1 9 C O5' O -5.055 -4.541 0.765 . . . 1.0 . . . . . . . . . . . . A . 9 C O5' . . . . . . . . . rr_1xwp 1 . 1 . 290 . 1 1 9 C OP1 O -4.151 -4.714 -1.573 . . . 1.0 . . . . . . . . . . . . A . 9 C OP1 . . . . . . . . . rr_1xwp 1 . 1 . 291 . 1 1 9 C OP2 O -2.565 -4.749 0.435 . . . 1.0 . . . . . . . . . . . . A . 9 C OP2 . . . . . . . . . rr_1xwp 1 . 1 . 292 . 1 1 9 C P P -3.866 -5.102 -0.174 . . . 1.0 . . . . . . . . . . . . A . 9 C P . . . . . . . . . rr_1xwp 1 . 1 . 293 . 1 1 10 A C1' C -5.641 0.205 8.070 . . . 1.0 . . . . . . . . . . . . A . 10 A C1' . . . . . . . . . rr_1xwp 1 . 1 . 294 . 1 1 10 A C2 C -1.734 -0.557 9.964 . . . 1.0 . . . . . . . . . . . . A . 10 A C2 . . . . . . . . . rr_1xwp 1 . 1 . 295 . 1 1 10 A C2' C -5.690 1.704 8.391 . . . 1.0 . . . . . . . . . . . . A . 10 A C2' . . . . . . . . . rr_1xwp 1 . 1 . 296 . 1 1 10 A C3' C -6.227 2.289 7.082 . . . 1.0 . . . . . . . . . . . . A . 10 A C3' . . . . . . . . . rr_1xwp 1 . 1 . 297 . 1 1 10 A C4 C -3.156 -0.383 8.234 . . . 1.0 . . . . . . . . . . . . A . 10 A C4 . . . . . . . . . rr_1xwp 1 . 1 . 298 . 1 1 10 A C4' C -7.223 1.202 6.666 . . . 1.0 . . . . . . . . . . . . A . 10 A C4' . . . . . . . . . rr_1xwp 1 . 1 . 299 . 1 1 10 A C5 C -2.188 -0.755 7.326 . . . 1.0 . . . . . . . . . . . . A . 10 A C5 . . . . . . . . . rr_1xwp 1 . 1 . 300 . 1 1 10 A C5' C -7.523 1.173 5.152 . . . 1.0 . . . . . . . . . . . . A . 10 A C5' . . . . . . . . . rr_1xwp 1 . 1 . 301 . 1 1 10 A C6 C -0.903 -1.045 7.855 . . . 1.0 . . . . . . . . . . . . A . 10 A C6 . . . . . . . . . rr_1xwp 1 . 1 . 302 . 1 1 10 A C8 C -3.962 -0.462 6.215 . . . 1.0 . . . . . . . . . . . . A . 10 A C8 . . . . . . . . . rr_1xwp 1 . 1 . 303 . 1 1 10 A H1' H -5.825 -0.394 8.964 . . . 1.0 . . . . . . . . . . . . A . 10 A H1' . . . . . . . . . rr_1xwp 1 . 1 . 304 . 1 1 10 A H2 H -1.528 -0.483 11.022 . . . 1.0 . . . . . . . . . . . . A . 10 A H2 . . . . . . . . . rr_1xwp 1 . 1 . 305 . 1 1 10 A H2' H -4.715 2.106 8.659 . . . 1.0 . . . . . . . . . . . . A . 10 A H2' . . . . . . . . . rr_1xwp 1 . 1 . 306 . 1 1 10 A H3' H -5.428 2.328 6.341 . . . 1.0 . . . . . . . . . . . . A . 10 A H3' . . . . . . . . . rr_1xwp 1 . 1 . 307 . 1 1 10 A H4' H -8.161 1.359 7.204 . . . 1.0 . . . . . . . . . . . . A . 10 A H4' . . . . . . . . . rr_1xwp 1 . 1 . 308 . 1 1 10 A H5' H -8.233 0.372 4.944 . . . 1.0 . . . . . . . . . . . . A . 10 A H5' . . . . . . . . . rr_1xwp 1 . 1 . 309 . 1 1 10 A H5'' H -7.975 2.124 4.866 . . . 1.0 . . . . . . . . . . . . A . 10 A H5'' . . . . . . . . . rr_1xwp 1 . 1 . 310 . 1 1 10 A H61 H 1.019 -1.641 7.522 . . . 1.0 . . . . . . . . . . . . A . 10 A H61 . . . . . . . . . rr_1xwp 1 . 1 . 311 . 1 1 10 A H62 H 0.007 -1.541 6.096 . . . 1.0 . . . . . . . . . . . . A . 10 A H62 . . . . . . . . . rr_1xwp 1 . 1 . 312 . 1 1 10 A H8 H -4.645 -0.423 5.390 . . . 1.0 . . . . . . . . . . . . A . 10 A H8 . . . . . . . . . rr_1xwp 1 . 1 . 313 . 1 1 10 A HO2' H -6.725 2.884 9.536 . . . 1.0 . . . . . . . . . . . . A . 10 A HO2' . . . . . . . . . rr_1xwp 1 . 1 . 314 . 1 1 10 A N1 N -0.709 -0.934 9.191 . . . 1.0 . . . . . . . . . . . . A . 10 A N1 . . . . . . . . . rr_1xwp 1 . 1 . 315 . 1 1 10 A N3 N -2.984 -0.262 9.587 . . . 1.0 . . . . . . . . . . . . A . 10 A N3 . . . . . . . . . rr_1xwp 1 . 1 . 316 . 1 1 10 A N6 N 0.123 -1.446 7.097 . . . 1.0 . . . . . . . . . . . . A . 10 A N6 . . . . . . . . . rr_1xwp 1 . 1 . 317 . 1 1 10 A N7 N -2.717 -0.799 6.047 . . . 1.0 . . . . . . . . . . . . A . 10 A N7 . . . . . . . . . rr_1xwp 1 . 1 . 318 . 1 1 10 A N9 N -4.314 -0.184 7.513 . . . 1.0 . . . . . . . . . . . . A . 10 A N9 . . . . . . . . . rr_1xwp 1 . 1 . 319 . 1 1 10 A O2' O -6.591 1.936 9.459 . . . 1.0 . . . . . . . . . . . . A . 10 A O2' . . . . . . . . . rr_1xwp 1 . 1 . 320 . 1 1 10 A O3' O -6.842 3.559 7.263 . . . 1.0 . . . . . . . . . . . . A . 10 A O3' . . . . . . . . . rr_1xwp 1 . 1 . 321 . 1 1 10 A O4' O -6.681 -0.031 7.127 . . . 1.0 . . . . . . . . . . . . A . 10 A O4' . . . . . . . . . rr_1xwp 1 . 1 . 322 . 1 1 10 A O5' O -6.325 0.977 4.415 . . . 1.0 . . . . . . . . . . . . A . 10 A O5' . . . . . . . . . rr_1xwp 1 . 1 . 323 . 1 1 10 A OP1 O -7.301 1.681 2.208 . . . 1.0 . . . . . . . . . . . . A . 10 A OP1 . . . . . . . . . rr_1xwp 1 . 1 . 324 . 1 1 10 A OP2 O -4.860 0.946 2.387 . . . 1.0 . . . . . . . . . . . . A . 10 A OP2 . . . . . . . . . rr_1xwp 1 . 1 . 325 . 1 1 10 A P P -6.273 0.800 2.804 . . . 1.0 . . . . . . . . . . . . A . 10 A P . . . . . . . . . rr_1xwp 1 . 1 . 326 . 1 1 11 C C1' C -1.257 2.785 8.150 . . . 1.0 . . . . . . . . . . . . A . 11 C C1' . . . . . . . . . rr_1xwp 1 . 1 . 327 . 1 1 11 C C2 C -0.376 1.813 6.023 . . . 1.0 . . . . . . . . . . . . A . 11 C C2 . . . . . . . . . rr_1xwp 1 . 1 . 328 . 1 1 11 C C2' C -0.206 3.837 8.533 . . . 1.0 . . . . . . . . . . . . A . 11 C C2' . . . . . . . . . rr_1xwp 1 . 1 . 329 . 1 1 11 C C3' C -1.014 5.130 8.390 . . . 1.0 . . . . . . . . . . . . A . 11 C C3' . . . . . . . . . rr_1xwp 1 . 1 . 330 . 1 1 11 C C4 C -1.785 1.512 4.145 . . . 1.0 . . . . . . . . . . . . A . 11 C C4 . . . . . . . . . rr_1xwp 1 . 1 . 331 . 1 1 11 C C4' C -2.411 4.690 8.859 . . . 1.0 . . . . . . . . . . . . A . 11 C C4' . . . . . . . . . rr_1xwp 1 . 1 . 332 . 1 1 11 C C5 C -2.830 2.283 4.762 . . . 1.0 . . . . . . . . . . . . A . 11 C C5 . . . . . . . . . rr_1xwp 1 . 1 . 333 . 1 1 11 C C5' C -3.531 5.399 8.073 . . . 1.0 . . . . . . . . . . . . A . 11 C C5' . . . . . . . . . rr_1xwp 1 . 1 . 334 . 1 1 11 C C6 C -2.593 2.753 6.011 . . . 1.0 . . . . . . . . . . . . A . 11 C C6 . . . . . . . . . rr_1xwp 1 . 1 . 335 . 1 1 11 C H1' H -1.019 1.836 8.629 . . . 1.0 . . . . . . . . . . . . A . 11 C H1' . . . . . . . . . rr_1xwp 1 . 1 . 336 . 1 1 11 C H2' H 0.673 3.829 7.887 . . . 1.0 . . . . . . . . . . . . A . 11 C H2' . . . . . . . . . rr_1xwp 1 . 1 . 337 . 1 1 11 C H3' H -1.040 5.375 7.327 . . . 1.0 . . . . . . . . . . . . A . 11 C H3' . . . . . . . . . rr_1xwp 1 . 1 . 338 . 1 1 11 C H4' H -2.534 4.903 9.923 . . . 1.0 . . . . . . . . . . . . A . 11 C H4' . . . . . . . . . rr_1xwp 1 . 1 . 339 . 1 1 11 C H41 H -1.264 0.397 2.521 . . . 1.0 . . . . . . . . . . . . A . 11 C H41 . . . . . . . . . rr_1xwp 1 . 1 . 340 . 1 1 11 C H42 H -2.904 1.024 2.518 . . . 1.0 . . . . . . . . . . . . A . 11 C H42 . . . . . . . . . rr_1xwp 1 . 1 . 341 . 1 1 11 C H5 H -3.781 2.484 4.289 . . . 1.0 . . . . . . . . . . . . A . 11 C H5 . . . . . . . . . rr_1xwp 1 . 1 . 342 . 1 1 11 C H5' H -3.642 6.422 8.438 . . . 1.0 . . . . . . . . . . . . A . 11 C H5' . . . . . . . . . rr_1xwp 1 . 1 . 343 . 1 1 11 C H5'' H -3.245 5.450 7.022 . . . 1.0 . . . . . . . . . . . . A . 11 C H5'' . . . . . . . . . rr_1xwp 1 . 1 . 344 . 1 1 11 C H6 H -3.391 3.285 6.492 . . . 1.0 . . . . . . . . . . . . A . 11 C H6 . . . . . . . . . rr_1xwp 1 . 1 . 345 . 1 1 11 C HO2' H 0.695 2.798 9.915 . . . 1.0 . . . . . . . . . . . . A . 11 C HO2' . . . . . . . . . rr_1xwp 1 . 1 . 346 . 1 1 11 C N1 N -1.401 2.521 6.677 . . . 1.0 . . . . . . . . . . . . A . 11 C N1 . . . . . . . . . rr_1xwp 1 . 1 . 347 . 1 1 11 C N3 N -0.606 1.321 4.765 . . . 1.0 . . . . . . . . . . . . A . 11 C N3 . . . . . . . . . rr_1xwp 1 . 1 . 348 . 1 1 11 C N4 N -1.996 0.937 2.959 . . . 1.0 . . . . . . . . . . . . A . 11 C N4 . . . . . . . . . rr_1xwp 1 . 1 . 349 . 1 1 11 C O2 O 0.708 1.618 6.568 . . . 1.0 . . . . . . . . . . . . A . 11 C O2 . . . . . . . . . rr_1xwp 1 . 1 . 350 . 1 1 11 C O2' O 0.188 3.612 9.876 . . . 1.0 . . . . . . . . . . . . A . 11 C O2' . . . . . . . . . rr_1xwp 1 . 1 . 351 . 1 1 11 C O3' O -0.565 6.264 9.125 . . . 1.0 . . . . . . . . . . . . A . 11 C O3' . . . . . . . . . rr_1xwp 1 . 1 . 352 . 1 1 11 C O4' O -2.458 3.272 8.730 . . . 1.0 . . . . . . . . . . . . A . 11 C O4' . . . . . . . . . rr_1xwp 1 . 1 . 353 . 1 1 11 C O5' O -4.764 4.705 8.213 . . . 1.0 . . . . . . . . . . . . A . 11 C O5' . . . . . . . . . rr_1xwp 1 . 1 . 354 . 1 1 11 C OP1 O -6.850 6.020 7.749 . . . 1.0 . . . . . . . . . . . . A . 11 C OP1 . . . . . . . . . rr_1xwp 1 . 1 . 355 . 1 1 11 C OP2 O -5.466 5.064 5.822 . . . 1.0 . . . . . . . . . . . . A . 11 C OP2 . . . . . . . . . rr_1xwp 1 . 1 . 356 . 1 1 11 C P P -6.002 4.942 7.196 . . . 1.0 . . . . . . . . . . . . A . 11 C P . . . . . . . . . rr_1xwp 1 . 1 . 357 . 1 1 12 U C1' C 1.880 5.172 3.577 . . . 1.0 . . . . . . . . . . . . A . 12 U C1' . . . . . . . . . rr_1xwp 1 . 1 . 358 . 1 1 12 U C2 C 1.227 3.928 1.550 . . . 1.0 . . . . . . . . . . . . A . 12 U C2 . . . . . . . . . rr_1xwp 1 . 1 . 359 . 1 1 12 U C2' C 2.263 6.537 2.975 . . . 1.0 . . . . . . . . . . . . A . 12 U C2' . . . . . . . . . rr_1xwp 1 . 1 . 360 . 1 1 12 U C3' C 1.665 7.515 3.989 . . . 1.0 . . . . . . . . . . . . A . 12 U C3' . . . . . . . . . rr_1xwp 1 . 1 . 361 . 1 1 12 U C4 C -1.134 3.412 1.023 . . . 1.0 . . . . . . . . . . . . A . 12 U C4 . . . . . . . . . rr_1xwp 1 . 1 . 362 . 1 1 12 U C4' C 1.906 6.722 5.271 . . . 1.0 . . . . . . . . . . . . A . 12 U C4' . . . . . . . . . rr_1xwp 1 . 1 . 363 . 1 1 12 U C5 C -1.488 4.119 2.245 . . . 1.0 . . . . . . . . . . . . A . 12 U C5 . . . . . . . . . rr_1xwp 1 . 1 . 364 . 1 1 12 U C5' C 1.135 7.266 6.479 . . . 1.0 . . . . . . . . . . . . A . 12 U C5' . . . . . . . . . rr_1xwp 1 . 1 . 365 . 1 1 12 U C6 C -0.528 4.638 3.059 . . . 1.0 . . . . . . . . . . . . A . 12 U C6 . . . . . . . . . rr_1xwp 1 . 1 . 366 . 1 1 12 U H1' H 2.753 4.517 3.622 . . . 1.0 . . . . . . . . . . . . A . 12 U H1' . . . . . . . . . rr_1xwp 1 . 1 . 367 . 1 1 12 U H2' H 1.845 6.704 1.984 . . . 1.0 . . . . . . . . . . . . A . 12 U H2' . . . . . . . . . rr_1xwp 1 . 1 . 368 . 1 1 12 U H3 H 0.519 2.934 -0.095 . . . 1.0 . . . . . . . . . . . . A . 12 U H3 . . . . . . . . . rr_1xwp 1 . 1 . 369 . 1 1 12 U H3' H 0.586 7.595 3.834 . . . 1.0 . . . . . . . . . . . . A . 12 U H3' . . . . . . . . . rr_1xwp 1 . 1 . 370 . 1 1 12 U H4' H 2.975 6.715 5.500 . . . 1.0 . . . . . . . . . . . . A . 12 U H4' . . . . . . . . . rr_1xwp 1 . 1 . 371 . 1 1 12 U H5 H -2.529 4.223 2.512 . . . 1.0 . . . . . . . . . . . . A . 12 U H5 . . . . . . . . . rr_1xwp 1 . 1 . 372 . 1 1 12 U H5' H 1.416 8.309 6.631 . . . 1.0 . . . . . . . . . . . . A . 12 U H5' . . . . . . . . . rr_1xwp 1 . 1 . 373 . 1 1 12 U H5'' H 0.061 7.208 6.297 . . . 1.0 . . . . . . . . . . . . A . 12 U H5'' . . . . . . . . . rr_1xwp 1 . 1 . 374 . 1 1 12 U H6 H -0.834 5.155 3.957 . . . 1.0 . . . . . . . . . . . . A . 12 U H6 . . . . . . . . . rr_1xwp 1 . 1 . 375 . 1 1 12 U HO2' H 3.986 6.074 2.195 . . . 1.0 . . . . . . . . . . . . A . 12 U HO2' . . . . . . . . . rr_1xwp 1 . 1 . 376 . 1 1 12 U N1 N 0.818 4.528 2.750 . . . 1.0 . . . . . . . . . . . . A . 12 U N1 . . . . . . . . . rr_1xwp 1 . 1 . 377 . 1 1 12 U N3 N 0.226 3.386 0.757 . . . 1.0 . . . . . . . . . . . . A . 12 U N3 . . . . . . . . . rr_1xwp 1 . 1 . 378 . 1 1 12 U O2 O 2.401 3.873 1.189 . . . 1.0 . . . . . . . . . . . . A . 12 U O2 . . . . . . . . . rr_1xwp 1 . 1 . 379 . 1 1 12 U O2' O 3.674 6.637 2.909 . . . 1.0 . . . . . . . . . . . . A . 12 U O2' . . . . . . . . . rr_1xwp 1 . 1 . 380 . 1 1 12 U O3' O 2.275 8.798 3.994 . . . 1.0 . . . . . . . . . . . . A . 12 U O3' . . . . . . . . . rr_1xwp 1 . 1 . 381 . 1 1 12 U O4 O -1.915 2.866 0.249 . . . 1.0 . . . . . . . . . . . . A . 12 U O4 . . . . . . . . . rr_1xwp 1 . 1 . 382 . 1 1 12 U O4' O 1.490 5.410 4.924 . . . 1.0 . . . . . . . . . . . . A . 12 U O4' . . . . . . . . . rr_1xwp 1 . 1 . 383 . 1 1 12 U O5' O 1.503 6.498 7.611 . . . 1.0 . . . . . . . . . . . . A . 12 U O5' . . . . . . . . . rr_1xwp 1 . 1 . 384 . 1 1 12 U OP1 O 1.757 6.002 10.043 . . . 1.0 . . . . . . . . . . . . A . 12 U OP1 . . . . . . . . . rr_1xwp 1 . 1 . 385 . 1 1 12 U OP2 O 0.909 8.282 9.271 . . . 1.0 . . . . . . . . . . . . A . 12 U OP2 . . . . . . . . . rr_1xwp 1 . 1 . 386 . 1 1 12 U P P 0.959 6.813 9.098 . . . 1.0 . . . . . . . . . . . . A . 12 U P . . . . . . . . . rr_1xwp 1 . 1 . 387 . 1 1 13 C C1' C 3.503 6.845 -1.427 . . . 1.0 . . . . . . . . . . . . A . 13 C C1' . . . . . . . . . rr_1xwp 1 . 1 . 388 . 1 1 13 C C2 C 1.894 5.493 -2.763 . . . 1.0 . . . . . . . . . . . . A . 13 C C2 . . . . . . . . . rr_1xwp 1 . 1 . 389 . 1 1 13 C C2' C 3.774 8.070 -2.314 . . . 1.0 . . . . . . . . . . . . A . 13 C C2' . . . . . . . . . rr_1xwp 1 . 1 . 390 . 1 1 13 C C3' C 3.619 9.226 -1.324 . . . 1.0 . . . . . . . . . . . . A . 13 C C3' . . . . . . . . . rr_1xwp 1 . 1 . 391 . 1 1 13 C C4 C -0.347 5.208 -2.080 . . . 1.0 . . . . . . . . . . . . A . 13 C C4 . . . . . . . . . rr_1xwp 1 . 1 . 392 . 1 1 13 C C4' C 4.245 8.582 -0.087 . . . 1.0 . . . . . . . . . . . . A . 13 C C4' . . . . . . . . . rr_1xwp 1 . 1 . 393 . 1 1 13 C C5 C -0.181 6.157 -1.007 . . . 1.0 . . . . . . . . . . . . A . 13 C C5 . . . . . . . . . rr_1xwp 1 . 1 . 394 . 1 1 13 C C5' C 3.946 9.332 1.220 . . . 1.0 . . . . . . . . . . . . A . 13 C C5' . . . . . . . . . rr_1xwp 1 . 1 . 395 . 1 1 13 C C6 C 1.058 6.689 -0.840 . . . 1.0 . . . . . . . . . . . . A . 13 C C6 . . . . . . . . . rr_1xwp 1 . 1 . 396 . 1 1 13 C H1' H 4.219 6.048 -1.640 . . . 1.0 . . . . . . . . . . . . A . 13 C H1' . . . . . . . . . rr_1xwp 1 . 1 . 397 . 1 1 13 C H2' H 3.068 8.162 -3.136 . . . 1.0 . . . . . . . . . . . . A . 13 C H2' . . . . . . . . . rr_1xwp 1 . 1 . 398 . 1 1 13 C H3' H 2.559 9.406 -1.132 . . . 1.0 . . . . . . . . . . . . A . 13 C H3' . . . . . . . . . rr_1xwp 1 . 1 . 399 . 1 1 13 C H4' H 5.329 8.536 -0.218 . . . 1.0 . . . . . . . . . . . . A . 13 C H4' . . . . . . . . . rr_1xwp 1 . 1 . 400 . 1 1 13 C H41 H -1.614 3.938 -3.020 . . . 1.0 . . . . . . . . . . . . A . 13 C H41 . . . . . . . . . rr_1xwp 1 . 1 . 401 . 1 1 13 C H42 H -2.285 4.765 -1.627 . . . 1.0 . . . . . . . . . . . . A . 13 C H42 . . . . . . . . . rr_1xwp 1 . 1 . 402 . 1 1 13 C H5 H -0.982 6.451 -0.344 . . . 1.0 . . . . . . . . . . . . A . 13 C H5 . . . . . . . . . rr_1xwp 1 . 1 . 403 . 1 1 13 C H5' H 4.507 8.867 2.031 . . . 1.0 . . . . . . . . . . . . A . 13 C H5' . . . . . . . . . rr_1xwp 1 . 1 . 404 . 1 1 13 C H5'' H 4.284 10.364 1.118 . . . 1.0 . . . . . . . . . . . . A . 13 C H5'' . . . . . . . . . rr_1xwp 1 . 1 . 405 . 1 1 13 C H6 H 1.207 7.419 -0.059 . . . 1.0 . . . . . . . . . . . . A . 13 C H6 . . . . . . . . . rr_1xwp 1 . 1 . 406 . 1 1 13 C HO2' H 5.098 7.349 -3.545 . . . 1.0 . . . . . . . . . . . . A . 13 C HO2' . . . . . . . . . rr_1xwp 1 . 1 . 407 . 1 1 13 C N1 N 2.116 6.330 -1.654 . . . 1.0 . . . . . . . . . . . . A . 13 C N1 . . . . . . . . . rr_1xwp 1 . 1 . 408 . 1 1 13 C N3 N 0.658 4.931 -2.929 . . . 1.0 . . . . . . . . . . . . A . 13 C N3 . . . . . . . . . rr_1xwp 1 . 1 . 409 . 1 1 13 C N4 N -1.518 4.595 -2.259 . . . 1.0 . . . . . . . . . . . . A . 13 C N4 . . . . . . . . . rr_1xwp 1 . 1 . 410 . 1 1 13 C O2 O 2.789 5.260 -3.573 . . . 1.0 . . . . . . . . . . . . A . 13 C O2 . . . . . . . . . rr_1xwp 1 . 1 . 411 . 1 1 13 C O2' O 5.091 7.989 -2.828 . . . 1.0 . . . . . . . . . . . . A . 13 C O2' . . . . . . . . . rr_1xwp 1 . 1 . 412 . 1 1 13 C O3' O 4.278 10.423 -1.718 . . . 1.0 . . . . . . . . . . . . A . 13 C O3' . . . . . . . . . rr_1xwp 1 . 1 . 413 . 1 1 13 C O4' O 3.739 7.253 -0.081 . . . 1.0 . . . . . . . . . . . . A . 13 C O4' . . . . . . . . . rr_1xwp 1 . 1 . 414 . 1 1 13 C O5' O 2.555 9.309 1.499 . . . 1.0 . . . . . . . . . . . . A . 13 C O5' . . . . . . . . . rr_1xwp 1 . 1 . 415 . 1 1 13 C OP1 O 2.685 11.143 3.209 . . . 1.0 . . . . . . . . . . . . A . 13 C OP1 . . . . . . . . . rr_1xwp 1 . 1 . 416 . 1 1 13 C OP2 O 0.468 9.972 2.712 . . . 1.0 . . . . . . . . . . . . A . 13 C OP2 . . . . . . . . . rr_1xwp 1 . 1 . 417 . 1 1 13 C P P 1.939 9.912 2.866 . . . 1.0 . . . . . . . . . . . . A . 13 C P . . . . . . . . . rr_1xwp 1 . 1 . 418 . 1 1 14 C C1' C 3.245 7.561 -6.596 . . . 1.0 . . . . . . . . . . . . A . 14 C C1' . . . . . . . . . rr_1xwp 1 . 1 . 419 . 1 1 14 C C2 C 1.191 6.155 -6.685 . . . 1.0 . . . . . . . . . . . . A . 14 C C2 . . . . . . . . . rr_1xwp 1 . 1 . 420 . 1 1 14 C C2' C 3.224 8.538 -7.787 . . . 1.0 . . . . . . . . . . . . A . 14 C C2' . . . . . . . . . rr_1xwp 1 . 1 . 421 . 1 1 14 C C3' C 3.639 9.864 -7.139 . . . 1.0 . . . . . . . . . . . . A . 14 C C3' . . . . . . . . . rr_1xwp 1 . 1 . 422 . 1 1 14 C C4 C -0.678 6.592 -5.311 . . . 1.0 . . . . . . . . . . . . A . 14 C C4 . . . . . . . . . rr_1xwp 1 . 1 . 423 . 1 1 14 C C4' C 4.606 9.357 -6.068 . . . 1.0 . . . . . . . . . . . . A . 14 C C4' . . . . . . . . . rr_1xwp 1 . 1 . 424 . 1 1 14 C C5 C -0.046 7.765 -4.758 . . . 1.0 . . . . . . . . . . . . A . 14 C C5 . . . . . . . . . rr_1xwp 1 . 1 . 425 . 1 1 14 C C5' C 4.867 10.368 -4.941 . . . 1.0 . . . . . . . . . . . . A . 14 C C5' . . . . . . . . . rr_1xwp 1 . 1 . 426 . 1 1 14 C C6 C 1.208 8.054 -5.195 . . . 1.0 . . . . . . . . . . . . A . 14 C C6 . . . . . . . . . rr_1xwp 1 . 1 . 427 . 1 1 14 C H1' H 3.759 6.637 -6.872 . . . 1.0 . . . . . . . . . . . . A . 14 C H1' . . . . . . . . . rr_1xwp 1 . 1 . 428 . 1 1 14 C H2' H 2.239 8.614 -8.245 . . . 1.0 . . . . . . . . . . . . A . 14 C H2' . . . . . . . . . rr_1xwp 1 . 1 . 429 . 1 1 14 C H3' H 2.774 10.330 -6.661 . . . 1.0 . . . . . . . . . . . . A . 14 C H3' . . . . . . . . . rr_1xwp 1 . 1 . 430 . 1 1 14 C H4' H 5.560 9.106 -6.538 . . . 1.0 . . . . . . . . . . . . A . 14 C H4' . . . . . . . . . rr_1xwp 1 . 1 . 431 . 1 1 14 C H41 H -2.335 5.429 -5.349 . . . 1.0 . . . . . . . . . . . . A . 14 C H41 . . . . . . . . . rr_1xwp 1 . 1 . 432 . 1 1 14 C H42 H -2.405 6.789 -4.242 . . . 1.0 . . . . . . . . . . . . A . 14 C H42 . . . . . . . . . rr_1xwp 1 . 1 . 433 . 1 1 14 C H5 H -0.520 8.408 -4.031 . . . 1.0 . . . . . . . . . . . . A . 14 C H5 . . . . . . . . . rr_1xwp 1 . 1 . 434 . 1 1 14 C H5' H 5.655 9.980 -4.294 . . . 1.0 . . . . . . . . . . . . A . 14 C H5' . . . . . . . . . rr_1xwp 1 . 1 . 435 . 1 1 14 C H5'' H 5.212 11.308 -5.374 . . . 1.0 . . . . . . . . . . . . A . 14 C H5'' . . . . . . . . . rr_1xwp 1 . 1 . 436 . 1 1 14 C H6 H 1.695 8.934 -4.805 . . . 1.0 . . . . . . . . . . . . A . 14 C H6 . . . . . . . . . rr_1xwp 1 . 1 . 437 . 1 1 14 C HO2' H 5.034 8.118 -8.386 . . . 1.0 . . . . . . . . . . . . A . 14 C HO2' . . . . . . . . . rr_1xwp 1 . 1 . 438 . 1 1 14 C N1 N 1.858 7.255 -6.120 . . . 1.0 . . . . . . . . . . . . A . 14 C N1 . . . . . . . . . rr_1xwp 1 . 1 . 439 . 1 1 14 C N3 N -0.063 5.843 -6.241 . . . 1.0 . . . . . . . . . . . . A . 14 C N3 . . . . . . . . . rr_1xwp 1 . 1 . 440 . 1 1 14 C N4 N -1.911 6.246 -4.933 . . . 1.0 . . . . . . . . . . . . A . 14 C N4 . . . . . . . . . rr_1xwp 1 . 1 . 441 . 1 1 14 C O2 O 1.707 5.488 -7.577 . . . 1.0 . . . . . . . . . . . . A . 14 C O2 . . . . . . . . . rr_1xwp 1 . 1 . 442 . 1 1 14 C O2' O 4.154 8.116 -8.770 . . . 1.0 . . . . . . . . . . . . A . 14 C O2' . . . . . . . . . rr_1xwp 1 . 1 . 443 . 1 1 14 C O3' O 4.298 10.766 -8.017 . . . 1.0 . . . . . . . . . . . . A . 14 C O3' . . . . . . . . . rr_1xwp 1 . 1 . 444 . 1 1 14 C O4' O 4.035 8.155 -5.577 . . . 1.0 . . . . . . . . . . . . A . 14 C O4' . . . . . . . . . rr_1xwp 1 . 1 . 445 . 1 1 14 C O5' O 3.677 10.588 -4.201 . . . 1.0 . . . . . . . . . . . . A . 14 C O5' . . . . . . . . . rr_1xwp 1 . 1 . 446 . 1 1 14 C OP1 O 4.578 12.578 -2.965 . . . 1.0 . . . . . . . . . . . . A . 14 C OP1 . . . . . . . . . rr_1xwp 1 . 1 . 447 . 1 1 14 C OP2 O 2.238 11.675 -2.467 . . . 1.0 . . . . . . . . . . . . A . 14 C OP2 . . . . . . . . . rr_1xwp 1 . 1 . 448 . 1 1 14 C P P 3.654 11.430 -2.823 . . . 1.0 . . . . . . . . . . . . A . 14 C P . . . . . . . . . rr_1xwp 1 . 1 . 449 . 1 1 15 A C1' C 0.147 7.212 -11.009 . . . 1.0 . . . . . . . . . . . . A . 15 A C1' . . . . . . . . . rr_1xwp 1 . 1 . 450 . 1 1 15 A C2 C -3.753 5.222 -10.665 . . . 1.0 . . . . . . . . . . . . A . 15 A C2 . . . . . . . . . rr_1xwp 1 . 1 . 451 . 1 1 15 A C2' C -0.415 7.856 -12.285 . . . 1.0 . . . . . . . . . . . . A . 15 A C2' . . . . . . . . . rr_1xwp 1 . 1 . 452 . 1 1 15 A C3' C -0.144 9.328 -11.989 . . . 1.0 . . . . . . . . . . . . A . 15 A C3' . . . . . . . . . rr_1xwp 1 . 1 . 453 . 1 1 15 A C4 C -2.070 6.526 -9.948 . . . 1.0 . . . . . . . . . . . . A . 15 A C4 . . . . . . . . . rr_1xwp 1 . 1 . 454 . 1 1 15 A C4' C 1.241 9.244 -11.341 . . . 1.0 . . . . . . . . . . . . A . 15 A C4' . . . . . . . . . rr_1xwp 1 . 1 . 455 . 1 1 15 A C5 C -2.733 6.856 -8.787 . . . 1.0 . . . . . . . . . . . . A . 15 A C5 . . . . . . . . . rr_1xwp 1 . 1 . 456 . 1 1 15 A C5' C 1.523 10.438 -10.416 . . . 1.0 . . . . . . . . . . . . A . 15 A C5' . . . . . . . . . rr_1xwp 1 . 1 . 457 . 1 1 15 A C6 C -4.016 6.271 -8.615 . . . 1.0 . . . . . . . . . . . . A . 15 A C6 . . . . . . . . . rr_1xwp 1 . 1 . 458 . 1 1 15 A C8 C -0.886 7.892 -8.729 . . . 1.0 . . . . . . . . . . . . A . 15 A C8 . . . . . . . . . rr_1xwp 1 . 1 . 459 . 1 1 15 A H1' H 0.459 6.182 -11.193 . . . 1.0 . . . . . . . . . . . . A . 15 A H1' . . . . . . . . . rr_1xwp 1 . 1 . 460 . 1 1 15 A H2 H -4.181 4.562 -11.405 . . . 1.0 . . . . . . . . . . . . A . 15 A H2 . . . . . . . . . rr_1xwp 1 . 1 . 461 . 1 1 15 A H2' H -1.477 7.668 -12.448 . . . 1.0 . . . . . . . . . . . . A . 15 A H2' . . . . . . . . . rr_1xwp 1 . 1 . 462 . 1 1 15 A H3' H -0.877 9.701 -11.272 . . . 1.0 . . . . . . . . . . . . A . 15 A H3' . . . . . . . . . rr_1xwp 1 . 1 . 463 . 1 1 15 A H4' H 1.996 9.210 -12.130 . . . 1.0 . . . . . . . . . . . . A . 15 A H4' . . . . . . . . . rr_1xwp 1 . 1 . 464 . 1 1 15 A H5' H 1.200 11.353 -10.916 . . . 1.0 . . . . . . . . . . . . A . 15 A H5' . . . . . . . . . rr_1xwp 1 . 1 . 465 . 1 1 15 A H5'' H 0.956 10.329 -9.490 . . . 1.0 . . . . . . . . . . . . A . 15 A H5'' . . . . . . . . . rr_1xwp 1 . 1 . 466 . 1 1 15 A H61 H -5.674 6.021 -7.468 . . . 1.0 . . . . . . . . . . . . A . 15 A H61 . . . . . . . . . rr_1xwp 1 . 1 . 467 . 1 1 15 A H62 H -4.440 7.066 -6.787 . . . 1.0 . . . . . . . . . . . . A . 15 A H62 . . . . . . . . . rr_1xwp 1 . 1 . 468 . 1 1 15 A H8 H -0.080 8.526 -8.397 . . . 1.0 . . . . . . . . . . . . A . 15 A H8 . . . . . . . . . rr_1xwp 1 . 1 . 469 . 1 1 15 A HO2' H 1.252 7.480 -13.228 . . . 1.0 . . . . . . . . . . . . A . 15 A HO2' . . . . . . . . . rr_1xwp 1 . 1 . 470 . 1 1 15 A HO3' H 0.375 9.705 -13.823 . . . 1.0 . . . . . . . . . . . . A . 15 A HO3' . . . . . . . . . rr_1xwp 1 . 1 . 471 . 1 1 15 A N1 N -4.502 5.457 -9.583 . . . 1.0 . . . . . . . . . . . . A . 15 A N1 . . . . . . . . . rr_1xwp 1 . 1 . 472 . 1 1 15 A N3 N -2.533 5.698 -10.936 . . . 1.0 . . . . . . . . . . . . A . 15 A N3 . . . . . . . . . rr_1xwp 1 . 1 . 473 . 1 1 15 A N6 N -4.775 6.476 -7.534 . . . 1.0 . . . . . . . . . . . . A . 15 A N6 . . . . . . . . . rr_1xwp 1 . 1 . 474 . 1 1 15 A N7 N -1.967 7.725 -8.020 . . . 1.0 . . . . . . . . . . . . A . 15 A N7 . . . . . . . . . rr_1xwp 1 . 1 . 475 . 1 1 15 A N9 N -0.873 7.208 -9.924 . . . 1.0 . . . . . . . . . . . . A . 15 A N9 . . . . . . . . . rr_1xwp 1 . 1 . 476 . 1 1 15 A O2' O 0.313 7.404 -13.415 . . . 1.0 . . . . . . . . . . . . A . 15 A O2' . . . . . . . . . rr_1xwp 1 . 1 . 477 . 1 1 15 A O3' O -0.168 10.129 -13.154 . . . 1.0 . . . . . . . . . . . . A . 15 A O3' . . . . . . . . . rr_1xwp 1 . 1 . 478 . 1 1 15 A O4' O 1.276 8.002 -10.644 . . . 1.0 . . . . . . . . . . . . A . 15 A O4' . . . . . . . . . rr_1xwp 1 . 1 . 479 . 1 1 15 A O5' O 2.914 10.542 -10.161 . . . 1.0 . . . . . . . . . . . . A . 15 A O5' . . . . . . . . . rr_1xwp 1 . 1 . 480 . 1 1 15 A OP1 O 4.541 12.421 -9.873 . . . 1.0 . . . . . . . . . . . . A . 15 A OP1 . . . . . . . . . rr_1xwp 1 . 1 . 481 . 1 1 15 A OP2 O 2.405 12.340 -8.470 . . . 1.0 . . . . . . . . . . . . A . 15 A OP2 . . . . . . . . . rr_1xwp 1 . 1 . 482 . 1 1 15 A P P 3.524 11.637 -9.137 . . . 1.0 . . . . . . . . . . . . A . 15 A P . . . . . . . . . rr_1xwp 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID rr_1xwp _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 1xwp.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 rr_1xwp 1 1 1xwp.mr . . DISCOVER 2 distance 'hydrogen bond' simple 11 rr_1xwp 1 1 1xwp.mr . . DISCOVER 3 distance 'hydrogen bond' simple 155 rr_1xwp 1 1 1xwp.mr . . DISCOVER 4 'dihedral angle' 'Not applicable' 'Not applicable' 45 rr_1xwp 1 1 1xwp.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 rr_1xwp 1 stop_ save_ save_Discover_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID rr_1xwp _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . rr_1xwp 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 1 1 G H22 H . . . 1 1 14 14 C O2 O . . . . . . 0.0 2.0 . . . . . A . 1 G H22 . . A . 14 C O2 . 1 . 1 G5' H22 . . . 1 . 14 C O2 . . rr_1xwp 1 2 1 . . 1 1 1 1 G H1 H . . . 1 1 14 14 C N3 N . . . . . . 0.0 2.0 . . . . . A . 1 G H1 . . A . 14 C N3 . 1 . 1 G5' H1 . . . 1 . 14 C N3 . . rr_1xwp 1 3 1 . . 1 1 1 1 G O6 O . . . 1 1 14 14 C H42 H . . . . . . 0.0 2.0 . . . . . A . 1 G O6 . . A . 14 C H42 . 1 . 1 G5' O6 . . . 1 . 14 C H42 . . rr_1xwp 1 4 1 . . 1 1 2 2 G H22 H . . . 1 1 13 13 C O2 O . . . . . . 0.0 2.0 . . . . . A . 2 G H22 . . A . 13 C O2 . 1 . 2 G H22 . . . 1 . 13 C O2 . . rr_1xwp 1 5 1 . . 1 1 2 2 G H1 H . . . 1 1 13 13 C N3 N . . . . . . 0.0 2.0 . . . . . A . 2 G H1 . . A . 13 C N3 . 1 . 2 G H1 . . . 1 . 13 C N3 . . rr_1xwp 1 6 1 . . 1 1 2 2 G O6 O . . . 1 1 13 13 C H42 H . . . . . . 0.0 2.0 . . . . . A . 2 G O6 . . A . 13 C H42 . 1 . 2 G O6 . . . 1 . 13 C H42 . . rr_1xwp 1 7 1 . . 1 1 3 3 A H61 H . . . 1 1 12 12 U O4 O . . . . . . 0.0 2.0 . . . . . A . 3 A H61 . . A . 12 U O4 . 1 . 3 A H61 . . . 1 . 12 U O4 . . rr_1xwp 1 8 1 . . 1 1 3 3 A N1 N . . . 1 1 12 12 U H3 H . . . . . . 0.0 2.0 . . . . . A . 3 A N1 . . A . 12 U H3 . 1 . 3 A N1 . . . 1 . 12 U H3 . . rr_1xwp 1 9 1 . . 1 1 4 4 G H22 H . . . 1 1 11 11 C O2 O . . . . . . 0.0 2.0 . . . . . A . 4 G H22 . . A . 11 C O2 . 1 . 4 G H22 . . . 1 . 11 C O2 . . rr_1xwp 1 10 1 . . 1 1 4 4 G H1 H . . . 1 1 11 11 C N3 N . . . . . . 0.0 2.0 . . . . . A . 4 G H1 . . A . 11 C N3 . 1 . 4 G H1 . . . 1 . 11 C N3 . . rr_1xwp 1 11 1 . . 1 1 4 4 G O6 O . . . 1 1 11 11 C H42 H . . . . . . 0.0 2.0 . . . . . A . 4 G O6 . . A . 11 C H42 . 1 . 4 G O6 . . . 1 . 11 C H42 . . rr_1xwp 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 'BIOSYM restraint 1 distance' 2 1 5 9 rr_1xwp 1 stop_ save_ save_Discover_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID rr_1xwp _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . rr_1xwp 2 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 12 12 U H3 H . . . 1 1 4 4 G H1 H . . . . . . 0.0 6.0 . . . . . A . 12 U H3 . . A . 4 G H1 . 1 . 12 U H3 . . . 1 . 4 G H1 . . rr_1xwp 2 2 1 . . 1 1 2 2 G H1 H . . . 1 1 12 12 U H3 H . . . . . . 0.0 6.0 . . . . . A . 2 G H1 . . A . 12 U H3 . 1 . 2 G H1 . . . 1 . 12 U H3 . . rr_1xwp 2 3 1 . . 1 1 1 1 G H1 H . . . 1 1 2 2 G H1 H . . . . . . 0.0 6.0 . . . . . A . 1 G H1 . . A . 2 G H1 . 1 . 1 G5' H1 . . . 1 . 2 G H1 . . rr_1xwp 2 4 1 . . 1 1 4 4 G H1 H . . . 1 1 11 11 C H5 H . . . . . . 0.0 6.0 . . . . . A . 4 G H1 . . A . 11 C H5 . 1 . 4 G H1 . . . 1 . 11 C H5 . . rr_1xwp 2 5 1 . . 1 1 4 4 G H1 H . . . 1 1 12 12 U H1' H . . . . . . 0.0 6.0 . . . . . A . 4 G H1 . . A . 12 U H1' . 1 . 4 G H1 . . . 1 . 12 U H1' . . rr_1xwp 2 6 1 . . 1 1 4 4 G H1 H . . . 1 1 11 11 C H1' H . . . . . . 0.0 6.0 . . . . . A . 4 G H1 . . A . 11 C H1' . 1 . 4 G H1 . . . 1 . 11 C H1' . . rr_1xwp 2 7 1 . . 1 1 4 4 G H1 H . . . 1 1 11 11 C H42 H . . . . . . 0.0 4.0 . . . . . A . 4 G H1 . . A . 11 C H42 . 1 . 4 G H1 . . . 1 . 11 C H42 . . rr_1xwp 2 8 1 . . 1 1 11 11 C H42 H . . . 1 1 5 5 A H2 H . . . . . . 0.0 6.0 . . . . . A . 11 C H42 . . A . 5 A H2 . 1 . 11 C H42 . . . 1 . 5 A H2 . . rr_1xwp 2 9 1 . . 1 1 2 2 G H1 H . . . 1 1 13 13 C H5 H . . . . . . 0.0 6.0 . . . . . A . 2 G H1 . . A . 13 C H5 . 1 . 2 G H1 . . . 1 . 13 C H5 . . rr_1xwp 2 10 1 . . 1 1 2 2 G H1 H . . . 1 1 14 14 C H5 H . . . . . . 0.0 6.0 . . . . . A . 2 G H1 . . A . 14 C H5 . 1 . 2 G H1 . . . 1 . 14 C H5 . . rr_1xwp 2 11 1 . . 1 1 1 1 G H1 H . . . 1 1 14 14 C H5 H . . . . . . 0.0 6.0 . . . . . A . 1 G H1 . . A . 14 C H5 . 1 . 1 G5' H1 . . . 1 . 14 C H5 . . rr_1xwp 2 12 1 . . 1 1 12 12 U H3 H . . . 1 1 3 3 A H2 H . . . . . . 0.0 4.0 . . . . . A . 12 U H3 . . A . 3 A H2 . 1 . 12 U H3 . . . 1 . 3 A H2 . . rr_1xwp 2 13 1 . . 1 1 1 1 G H8 H . . . 1 1 1 1 G H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 1 G H8 . . A . 1 G H1' . 1 . 1 G5' H8 . . . 1 . 1 G5' H1' . . rr_1xwp 2 14 1 . . 1 1 11 11 C H5 H . . . 1 1 11 11 C H6 H . . . . . 3.0 0.0 3.0 . . . . . A . 11 C H5 . . A . 11 C H6 . 1 . 11 C H5 . . . 1 . 11 C H6 . . rr_1xwp 2 15 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 10 A H8 . . A . 10 A H1' . 1 . 10 A H8 . . . 1 . 10 A H1' . . rr_1xwp 2 16 1 . . 1 1 7 7 C H6 H . . . 1 1 7 7 C H5 H . . . . . 3.0 0.0 3.0 . . . . . A . 7 C H6 . . A . 7 C H5 . 1 . 7 C H6 . . . 1 . 7 C H5 . . rr_1xwp 2 17 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H8 . . A . 8 G H1' . 1 . 8 G H8 . . . 1 . 8 G H1' . . rr_1xwp 2 18 1 . . 1 1 13 13 C H5 H . . . 1 1 13 13 C H6 H . . . . . 3.0 0.0 3.0 . . . . . A . 13 C H5 . . A . 13 C H6 . 1 . 13 C H5 . . . 1 . 13 C H6 . . rr_1xwp 2 19 1 . . 1 1 9 9 C H6 H . . . 1 1 9 9 C H5 H . . . . . 3.0 0.0 3.0 . . . . . A . 9 C H6 . . A . 9 C H5 . 1 . 9 C H6 . . . 1 . 9 C H5 . . rr_1xwp 2 20 1 . . 1 1 7 7 C H6 H . . . 1 1 7 7 C H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 7 C H6 . . A . 7 C H1' . 1 . 7 C H6 . . . 1 . 7 C H1' . . rr_1xwp 2 21 1 . . 1 1 3 3 A H2 H . . . 1 1 4 4 G H1' H . . . . . 4.0 0.0 4.0 . . . . . A . 3 A H2 . . A . 4 G H1' . 1 . 3 A H2 . . . 1 . 4 G H1' . . rr_1xwp 2 22 1 . . 1 1 12 12 U H6 H . . . 1 1 12 12 U H5 H . . . . . 3.0 0.0 3.0 . . . . . A . 12 U H6 . . A . 12 U H5 . 1 . 12 U H6 . . . 1 . 12 U H5 . . rr_1xwp 2 23 1 . . 1 1 14 14 C H5 H . . . 1 1 14 14 C H6 H . . . . . 3.0 0.0 3.0 . . . . . A . 14 C H5 . . A . 14 C H6 . 1 . 14 C H5 . . . 1 . 14 C H6 . . rr_1xwp 2 24 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H5 H . . . . . 3.0 0.0 3.0 . . . . . A . 6 U H6 . . A . 6 U H5 . 1 . 6 U H6 . . . 1 . 6 U H5 . . rr_1xwp 2 25 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 10 A H8 . . A . 10 A H2' . 1 . 10 A H8 . . . 1 . 10 A H2' . . rr_1xwp 2 26 1 . . 1 1 11 11 C H6 H . . . 1 1 10 10 A H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 11 C H6 . . A . 10 A H2' . 1 . 11 C H6 . . . 1 . 10 A H2' . . rr_1xwp 2 27 1 . . 1 1 10 10 A H1' H . . . 1 1 10 10 A H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 10 A H1' . . A . 10 A H2' . 1 . 10 A H1' . . . 1 . 10 A H2' . . rr_1xwp 2 28 1 . . 1 1 1 1 G H8 H . . . 1 1 1 1 G H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 1 G H8 . . A . 1 G H2' . 1 . 1 G5' H8 . . . 1 . 1 G5' H2' . . rr_1xwp 2 29 1 . . 1 1 1 1 G H2' H . . . 1 1 2 2 G H8 H . . . . . 4.0 0.0 4.0 . . . . . A . 1 G H2' . . A . 2 G H8 . 1 . 1 G5' H2' . . . 1 . 2 G H8 . . rr_1xwp 2 30 1 . . 1 1 1 1 G H1' H . . . 1 1 2 2 G H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 1 G H1' . . A . 2 G H1' . 1 . 1 G5' H1' . . . 1 . 2 G H1' . . rr_1xwp 2 31 1 . . 1 1 9 9 C H6 H . . . 1 1 8 8 G H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 9 C H6 . . A . 8 G H3' . 1 . 9 C H6 . . . 1 . 8 G H3' . . rr_1xwp 2 32 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 8 G H8 . . A . 8 G H3' . 1 . 8 G H8 . . . 1 . 8 G H3' . . rr_1xwp 2 33 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H1' . . A . 8 G H3' . 1 . 8 G H1' . . . 1 . 8 G H3' . . rr_1xwp 2 34 1 . . 1 1 5 5 A H8 H . . . 1 1 5 5 A H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 5 A H8 . . A . 5 A H3' . 1 . 5 A H8 . . . 1 . 5 A H3' . . rr_1xwp 2 35 1 . . 1 1 4 4 G H8 H . . . 1 1 3 3 A H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 4 G H8 . . A . 3 A H2' . 1 . 4 G H8 . . . 1 . 3 A H2' . . rr_1xwp 2 36 1 . . 1 1 3 3 A H2' H . . . 1 1 3 3 A H1' H . . . . . 4.0 0.0 4.0 . . . . . A . 3 A H2' . . A . 3 A H1' . 1 . 3 A H2' . . . 1 . 3 A H1' . . rr_1xwp 2 37 1 . . 1 1 3 3 A H8 H . . . 1 1 2 2 G H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 3 A H8 . . A . 2 G H2' . 1 . 3 A H8 . . . 1 . 2 G H2' . . rr_1xwp 2 38 1 . . 1 1 2 2 G H1' H . . . 1 1 2 2 G H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 2 G H1' . . A . 2 G H2' . 1 . 2 G H1' . . . 1 . 2 G H2' . . rr_1xwp 2 39 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 A H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 6 U H6 . . A . 5 A H3' . 1 . 6 U H6 . . . 1 . 5 A H3' . . rr_1xwp 2 40 1 . . 1 1 5 5 A H8 H . . . 1 1 4 4 G H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 5 A H8 . . A . 4 G H2' . 1 . 5 A H8 . . . 1 . 4 G H2' . . rr_1xwp 2 41 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 4 G H1' . . A . 4 G H2' . 1 . 4 G H1' . . . 1 . 4 G H2' . . rr_1xwp 2 42 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H8 . . A . 8 G H2' . 1 . 8 G H8 . . . 1 . 8 G H2' . . rr_1xwp 2 43 1 . . 1 1 10 10 A H1' H . . . 1 1 10 10 A H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 10 A H1' . . A . 10 A H4' . 1 . 10 A H1' . . . 1 . 10 A H4' . . rr_1xwp 2 44 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 8 G H1' . . A . 8 G H2' . 1 . 8 G H1' . . . 1 . 8 G H2' . . rr_1xwp 2 45 1 . . 1 1 9 9 C H6 H . . . 1 1 9 9 C H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 9 C H6 . . A . 9 C H2' . 1 . 9 C H6 . . . 1 . 9 C H2' . . rr_1xwp 2 46 1 . . 1 1 9 9 C H2' H . . . 1 1 9 9 C H1' H . . . . . 4.0 0.0 4.0 . . . . . A . 9 C H2' . . A . 9 C H1' . 1 . 9 C H2' . . . 1 . 9 C H1' . . rr_1xwp 2 47 1 . . 1 1 2 2 G H1' H . . . 1 1 2 2 G H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 2 G H1' . . A . 2 G H4' . 1 . 2 G H1' . . . 1 . 2 G H4' . . rr_1xwp 2 48 1 . . 1 1 13 13 C H6 H . . . 1 1 12 12 U H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 13 C H6 . . A . 12 U H2' . 1 . 13 C H6 . . . 1 . 12 U H2' . . rr_1xwp 2 49 1 . . 1 1 12 12 U H1' H . . . 1 1 12 12 U H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 12 U H1' . . A . 12 U H2' . 1 . 12 U H1' . . . 1 . 12 U H2' . . rr_1xwp 2 50 1 . . 1 1 13 13 C H5 H . . . 1 1 12 12 U H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 13 C H5 . . A . 12 U H2' . 1 . 13 C H5 . . . 1 . 12 U H2' . . rr_1xwp 2 51 1 . . 1 1 3 3 A H1' H . . . 1 1 3 3 A H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 3 A H1' . . A . 3 A H4' . 1 . 3 A H1' . . . 1 . 3 A H4' . . rr_1xwp 2 52 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 4 G H1' . . A . 4 G H4' . 1 . 4 G H1' . . . 1 . 4 G H4' . . rr_1xwp 2 53 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 C H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 10 A H8 . . A . 9 C H3' . 1 . 10 A H8 . . . 1 . 9 C H3' . . rr_1xwp 2 54 1 . . 1 1 5 5 A H1' H . . . 1 1 5 5 A H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 5 A H1' . . A . 5 A H4' . 1 . 5 A H1' . . . 1 . 5 A H4' . . rr_1xwp 2 55 1 . . 1 1 14 14 C H1' H . . . 1 1 14 14 C H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 14 C H1' . . A . 14 C H2' . 1 . 14 C H1' . . . 1 . 14 C H2' . . rr_1xwp 2 56 1 . . 1 1 9 9 C H1' H . . . 1 1 9 9 C H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 9 C H1' . . A . 9 C H4' . 1 . 9 C H1' . . . 1 . 9 C H4' . . rr_1xwp 2 57 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 6 U H6 . . A . 6 U H2' . 1 . 6 U H6 . . . 1 . 6 U H2' . . rr_1xwp 2 58 1 . . 1 1 6 6 U H2' H . . . 1 1 6 6 U H1' H . . . . . 4.0 0.0 4.0 . . . . . A . 6 U H2' . . A . 6 U H1' . 1 . 6 U H2' . . . 1 . 6 U H1' . . rr_1xwp 2 59 1 . . 1 1 14 14 C H6 H . . . 1 1 13 13 C H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 14 C H6 . . A . 13 C H2' . 1 . 14 C H6 . . . 1 . 13 C H2' . . rr_1xwp 2 60 1 . . 1 1 13 13 C H2' H . . . 1 1 13 13 C H1' H . . . . . 4.0 0.0 4.0 . . . . . A . 13 C H2' . . A . 13 C H1' . 1 . 13 C H2' . . . 1 . 13 C H1' . . rr_1xwp 2 61 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 8 G H1' . . A . 8 G H4' . 1 . 8 G H1' . . . 1 . 8 G H4' . . rr_1xwp 2 62 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 A H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 6 U H6 . . A . 5 A H2' . 1 . 6 U H6 . . . 1 . 5 A H2' . . rr_1xwp 2 63 1 . . 1 1 6 6 U H1' H . . . 1 1 6 6 U H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H1' . . A . 6 U H3' . 1 . 6 U H1' . . . 1 . 6 U H3' . . rr_1xwp 2 64 1 . . 1 1 5 5 A H1' H . . . 1 1 5 5 A H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 5 A H1' . . A . 5 A H2' . 1 . 5 A H1' . . . 1 . 5 A H2' . . rr_1xwp 2 65 1 . . 1 1 8 8 G H8 H . . . 1 1 7 7 C H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 8 G H8 . . A . 7 C H2' . 1 . 8 G H8 . . . 1 . 7 C H2' . . rr_1xwp 2 66 1 . . 1 1 7 7 C H6 H . . . 1 1 7 7 C H2' H . . . . . 3.0 0.0 3.0 . . . . . A . 7 C H6 . . A . 7 C H2' . 1 . 7 C H6 . . . 1 . 7 C H2' . . rr_1xwp 2 67 1 . . 1 1 7 7 C H1' H . . . 1 1 7 7 C H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 7 C H1' . . A . 7 C H2' . 1 . 7 C H1' . . . 1 . 7 C H2' . . rr_1xwp 2 68 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 4 G H8 . . A . 4 G H3' . 1 . 4 G H8 . . . 1 . 4 G H3' . . rr_1xwp 2 69 1 . . 1 1 5 5 A H8 H . . . 1 1 4 4 G H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 5 A H8 . . A . 4 G H3' . 1 . 5 A H8 . . . 1 . 4 G H3' . . rr_1xwp 2 70 1 . . 1 1 11 11 C H1' H . . . 1 1 11 11 C H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 11 C H1' . . A . 11 C H2' . 1 . 11 C H1' . . . 1 . 11 C H2' . . rr_1xwp 2 71 1 . . 1 1 15 15 A H1' H . . . 1 1 15 15 A H4' H . . . . . 4.0 0.0 4.0 . . . . . A . 15 A H1' . . A . 15 A H4' . 1 . 15 A3' H1' . . . 1 . 15 A3' H4' . . rr_1xwp 2 72 1 . . 1 1 7 7 C H6 H . . . 1 1 7 7 C H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 7 C H6 . . A . 7 C H4' . 1 . 7 C H6 . . . 1 . 7 C H4' . . rr_1xwp 2 73 1 . . 1 1 7 7 C H1' H . . . 1 1 7 7 C H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 7 C H1' . . A . 7 C H4' . 1 . 7 C H1' . . . 1 . 7 C H4' . . rr_1xwp 2 74 1 . . 1 1 6 6 U H1' H . . . 1 1 6 6 U H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H1' . . A . 6 U H4' . 1 . 6 U H1' . . . 1 . 6 U H4' . . rr_1xwp 2 75 1 . . 1 1 15 15 A H8 H . . . 1 1 15 15 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 15 A H8 . . A . 15 A H2' . 1 . 15 A3' H8 . . . 1 . 15 A3' H2' . . rr_1xwp 2 76 1 . . 1 1 11 11 C H6 H . . . 1 1 10 10 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 11 C H6 . . A . 10 A H8 . 1 . 11 C H6 . . . 1 . 10 A H8 . . rr_1xwp 2 77 1 . . 1 1 13 13 C H6 H . . . 1 1 14 14 C H6 H . . . . . 5.0 0.0 5.0 . . . . . A . 13 C H6 . . A . 14 C H6 . 1 . 13 C H6 . . . 1 . 14 C H6 . . rr_1xwp 2 78 1 . . 1 1 14 14 C H6 H . . . 1 1 15 15 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 14 C H6 . . A . 15 A H8 . 1 . 14 C H6 . . . 1 . 15 A3' H8 . . rr_1xwp 2 79 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 C H6 H . . . . . 7.0 0.0 7.0 . . . . . A . 10 A H8 . . A . 9 C H6 . 1 . 10 A H8 . . . 1 . 9 C H6 . . rr_1xwp 2 80 1 . . 1 1 8 8 G H8 H . . . 1 1 9 9 C H6 H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H8 . . A . 9 C H6 . 1 . 8 G H8 . . . 1 . 9 C H6 . . rr_1xwp 2 81 1 . . 1 1 1 1 G H8 H . . . 1 1 2 2 G H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 1 G H8 . . A . 2 G H8 . 1 . 1 G5' H8 . . . 1 . 2 G H8 . . rr_1xwp 2 82 1 . . 1 1 2 2 G H8 H . . . 1 1 3 3 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 2 G H8 . . A . 3 A H8 . 1 . 2 G H8 . . . 1 . 3 A H8 . . rr_1xwp 2 83 1 . . 1 1 1 1 G H8 H . . . 1 1 15 15 A H2 H . . . . . 7.0 0.0 7.0 . . . . . A . 1 G H8 . . A . 15 A H2 . 1 . 1 G5' H8 . . . 1 . 15 A3' H2 . . rr_1xwp 2 84 1 . . 1 1 8 8 G H8 H . . . 1 1 6 6 U H6 H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H8 . . A . 6 U H6 . 1 . 8 G H8 . . . 1 . 6 U H6 . . rr_1xwp 2 85 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H6 . . A . 5 A H8 . 1 . 6 U H6 . . . 1 . 5 A H8 . . rr_1xwp 2 86 1 . . 1 1 5 5 A H8 H . . . 1 1 4 4 G H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 5 A H8 . . A . 4 G H8 . 1 . 5 A H8 . . . 1 . 4 G H8 . . rr_1xwp 2 87 1 . . 1 1 4 4 G H8 H . . . 1 1 3 3 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 4 G H8 . . A . 3 A H8 . 1 . 4 G H8 . . . 1 . 3 A H8 . . rr_1xwp 2 88 1 . . 1 1 3 3 A H2 H . . . 1 1 4 4 G H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 3 A H2 . . A . 4 G H8 . 1 . 3 A H2 . . . 1 . 4 G H8 . . rr_1xwp 2 89 1 . . 1 1 4 4 G H1' H . . . 1 1 3 3 A H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 4 G H1' . . A . 3 A H1' . 1 . 4 G H1' . . . 1 . 3 A H1' . . rr_1xwp 2 90 1 . . 1 1 3 3 A H1' H . . . 1 1 3 3 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 3 A H1' . . A . 3 A H8 . 1 . 3 A H1' . . . 1 . 3 A H8 . . rr_1xwp 2 91 1 . . 1 1 4 4 G H8 H . . . 1 1 3 3 A H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H8 . . A . 3 A H1' . 1 . 4 G H8 . . . 1 . 3 A H1' . . rr_1xwp 2 92 1 . . 1 1 1 1 G H1' H . . . 1 1 2 2 G H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 1 G H1' . . A . 2 G H8 . 1 . 1 G5' H1' . . . 1 . 2 G H8 . . rr_1xwp 2 93 1 . . 1 1 1 1 G H1' H . . . 1 1 15 15 A H2 H . . . . . 5.0 0.0 5.0 . . . . . A . 1 G H1' . . A . 15 A H2 . 1 . 1 G5' H1' . . . 1 . 15 A3' H2 . . rr_1xwp 2 94 1 . . 1 1 15 15 A H1' H . . . 1 1 15 15 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 15 A H1' . . A . 15 A H8 . 1 . 15 A3' H1' . . . 1 . 15 A3' H8 . . rr_1xwp 2 95 1 . . 1 1 11 11 C H5 H . . . 1 1 10 10 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 11 C H5 . . A . 10 A H8 . 1 . 11 C H5 . . . 1 . 10 A H8 . . rr_1xwp 2 96 1 . . 1 1 5 5 A H8 H . . . 1 1 5 5 A H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 5 A H8 . . A . 5 A H1' . 1 . 5 A H8 . . . 1 . 5 A H1' . . rr_1xwp 2 97 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 A H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H6 . . A . 5 A H1' . 1 . 6 U H6 . . . 1 . 5 A H1' . . rr_1xwp 2 98 1 . . 1 1 4 4 G H1' H . . . 1 1 5 5 A H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 4 G H1' . . A . 5 A H1' . 1 . 4 G H1' . . . 1 . 5 A H1' . . rr_1xwp 2 99 1 . . 1 1 5 5 A H1' H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H1' . . A . 6 U H1' . 1 . 5 A H1' . . . 1 . 6 U H1' . . rr_1xwp 2 100 1 . . 1 1 2 2 G H1' H . . . 1 1 3 3 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 2 G H1' . . A . 3 A H8 . 1 . 2 G H1' . . . 1 . 3 A H8 . . rr_1xwp 2 101 1 . . 1 1 2 2 G H8 H . . . 1 1 2 2 G H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 2 G H8 . . A . 2 G H1' . 1 . 2 G H8 . . . 1 . 2 G H1' . . rr_1xwp 2 102 1 . . 1 1 8 8 G H1' H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H1' . . A . 6 U H1' . 1 . 8 G H1' . . . 1 . 6 U H1' . . rr_1xwp 2 103 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 C H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 10 A H8 . . A . 9 C H1' . 1 . 10 A H8 . . . 1 . 9 C H1' . . rr_1xwp 2 104 1 . . 1 1 9 9 C H6 H . . . 1 1 9 9 C H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 9 C H6 . . A . 9 C H1' . 1 . 9 C H6 . . . 1 . 9 C H1' . . rr_1xwp 2 105 1 . . 1 1 8 8 G H1' H . . . 1 1 9 9 C H6 H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H1' . . A . 9 C H6 . 1 . 8 G H1' . . . 1 . 9 C H6 . . rr_1xwp 2 106 1 . . 1 1 14 14 C H6 H . . . 1 1 13 13 C H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 14 C H6 . . A . 13 C H1' . 1 . 14 C H6 . . . 1 . 13 C H1' . . rr_1xwp 2 107 1 . . 1 1 3 3 A H2 H . . . 1 1 13 13 C H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 3 A H2 . . A . 13 C H1' . 1 . 3 A H2 . . . 1 . 13 C H1' . . rr_1xwp 2 108 1 . . 1 1 13 13 C H6 H . . . 1 1 13 13 C H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 13 C H6 . . A . 13 C H1' . 1 . 13 C H6 . . . 1 . 13 C H1' . . rr_1xwp 2 109 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 C H5 H . . . . . 7.0 0.0 7.0 . . . . . A . 10 A H8 . . A . 9 C H5 . 1 . 10 A H8 . . . 1 . 9 C H5 . . rr_1xwp 2 110 1 . . 1 1 8 8 G H8 H . . . 1 1 7 7 C H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H8 . . A . 7 C H1' . 1 . 8 G H8 . . . 1 . 7 C H1' . . rr_1xwp 2 111 1 . . 1 1 12 12 U H1' H . . . 1 1 12 12 U H6 H . . . . . 5.0 0.0 5.0 . . . . . A . 12 U H1' . . A . 12 U H6 . 1 . 12 U H1' . . . 1 . 12 U H6 . . rr_1xwp 2 112 1 . . 1 1 4 4 G H1' H . . . 1 1 5 5 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H1' . . A . 5 A H8 . 1 . 4 G H1' . . . 1 . 5 A H8 . . rr_1xwp 2 113 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H1' . . A . 4 G H8 . 1 . 4 G H1' . . . 1 . 4 G H8 . . rr_1xwp 2 114 1 . . 1 1 11 11 C H1' H . . . 1 1 11 11 C H6 H . . . . . 7.0 0.0 7.0 . . . . . A . 11 C H1' . . A . 11 C H6 . 1 . 11 C H1' . . . 1 . 11 C H6 . . rr_1xwp 2 115 1 . . 1 1 11 11 C H5 H . . . 1 1 11 11 C H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 11 C H5 . . A . 11 C H1' . 1 . 11 C H5 . . . 1 . 11 C H1' . . rr_1xwp 2 116 1 . . 1 1 13 13 C H5 H . . . 1 1 14 14 C H5 H . . . . . 5.0 0.0 5.0 . . . . . A . 13 C H5 . . A . 14 C H5 . 1 . 13 C H5 . . . 1 . 14 C H5 . . rr_1xwp 2 117 1 . . 1 1 8 8 G H8 H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 8 G H8 . . A . 6 U H1' . 1 . 8 G H8 . . . 1 . 6 U H1' . . rr_1xwp 2 118 1 . . 1 1 7 7 C H6 H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 7 C H6 . . A . 6 U H1' . 1 . 7 C H6 . . . 1 . 6 U H1' . . rr_1xwp 2 119 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H6 . . A . 6 U H1' . 1 . 6 U H6 . . . 1 . 6 U H1' . . rr_1xwp 2 120 1 . . 1 1 9 9 C H5 H . . . 1 1 6 6 U H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 9 C H5 . . A . 6 U H1' . 1 . 9 C H5 . . . 1 . 6 U H1' . . rr_1xwp 2 121 1 . . 1 1 6 6 U H5 H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H5 . . A . 6 U H1' . 1 . 6 U H5 . . . 1 . 6 U H1' . . rr_1xwp 2 122 1 . . 1 1 6 6 U H5 H . . . 1 1 5 5 A H8 H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H5 . . A . 5 A H8 . 1 . 6 U H5 . . . 1 . 5 A H8 . . rr_1xwp 2 123 1 . . 1 1 6 6 U H5 H . . . 1 1 5 5 A H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H5 . . A . 5 A H1' . 1 . 6 U H5 . . . 1 . 5 A H1' . . rr_1xwp 2 124 1 . . 1 1 9 9 C H5 H . . . 1 1 8 8 G H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 9 C H5 . . A . 8 G H3' . 1 . 9 C H5 . . . 1 . 8 G H3' . . rr_1xwp 2 125 1 . . 1 1 3 3 A H2' H . . . 1 1 3 3 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 3 A H2' . . A . 3 A H8 . 1 . 3 A H2' . . . 1 . 3 A H8 . . rr_1xwp 2 126 1 . . 1 1 4 4 G H1' H . . . 1 1 3 3 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H1' . . A . 3 A H2' . 1 . 4 G H1' . . . 1 . 3 A H2' . . rr_1xwp 2 127 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H8 . . A . 4 G H2' . 1 . 4 G H8 . . . 1 . 4 G H2' . . rr_1xwp 2 128 1 . . 1 1 5 5 A H3' H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H3' . . A . 6 U H1' . 1 . 5 A H3' . . . 1 . 6 U H1' . . rr_1xwp 2 129 1 . . 1 1 6 6 U H5 H . . . 1 1 5 5 A H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 6 U H5 . . A . 5 A H3' . 1 . 6 U H5 . . . 1 . 5 A H3' . . rr_1xwp 2 130 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 C H2' H . . . . . 4.0 0.0 4.0 . . . . . A . 10 A H8 . . A . 9 C H2' . 1 . 10 A H8 . . . 1 . 9 C H2' . . rr_1xwp 2 131 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 4 G H8 . . A . 4 G H4' . 1 . 4 G H8 . . . 1 . 4 G H4' . . rr_1xwp 2 132 1 . . 1 1 9 9 C H1' H . . . 1 1 9 9 C H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 9 C H1' . . A . 9 C H3' . 1 . 9 C H1' . . . 1 . 9 C H3' . . rr_1xwp 2 133 1 . . 1 1 7 7 C H6 H . . . 1 1 6 6 U H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 7 C H6 . . A . 6 U H2' . 1 . 7 C H6 . . . 1 . 6 U H2' . . rr_1xwp 2 134 1 . . 1 1 6 6 U H5 H . . . 1 1 6 6 U H2' H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H5 . . A . 6 U H2' . 1 . 6 U H5 . . . 1 . 6 U H2' . . rr_1xwp 2 135 1 . . 1 1 13 13 C H6 H . . . 1 1 13 13 C H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 13 C H6 . . A . 13 C H2' . 1 . 13 C H6 . . . 1 . 13 C H2' . . rr_1xwp 2 136 1 . . 1 1 6 6 U H5 H . . . 1 1 5 5 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H5 . . A . 5 A H2' . 1 . 6 U H5 . . . 1 . 5 A H2' . . rr_1xwp 2 137 1 . . 1 1 5 5 A H8 H . . . 1 1 5 5 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 5 A H8 . . A . 5 A H2' . 1 . 5 A H8 . . . 1 . 5 A H2' . . rr_1xwp 2 138 1 . . 1 1 7 7 C H5 H . . . 1 1 7 7 C H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 7 C H5 . . A . 7 C H2' . 1 . 7 C H5 . . . 1 . 7 C H2' . . rr_1xwp 2 139 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H4' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H6 . . A . 6 U H4' . 1 . 6 U H6 . . . 1 . 6 U H4' . . rr_1xwp 2 140 1 . . 1 1 6 6 U H5 H . . . 1 1 6 6 U H4' H . . . . . 7.0 0.0 7.0 . . . . . A . 6 U H5 . . A . 6 U H4' . 1 . 6 U H5 . . . 1 . 6 U H4' . . rr_1xwp 2 141 1 . . 1 1 8 8 G H8 H . . . 1 1 9 9 C H5 H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H8 . . A . 9 C H5 . 1 . 8 G H8 . . . 1 . 9 C H5 . . rr_1xwp 2 142 1 . . 1 1 12 12 U H1' H . . . 1 1 13 13 C H6 H . . . . . 5.0 0.0 5.0 . . . . . A . 12 U H1' . . A . 13 C H6 . 1 . 12 U H1' . . . 1 . 13 C H6 . . rr_1xwp 2 143 1 . . 1 1 14 14 C H2' H . . . 1 1 15 15 A H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 14 C H2' . . A . 15 A H1' . 1 . 14 C H2' . . . 1 . 15 A3' H1' . . rr_1xwp 2 144 1 . . 1 1 9 9 C H6 H . . . 1 1 9 9 C H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 9 C H6 . . A . 9 C H3' . 1 . 9 C H6 . . . 1 . 9 C H3' . . rr_1xwp 2 145 1 . . 1 1 8 8 G H2' H . . . 1 1 9 9 C H1' H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H2' . . A . 9 C H1' . 1 . 8 G H2' . . . 1 . 9 C H1' . . rr_1xwp 2 146 1 . . 1 1 8 8 G H8 H . . . 1 1 6 6 U H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 8 G H8 . . A . 6 U H2' . 1 . 8 G H8 . . . 1 . 6 U H2' . . rr_1xwp 2 147 1 . . 1 1 6 6 U H5 H . . . 1 1 6 6 U H3' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H5 . . A . 6 U H3' . 1 . 6 U H5 . . . 1 . 6 U H3' . . rr_1xwp 2 148 1 . . 1 1 6 6 U H1' H . . . 1 1 5 5 A H2' H . . . . . 5.0 0.0 5.0 . . . . . A . 6 U H1' . . A . 5 A H2' . 1 . 6 U H1' . . . 1 . 5 A H2' . . rr_1xwp 2 149 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 6 U H6 . . A . 6 U H3' . 1 . 6 U H6 . . . 1 . 6 U H3' . . rr_1xwp 2 150 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A H3' H . . . . . 4.0 0.0 4.0 . . . . . A . 10 A H8 . . A . 10 A H3' . 1 . 10 A H8 . . . 1 . 10 A H3' . . rr_1xwp 2 151 1 . . 1 1 5 5 A H2 H . . . 1 1 6 6 U H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H2 . . A . 6 U H1' . 1 . 5 A H2 . . . 1 . 6 U H1' . . rr_1xwp 2 152 1 . . 1 1 5 5 A H2 H . . . 1 1 10 10 A H8 H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H2 . . A . 10 A H8 . 1 . 5 A H2 . . . 1 . 10 A H8 . . rr_1xwp 2 153 1 . . 1 1 10 10 A H2' H . . . 1 1 10 10 A H2 H . . . . . 7.0 0.0 7.0 . . . . . A . 10 A H2' . . A . 10 A H2 . 1 . 10 A H2' . . . 1 . 10 A H2 . . rr_1xwp 2 154 1 . . 1 1 5 5 A H2 H . . . 1 1 9 9 C H1' H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H2 . . A . 9 C H1' . 1 . 5 A H2 . . . 1 . 9 C H1' . . rr_1xwp 2 155 1 . . 1 1 5 5 A H2 H . . . 1 1 9 9 C H2' H . . . . . 7.0 0.0 7.0 . . . . . A . 5 A H2 . . A . 9 C H2' . 1 . 5 A H2 . . . 1 . 9 C H2' . . rr_1xwp 2 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 NOE_distance 1 1 1 13 rr_1xwp 2 stop_ save_ save_Discover_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_4 _Torsion_angle_constraint_list.Entry_ID rr_1xwp _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . rr_1xwp 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 1 1 G C3' C . . 1 1 1 1 G O3' O . . 1 1 2 2 G P P . . 1 1 2 2 G O5' O . -120.0 120.0 . . . A . 1 G C3' . . A . 1 G O3' . . A . 2 G P . . A . 2 G O5' . 1 . 1 G5' C3' . . . 1 . 1 G5' O3' . . . 1 . 2 G P . . . 1 . 2 G O5' . . rr_1xwp 1 2 . . 1 1 1 1 G O3' O . . 1 1 2 2 G P P . . 1 1 2 2 G O5' O . . 1 1 2 2 G C5' C . -120.0 120.0 . . . A . 1 G O3' . . A . 2 G P . . A . 2 G O5' . . A . 2 G C5' . 1 . 1 G5' O3' . . . 1 . 2 G P . . . 1 . 2 G O5' . . . 1 . 2 G C5' . . rr_1xwp 1 3 . . 1 1 2 2 G P P . . 1 1 2 2 G O5' O . . 1 1 2 2 G C5' C . . 1 1 2 2 G C4' C . 150.0 210.0 . . . A . 2 G P . . A . 2 G O5' . . A . 2 G C5' . . A . 2 G C4' . 1 . 2 G P . . . 1 . 2 G O5' . . . 1 . 2 G C5' . . . 1 . 2 G C4' . . rr_1xwp 1 4 . . 1 1 2 2 G C5' C . . 1 1 2 2 G C4' C . . 1 1 2 2 G C3' C . . 1 1 2 2 G O3' O . 65.0 125.0 . . . A . 2 G C5' . . A . 2 G C4' . . A . 2 G C3' . . A . 2 G O3' . 1 . 2 G C5' . . . 1 . 2 G C4' . . . 1 . 2 G C3' . . . 1 . 2 G O3' . . rr_1xwp 1 5 . . 1 1 2 2 G C4' C . . 1 1 2 2 G C3' C . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . 170.0 250.0 . . . A . 2 G C4' . . A . 2 G C3' . . A . 2 G O3' . . A . 3 A P . 1 . 2 G C4' . . . 1 . 2 G C3' . . . 1 . 2 G O3' . . . 1 . 3 A P . . rr_1xwp 1 6 . . 1 1 2 2 G C3' C . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . -120.0 120.0 . . . A . 2 G C3' . . A . 2 G O3' . . A . 3 A P . . A . 3 A O5' . 1 . 2 G C3' . . . 1 . 2 G O3' . . . 1 . 3 A P . . . 1 . 3 A O5' . . rr_1xwp 1 7 . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . -120.0 120.0 . . . A . 2 G O3' . . A . 3 A P . . A . 3 A O5' . . A . 3 A C5' . 1 . 2 G O3' . . . 1 . 3 A P . . . 1 . 3 A O5' . . . 1 . 3 A C5' . . rr_1xwp 1 8 . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . . 1 1 3 3 A C4' C . 150.0 210.0 . . . A . 3 A P . . A . 3 A O5' . . A . 3 A C5' . . A . 3 A C4' . 1 . 3 A P . . . 1 . 3 A O5' . . . 1 . 3 A C5' . . . 1 . 3 A C4' . . rr_1xwp 1 9 . . 1 1 3 3 A C5' C . . 1 1 3 3 A C4' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . 65.0 125.0 . . . A . 3 A C5' . . A . 3 A C4' . . A . 3 A C3' . . A . 3 A O3' . 1 . 3 A C5' . . . 1 . 3 A C4' . . . 1 . 3 A C3' . . . 1 . 3 A O3' . . rr_1xwp 1 10 . . 1 1 3 3 A C4' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . . 1 1 4 4 G P P . 170.0 250.0 . . . A . 3 A C4' . . A . 3 A C3' . . A . 3 A O3' . . A . 4 G P . 1 . 3 A C4' . . . 1 . 3 A C3' . . . 1 . 3 A O3' . . . 1 . 4 G P . . rr_1xwp 1 11 . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . . 1 1 4 4 G P P . . 1 1 4 4 G O5' O . -120.0 120.0 . . . A . 3 A C3' . . A . 3 A O3' . . A . 4 G P . . A . 4 G O5' . 1 . 3 A C3' . . . 1 . 3 A O3' . . . 1 . 4 G P . . . 1 . 4 G O5' . . rr_1xwp 1 12 . . 1 1 11 11 C C3' C . . 1 1 11 11 C O3' O . . 1 1 12 12 U P P . . 1 1 12 12 U O5' O . -120.0 120.0 . . . A . 11 C C3' . . A . 11 C O3' . . A . 12 U P . . A . 12 U O5' . 1 . 11 C C3' . . . 1 . 11 C O3' . . . 1 . 12 U P . . . 1 . 12 U O5' . . rr_1xwp 1 13 . . 1 1 11 11 C O3' O . . 1 1 12 12 U P P . . 1 1 12 12 U O5' O . . 1 1 12 12 U C5' C . -120.0 120.0 . . . A . 11 C O3' . . A . 12 U P . . A . 12 U O5' . . A . 12 U C5' . 1 . 11 C O3' . . . 1 . 12 U P . . . 1 . 12 U O5' . . . 1 . 12 U C5' . . rr_1xwp 1 14 . . 1 1 12 12 U P P . . 1 1 12 12 U O5' O . . 1 1 12 12 U C5' C . . 1 1 12 12 U C4' C . 150.0 210.0 . . . A . 12 U P . . A . 12 U O5' . . A . 12 U C5' . . A . 12 U C4' . 1 . 12 U P . . . 1 . 12 U O5' . . . 1 . 12 U C5' . . . 1 . 12 U C4' . . rr_1xwp 1 15 . . 1 1 12 12 U C5' C . . 1 1 12 12 U C4' C . . 1 1 12 12 U C3' C . . 1 1 12 12 U O3' O . 65.0 125.0 . . . A . 12 U C5' . . A . 12 U C4' . . A . 12 U C3' . . A . 12 U O3' . 1 . 12 U C5' . . . 1 . 12 U C4' . . . 1 . 12 U C3' . . . 1 . 12 U O3' . . rr_1xwp 1 16 . . 1 1 12 12 U C4' C . . 1 1 12 12 U C3' C . . 1 1 12 12 U O3' O . . 1 1 13 13 C P P . 170.0 250.0 . . . A . 12 U C4' . . A . 12 U C3' . . A . 12 U O3' . . A . 13 C P . 1 . 12 U C4' . . . 1 . 12 U C3' . . . 1 . 12 U O3' . . . 1 . 13 C P . . rr_1xwp 1 17 . . 1 1 12 12 U C3' C . . 1 1 12 12 U O3' O . . 1 1 13 13 C P P . . 1 1 13 13 C O5' O . -120.0 120.0 . . . A . 12 U C3' . . A . 12 U O3' . . A . 13 C P . . A . 13 C O5' . 1 . 12 U C3' . . . 1 . 12 U O3' . . . 1 . 13 C P . . . 1 . 13 C O5' . . rr_1xwp 1 18 . . 1 1 12 12 U O3' O . . 1 1 13 13 C P P . . 1 1 13 13 C O5' O . . 1 1 13 13 C C5' C . -120.0 120.0 . . . A . 12 U O3' . . A . 13 C P . . A . 13 C O5' . . A . 13 C C5' . 1 . 12 U O3' . . . 1 . 13 C P . . . 1 . 13 C O5' . . . 1 . 13 C C5' . . rr_1xwp 1 19 . . 1 1 13 13 C P P . . 1 1 13 13 C O5' O . . 1 1 13 13 C C5' C . . 1 1 13 13 C C4' C . 150.0 210.0 . . . A . 13 C P . . A . 13 C O5' . . A . 13 C C5' . . A . 13 C C4' . 1 . 13 C P . . . 1 . 13 C O5' . . . 1 . 13 C C5' . . . 1 . 13 C C4' . . rr_1xwp 1 20 . . 1 1 13 13 C C5' C . . 1 1 13 13 C C4' C . . 1 1 13 13 C C3' C . . 1 1 13 13 C O3' O . 65.0 125.0 . . . A . 13 C C5' . . A . 13 C C4' . . A . 13 C C3' . . A . 13 C O3' . 1 . 13 C C5' . . . 1 . 13 C C4' . . . 1 . 13 C C3' . . . 1 . 13 C O3' . . rr_1xwp 1 21 . . 1 1 13 13 C C4' C . . 1 1 13 13 C C3' C . . 1 1 13 13 C O3' O . . 1 1 14 14 C P P . 170.0 250.0 . . . A . 13 C C4' . . A . 13 C C3' . . A . 13 C O3' . . A . 14 C P . 1 . 13 C C4' . . . 1 . 13 C C3' . . . 1 . 13 C O3' . . . 1 . 14 C P . . rr_1xwp 1 22 . . 1 1 13 13 C C3' C . . 1 1 13 13 C O3' O . . 1 1 14 14 C P P . . 1 1 14 14 C O5' O . -120.0 120.0 . . . A . 13 C C3' . . A . 13 C O3' . . A . 14 C P . . A . 14 C O5' . 1 . 13 C C3' . . . 1 . 13 C O3' . . . 1 . 14 C P . . . 1 . 14 C O5' . . rr_1xwp 1 23 . . 1 1 13 13 C O3' O . . 1 1 14 14 C P P . . 1 1 14 14 C O5' O . . 1 1 14 14 C C5' C . -120.0 120.0 . . . A . 13 C O3' . . A . 14 C P . . A . 14 C O5' . . A . 14 C C5' . 1 . 13 C O3' . . . 1 . 14 C P . . . 1 . 14 C O5' . . . 1 . 14 C C5' . . rr_1xwp 1 24 . . 1 1 14 14 C P P . . 1 1 14 14 C O5' O . . 1 1 14 14 C C5' C . . 1 1 14 14 C C4' C . 150.0 210.0 . . . A . 14 C P . . A . 14 C O5' . . A . 14 C C5' . . A . 14 C C4' . 1 . 14 C P . . . 1 . 14 C O5' . . . 1 . 14 C C5' . . . 1 . 14 C C4' . . rr_1xwp 1 25 . . 1 1 14 14 C C5' C . . 1 1 14 14 C C4' C . . 1 1 14 14 C C3' C . . 1 1 14 14 C O3' O . 65.0 125.0 . . . A . 14 C C5' . . A . 14 C C4' . . A . 14 C C3' . . A . 14 C O3' . 1 . 14 C C5' . . . 1 . 14 C C4' . . . 1 . 14 C C3' . . . 1 . 14 C O3' . . rr_1xwp 1 26 . . 1 1 14 14 C C4' C . . 1 1 14 14 C C3' C . . 1 1 14 14 C O3' O . . 1 1 15 15 A P P . 170.0 250.0 . . . A . 14 C C4' . . A . 14 C C3' . . A . 14 C O3' . . A . 15 A P . 1 . 14 C C4' . . . 1 . 14 C C3' . . . 1 . 14 C O3' . . . 1 . 15 A3' P . . rr_1xwp 1 27 . . 1 1 14 14 C C3' C . . 1 1 14 14 C O3' O . . 1 1 15 15 A P P . . 1 1 15 15 A O5' O . -120.0 120.0 . . . A . 14 C C3' . . A . 14 C O3' . . A . 15 A P . . A . 15 A O5' . 1 . 14 C C3' . . . 1 . 14 C O3' . . . 1 . 15 A3' P . . . 1 . 15 A3' O5' . . rr_1xwp 1 28 . . 1 1 14 14 C O3' O . . 1 1 15 15 A P P . . 1 1 15 15 A O5' O . . 1 1 15 15 A C5' C . -120.0 120.0 . . . A . 14 C O3' . . A . 15 A P . . A . 15 A O5' . . A . 15 A C5' . 1 . 14 C O3' . . . 1 . 15 A3' P . . . 1 . 15 A3' O5' . . . 1 . 15 A3' C5' . . rr_1xwp 1 29 . . 1 1 15 15 A P P . . 1 1 15 15 A O5' O . . 1 1 15 15 A C5' C . . 1 1 15 15 A C4' C . 150.0 210.0 . . . A . 15 A P . . A . 15 A O5' . . A . 15 A C5' . . A . 15 A C4' . 1 . 15 A3' P . . . 1 . 15 A3' O5' . . . 1 . 15 A3' C5' . . . 1 . 15 A3' C4' . . rr_1xwp 1 30 . . 1 1 15 15 A C5' C . . 1 1 15 15 A C4' C . . 1 1 15 15 A C3' C . . 1 1 15 15 A O3' O . 65.0 125.0 . . . A . 15 A C5' . . A . 15 A C4' . . A . 15 A C3' . . A . 15 A O3' . 1 . 15 A3' C5' . . . 1 . 15 A3' C4' . . . 1 . 15 A3' C3' . . . 1 . 15 A3' O3' . . rr_1xwp 1 31 . . 1 1 5 5 A P P . . 1 1 5 5 A O5' O . . 1 1 5 5 A C5' C . . 1 1 5 5 A C4' C . 150.0 210.0 . . . A . 5 A P . . A . 5 A O5' . . A . 5 A C5' . . A . 5 A C4' . 1 . 5 A P . . . 1 . 5 A O5' . . . 1 . 5 A C5' . . . 1 . 5 A C4' . . rr_1xwp 1 32 . . 1 1 6 6 U P P . . 1 1 6 6 U O5' O . . 1 1 6 6 U C5' C . . 1 1 6 6 U C4' C . 150.0 210.0 . . . A . 6 U P . . A . 6 U O5' . . A . 6 U C5' . . A . 6 U C4' . 1 . 6 U P . . . 1 . 6 U O5' . . . 1 . 6 U C5' . . . 1 . 6 U C4' . . rr_1xwp 1 33 . . 1 1 7 7 C P P . . 1 1 7 7 C O5' O . . 1 1 7 7 C C5' C . . 1 1 7 7 C C4' C . 150.0 210.0 . . . A . 7 C P . . A . 7 C O5' . . A . 7 C C5' . . A . 7 C C4' . 1 . 7 C P . . . 1 . 7 C O5' . . . 1 . 7 C C5' . . . 1 . 7 C C4' . . rr_1xwp 1 34 . . 1 1 9 9 C P P . . 1 1 9 9 C O5' O . . 1 1 9 9 C C5' C . . 1 1 9 9 C C4' C . 150.0 210.0 . . . A . 9 C P . . A . 9 C O5' . . A . 9 C C5' . . A . 9 C C4' . 1 . 9 C P . . . 1 . 9 C O5' . . . 1 . 9 C C5' . . . 1 . 9 C C4' . . rr_1xwp 1 35 . . 1 1 10 10 A P P . . 1 1 10 10 A O5' O . . 1 1 10 10 A C5' C . . 1 1 10 10 A C4' C . 150.0 210.0 . . . A . 10 A P . . A . 10 A O5' . . A . 10 A C5' . . A . 10 A C4' . 1 . 10 A P . . . 1 . 10 A O5' . . . 1 . 10 A C5' . . . 1 . 10 A C4' . . rr_1xwp 1 36 . . 1 1 11 11 C P P . . 1 1 11 11 C O5' O . . 1 1 11 11 C C5' C . . 1 1 11 11 C C4' C . 150.0 210.0 . . . A . 11 C P . . A . 11 C O5' . . A . 11 C C5' . . A . 11 C C4' . 1 . 11 C P . . . 1 . 11 C O5' . . . 1 . 11 C C5' . . . 1 . 11 C C4' . . rr_1xwp 1 37 . . 1 1 4 4 G C4' C . . 1 1 4 4 G C3' C . . 1 1 4 4 G O3' O . . 1 1 5 5 A P P . 170.0 300.0 . . . A . 4 G C4' . . A . 4 G C3' . . A . 4 G O3' . . A . 5 A P . 1 . 4 G C4' . . . 1 . 4 G C3' . . . 1 . 4 G O3' . . . 1 . 5 A P . . rr_1xwp 1 38 . . 1 1 5 5 A C4' C . . 1 1 5 5 A C3' C . . 1 1 5 5 A O3' O . . 1 1 6 6 U P P . 170.0 300.0 . . . A . 5 A C4' . . A . 5 A C3' . . A . 5 A O3' . . A . 6 U P . 1 . 5 A C4' . . . 1 . 5 A C3' . . . 1 . 5 A O3' . . . 1 . 6 U P . . rr_1xwp 1 39 . . 1 1 6 6 U C4' C . . 1 1 6 6 U C3' C . . 1 1 6 6 U O3' O . . 1 1 7 7 C P P . 170.0 300.0 . . . A . 6 U C4' . . A . 6 U C3' . . A . 6 U O3' . . A . 7 C P . 1 . 6 U C4' . . . 1 . 6 U C3' . . . 1 . 6 U O3' . . . 1 . 7 C P . . rr_1xwp 1 40 . . 1 1 8 8 G C4' C . . 1 1 8 8 G C3' C . . 1 1 8 8 G O3' O . . 1 1 9 9 C P P . 170.0 300.0 . . . A . 8 G C4' . . A . 8 G C3' . . A . 8 G O3' . . A . 9 C P . 1 . 8 G C4' . . . 1 . 8 G C3' . . . 1 . 8 G O3' . . . 1 . 9 C P . . rr_1xwp 1 41 . . 1 1 9 9 C C4' C . . 1 1 9 9 C C3' C . . 1 1 9 9 C O3' O . . 1 1 10 10 A P P . 170.0 300.0 . . . A . 9 C C4' . . A . 9 C C3' . . A . 9 C O3' . . A . 10 A P . 1 . 9 C C4' . . . 1 . 9 C C3' . . . 1 . 9 C O3' . . . 1 . 10 A P . . rr_1xwp 1 42 . . 1 1 10 10 A C4' C . . 1 1 10 10 A C3' C . . 1 1 10 10 A O3' O . . 1 1 11 11 C P P . 170.0 300.0 . . . A . 10 A C4' . . A . 10 A C3' . . A . 10 A O3' . . A . 11 C P . 1 . 10 A C4' . . . 1 . 10 A C3' . . . 1 . 10 A O3' . . . 1 . 11 C P . . rr_1xwp 1 43 . . 1 1 4 4 G C5' C . . 1 1 4 4 G C4' C . . 1 1 4 4 G C3' C . . 1 1 4 4 G O3' O . 65.0 125.0 . . . A . 4 G C5' . . A . 4 G C4' . . A . 4 G C3' . . A . 4 G O3' . 1 . 4 G C5' . . . 1 . 4 G C4' . . . 1 . 4 G C3' . . . 1 . 4 G O3' . . rr_1xwp 1 44 . . 1 1 5 5 A C5' C . . 1 1 5 5 A C4' C . . 1 1 5 5 A C3' C . . 1 1 5 5 A O3' O . 65.0 125.0 . . . A . 5 A C5' . . A . 5 A C4' . . A . 5 A C3' . . A . 5 A O3' . 1 . 5 A C5' . . . 1 . 5 A C4' . . . 1 . 5 A C3' . . . 1 . 5 A O3' . . rr_1xwp 1 45 . . 1 1 11 11 C C5' C . . 1 1 11 11 C C4' C . . 1 1 11 11 C C3' C . . 1 1 11 11 C O3' O . 65.0 125.0 . . . A . 11 C C5' . . A . 11 C C4' . . A . 11 C C3' . . A . 11 C O3' . 1 . 11 C C5' . . . 1 . 11 C C4' . . . 1 . 11 C C3' . . . 1 . 11 C O3' . . rr_1xwp 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 NMR_dihedral 1 1 2 13 rr_1xwp 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID rr_1xwp _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment "*HEADER RNA 02-NOV-04 1XWP *TITLE SOLUTION STRUCTURE OF AUCGCA LOOP *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: 5'- *COMPND 3 R(*GP*GP*AP*GP*AP*UP*CP*GP*CP*AP*CP*UP*CP*CP*A)-3'; *COMPND 4 CHAIN: A; *COMPND 5 SYNONYM: AUCGCA HEXA-NUCLEOTIDE LOOP; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES *KEYWDS HAIRPIN LOOP *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR T.SAKAMOTO, A.OGURO, G.KAWAI, T.OHTSU, Y.NAKAMURA *REVDAT 1 15-FEB-05 1XWP 0" save_