data_26842 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR resonance assignments for the tetramethylrhodamine binding RNA aptamer 3 in complex with the ligand 5-carboxy-tetramethylrhodamine ; _BMRB_accession_number 26842 _BMRB_flat_file_name bmr26842.str _Entry_type original _Submission_date 2016-07-01 _Accession_date 2016-07-01 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Chemical shift assignment of an aptamer binding to tetramethylrhodamine' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Elke Duchardt-Ferner . . 2 Juen Michael . . 3 Kreutz Christoph . . 4 Wohnert Jens . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 415 "13C chemical shifts" 382 "15N chemical shifts" 157 "31P chemical shifts" 3 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2017-03-14 update BMRB 'update entry citation' 2016-10-13 original author 'original release' stop_ _Original_release_date 2016-10-13 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR resonance assignments for the tetramethylrhodamine binding RNA aptamer 3 in complex with the ligand 5-carboxy-tetramethylrhodamine ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 27730489 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Duchardt-Ferner Elke . . 2 Juen Michael . . 3 Kreutz Christoph . . 4 Wohnert Jens . . stop_ _Journal_abbreviation 'Biomol. NMR Assign.' _Journal_volume 11 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 29 _Page_last 34 _Year 2017 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name TMR-3_48nt-5-TAMRA _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label TMR-3_48nt $TMR-3_48nt stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details 'ligand 5-carboxy-tetramethylrhodamine: C25H22N2O5' save_ ######################## # Monomeric polymers # ######################## save_TMR-3_48nt _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common TMR-3_48nt _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 48 _Mol_residue_sequence ; GGACGACUGAACCGAAAGGU UCUUGGCUGCUUCGGCAGAG GUACGUCC ; loop_ _Residue_seq_code _Residue_label 1 G 2 G 3 A 4 C 5 G 6 A 7 C 8 U 9 G 10 A 11 A 12 C 13 C 14 G 15 A 16 A 17 A 18 G 19 G 20 U 21 U 22 C 23 U 24 U 25 G 26 G 27 C 28 U 29 G 30 C 31 U 32 U 33 C 34 G 35 G 36 C 37 A 38 G 39 A 40 G 41 G 42 U 43 A 44 C 45 G 46 U 47 C 48 C stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $TMR-3_48nt . . . . . . stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $TMR-3_48nt 'reverse transcriptase' . Escherichia coli . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_unlabeled_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM 'natural abundance' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 5 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' Na-Glutamate 130 mM 'natural abundance' H2O 95 v/v 'natural abundance' stop_ save_ save_13C-15N_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM '[U-13C; U-15N]' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 5 v/v 'natural abundance' H2O 95 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' Na-Glutamate 130 mM 'natural abundance' stop_ save_ save_15N_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM [U-15N] 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 5 v/v 'natural abundance' H2O 95 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' K-glutamate 130 mM 'natural abundance' stop_ save_ save_A-C-13C-15N_sample_H2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM '[U-13C; U-15N]-Ade,Cyt' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 5 v/v 'natural abundance' H2O 95 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' K-glutamate 130 mM 'natural abundance' stop_ save_ save_G-U-13C-15N_sample_H2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM '[U-13C; U-15N]-Gua,Ura' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 5 v/v 'natural abundance' H2O 95 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' Na-Glutamate 130 mM 'natural abundance' stop_ save_ save_A-C-13C-15N_sample_D2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM '[U-13C; U-15N]-Ade,Cyt' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 100 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' K-glutamate 130 mM 'natural abundance' stop_ save_ save_G-U-13C-15N_sample_D2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TMR-3_48nt 1.2 mM '[U-13C; U-15N]-Gua,Ura' 5-Carboxy-Tetramethylrhodamine 1.4 mM 'natural abundance' D2O 100 v/v 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' Na-Glutamate 130 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 3.2 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task acquisition processing stop_ _Details . save_ save_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_950_MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 950 _Details '5 mm z-gradient 1H,[13C,15N]-TCI cryogenic probe' save_ save_800_MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details '5 mm z-gradient 1H,[13C,15N]-TCI cryogenic probe' save_ save_600_MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details '5 mm z-gradient 1H,[13C,15N]-TCI cryogenic probe' save_ save_700_MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details '5 mm z-gradient 1H,[13C,15N]-TCI cryogenic probe' save_ save_600_MHz_HCP _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details '5 mm z-gradient 1H,[13C,31P]-TCI cryogenic probe' save_ ############################# # NMR applied experiments # ############################# save_3D_1H-13C_NOESY_aromatic_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $13C-15N_sample save_ save_3D_1H-13C_NOESY_aliphatic_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $13C-15N_sample save_ save_3D_1H-13C_NOESY_aromatic_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $A-C-13C-15N_sample_H2O save_ save_3D_1H-13C_NOESY_aliphatic_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $A-C-13C-15N_sample_D2O save_ save_3D_1H-13C_NOESY_aromatic_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $G-U-13C-15N_sample_H2O save_ save_3D_1H-13C_NOESY_aliphatic_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $G-U-13C-15N_sample_D2O save_ save_2D_1H-1H_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $15N_sample save_ save_2D_1H-15N_HSQC_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $15N_sample save_ save_2D_1H-15N_HSQC_NH2_only_9 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC NH2 only' _Sample_label $15N_sample save_ save_SELLR_HNN-COSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name 'SELLR HNN-COSY' _Sample_label $15N_sample save_ save_HNN-COSY_11 _Saveframe_category NMR_applied_experiment _Experiment_name HNN-COSY _Sample_label $15N_sample save_ save_amino_HNN-COSY_12 _Saveframe_category NMR_applied_experiment _Experiment_name 'amino HNN-COSY' _Sample_label $15N_sample save_ save_H1/H8_13C-HMBC_13 _Saveframe_category NMR_applied_experiment _Experiment_name 'H1/H8 13C-HMBC' _Sample_label $G-U-13C-15N_sample_H2O save_ save_2D_H5(C5C4N3)H3_14 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H5(C5C4N3)H3' _Sample_label $G-U-13C-15N_sample_H2O save_ save_2D_H5(C5C4N4)H4_15 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H5(C5C4N4)H4' _Sample_label $A-C-13C-15N_sample_H2O save_ save_2D_H(C)N_aromatic_16 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)N aromatic' _Sample_label $A-C-13C-15N_sample_D2O save_ save_2D_H(C)N_aliphatic_17 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)N aliphatic' _Sample_label $A-C-13C-15N_sample_D2O save_ save_2D_H(C)N_aromatic_18 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)N aromatic' _Sample_label $G-U-13C-15N_sample_D2O save_ save_2D_H(C)N_aliphatic_19 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)N aliphatic' _Sample_label $G-U-13C-15N_sample_D2O save_ save_3D_HCCH-TOCSY_20 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $A-C-13C-15N_sample_D2O save_ save_3D_HCCH-TOCSY_21 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $G-U-13C-15N_sample_D2O save_ save_3D_HCCH-COSY_22 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $A-C-13C-15N_sample_D2O save_ save_3D_HCCH-COSY_23 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $G-U-13C-15N_sample_D2O save_ save_2D_H(N)CO_24 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(N)CO' _Sample_label $G-U-13C-15N_sample_H2O save_ save_H6-C2/C4_lr13C-HSQC_25 _Saveframe_category NMR_applied_experiment _Experiment_name 'H6-C2/C4 lr13C-HSQC' _Sample_label $unlabeled_sample save_ save_H5-N3_lr15N-HSQC_26 _Saveframe_category NMR_applied_experiment _Experiment_name 'H5-N3 lr15N-HSQC' _Sample_label $G-U-13C-15N_sample_H2O save_ save_TROSY_relayed_HCCH_COSY_27 _Saveframe_category NMR_applied_experiment _Experiment_name 'TROSY relayed HCCH COSY' _Sample_label $A-C-13C-15N_sample_D2O save_ save_2D_H(C)P_28 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)P' _Sample_label $A-C-13C-15N_sample_D2O save_ save_2D_H(C)P_29 _Saveframe_category NMR_applied_experiment _Experiment_name '2D H(C)P' _Sample_label $G-U-13C-15N_sample_D2O save_ ####################### # Sample conditions # ####################### save_283K _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.41 . M pH 7.5 . pH pressure 1 . atm temperature 283 . K stop_ save_ save_298K _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.28 . M pH 7.5 . pH pressure 1 . atm temperature 283 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio TSP C 13 'methyl protons' ppm 0 internal indirect . . . 0.2514 TSP H 1 'methyl protons' ppm 0 internal direct . . . 1.0 TSP N 15 'methyl protons' ppm 0 internal indirect . . . 0.1013 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CARA stop_ loop_ _Experiment_label '3D 1H-13C NOESY aromatic' '3D 1H-13C NOESY aliphatic' '2D 1H-1H NOESY' 'SELLR HNN-COSY' HNN-COSY 'amino HNN-COSY' 'H1/H8 13C-HMBC' '2D H5(C5C4N3)H3' '2D H5(C5C4N4)H4' '2D H(C)N aromatic' '2D H(C)N aliphatic' '3D HCCH-TOCSY' '3D HCCH-COSY' '2D H(N)CO' 'H6-C2/C4 lr13C-HSQC' 'H5-N3 lr15N-HSQC' 'TROSY relayed HCCH COSY' '2D H(C)P' stop_ loop_ _Sample_label $13C-15N_sample $A-C-13C-15N_sample_H2O $A-C-13C-15N_sample_D2O $G-U-13C-15N_sample_H2O $G-U-13C-15N_sample_D2O $15N_sample $unlabeled_sample stop_ _Sample_conditions_label $298K _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name TMR-3_48nt _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 G H1' H 5.717 . 1 2 1 1 G H2' H 4.865 . 1 3 1 1 G H3' H 4.718 . 1 4 1 1 G H4' H 4.509 . 1 5 1 1 G H5' H 4.45 . 1 6 1 1 G H5'' H 4.263 . 1 7 1 1 G H8 H 8.095 . 1 8 1 1 G C1' C 91.995 . 1 9 1 1 G C2' C 74.848 . 1 10 1 1 G C3' C 73.802 . 1 11 1 1 G C4' C 82.977 . 1 12 1 1 G C5 C 118.551 . 1 13 1 1 G C5' C 66.289 . 1 14 1 1 G C8 C 139.016 . 1 15 1 1 G N9 N 169.149 . 1 16 2 2 G H1 H 12.583 . 1 17 2 2 G H1' H 5.824 . 1 18 2 2 G H2' H 4.591 . 1 19 2 2 G H3' H 4.565 . 1 20 2 2 G H4' H 4.522 . 1 21 2 2 G H5' H 4.49 . 1 22 2 2 G H5'' H 4.182 . 1 23 2 2 G H8 H 7.463 . 1 24 2 2 G C1' C 92.863 . 1 25 2 2 G C2' C 75.295 . 1 26 2 2 G C3' C 72.708 . 1 27 2 2 G C4' C 82.165 . 1 28 2 2 G C5 C 118.634 . 1 29 2 2 G C5' C 65.702 . 1 30 2 2 G C8 C 136.726 . 1 31 2 2 G N1 N 146.859 . 1 32 2 2 G N2 N 74.018 . 1 33 2 2 G N9 N 169.321 . 1 34 3 3 A H1' H 5.94 . 1 35 3 3 A H2 H 7.72 . 1 36 3 3 A H2' H 4.496 . 1 37 3 3 A H3' H 4.555 . 1 38 3 3 A H4' H 4.458 . 1 39 3 3 A H5' H 4.581 . 1 40 3 3 A H5'' H 4.097 . 1 41 3 3 A H8 H 7.773 . 1 42 3 3 A C1' C 92.821 . 1 43 3 3 A C2 C 153.756 . 1 44 3 3 A C2' C 75.2 . 1 45 3 3 A C3' C 72.184 . 1 46 3 3 A C4 C 148.473 . 1 47 3 3 A C4' C 81.75 . 1 48 3 3 A C5 C 120.312 . 1 49 3 3 A C5' C 64.325 . 1 50 3 3 A C6 C 157.414 . 1 51 3 3 A C8 C 139.073 . 1 52 3 3 A N1 N 222.326 . 1 53 3 3 A N3 N 211.613 . 1 54 3 3 A N6 N 83.727 . 1 55 3 3 A N9 N 170.704 . 1 56 4 4 C H1' H 5.32 . 1 57 4 4 C H2' H 4.456 . 1 58 4 4 C H3' H 4.315 . 1 59 4 4 C H4' H 4.323 . 1 60 4 4 C H5 H 5.044 . 1 61 4 4 C H5' H 4.451 . 1 62 4 4 C H5'' H 4.001 . 1 63 4 4 C H6 H 7.261 . 1 64 4 4 C H41 H 8.052 . 1 65 4 4 C H42 H 6.576 . 1 66 4 4 C C1' C 93.231 . 1 67 4 4 C C2' C 75.226 . 1 68 4 4 C C3' C 72.143 . 1 69 4 4 C C4 C 151.049 . 1 70 4 4 C C4' C 81.368 . 1 71 4 4 C C5 C 97.514 . 1 72 4 4 C C5' C 64.158 . 1 73 4 4 C C6 C 139.657 . 1 74 4 4 C N1 N 149.779 . 1 75 4 4 C N3 N 195.87 . 1 76 4 4 C N4 N 98.155 . 1 77 5 5 G H1 H 12.349 . 1 78 5 5 G H1' H 5.566 . 1 79 5 5 G H2' H 4.643 . 1 80 5 5 G H3' H 4.396 . 1 81 5 5 G H4' H 4.419 . 1 82 5 5 G H5' H 4.379 . 1 83 5 5 G H5'' H 4.044 . 1 84 5 5 G H8 H 7.302 . 1 85 5 5 G C1' C 92.98 . 1 86 5 5 G C2' C 74.995 . 1 87 5 5 G C3' C 73.152 . 1 88 5 5 G C4 C 151.162 . 1 89 5 5 G C4' C 81.944 . 1 90 5 5 G C5 C 118.035 . 1 91 5 5 G C5' C 66.221 . 1 92 5 5 G C8 C 135.733 . 1 93 5 5 G N1 N 146.136 . 1 94 5 5 G N2 N 74.918 . 1 95 5 5 G N7 N 234.022 . 1 96 5 5 G N9 N 168.424 . 1 97 6 6 A H1' H 5.809 . 1 98 6 6 A H2 H 7.898 . 1 99 6 6 A H2' H 4.388 . 1 100 6 6 A H3' H 4.553 . 1 101 6 6 A H4' H 4.416 . 1 102 6 6 A H8 H 7.792 . 1 103 6 6 A C1' C 92.893 . 1 104 6 6 A C2 C 155.23 . 1 105 6 6 A C2' C 75.242 . 1 106 6 6 A C3' C 72.057 . 1 107 6 6 A C4 C 148.245 . 1 108 6 6 A C4' C 82.117 . 1 109 6 6 A C5 C 120.112 . 1 110 6 6 A C6 C 157.193 . 1 111 6 6 A C8 C 138.866 . 1 112 6 6 A N1 N 224.497 . 1 113 6 6 A N3 N 210.946 . 1 114 6 6 A N6 N 82.205 . 1 115 6 6 A N7 N 230.059 . 1 116 6 6 A N9 N 170.416 . 1 117 7 7 C H1' H 5.564 . 1 118 7 7 C H2' H 4.02 . 1 119 7 7 C H3' H 4.152 . 1 120 7 7 C H4' H 4.29 . 1 121 7 7 C H5 H 5.092 . 1 122 7 7 C H5' H 4.063 . 1 123 7 7 C H5'' H 4.551 . 1 124 7 7 C H6 H 7.505 . 1 125 7 7 C H41 H 7.968 . 1 126 7 7 C H42 H 6.998 . 1 127 7 7 C C1' C 92.446 . 1 128 7 7 C C2' C 76.317 . 1 129 7 7 C C3' C 71.898 . 1 130 7 7 C C4' C 81.777 . 1 131 7 7 C C5 C 96.924 . 1 132 7 7 C C5' C 64.106 . 1 133 7 7 C C6 C 139.976 . 1 134 7 7 C N1 N 151.37 . 1 135 7 7 C N3 N 195.641 . 1 136 7 7 C N4 N 97.235 . 1 137 8 8 U H1' H 5.638 . 1 138 8 8 U H2' H 4.597 . 1 139 8 8 U H3 H 10.323 . 1 140 8 8 U H3' H 4.325 . 1 141 8 8 U H4' H 4.493 . 1 142 8 8 U H5 H 6.203 . 1 143 8 8 U H5' H 3.994 . 1 144 8 8 U H5'' H 4.421 . 1 145 8 8 U H6 H 7.552 . 1 146 8 8 U C1' C 94.684 . 1 147 8 8 U C2 C 152.35 . 1 148 8 8 U C2' C 75.405 . 1 149 8 8 U C3' C 73.85 . 1 150 8 8 U C4 C 169.604 . 1 151 8 8 U C4' C 84.352 . 1 152 8 8 U C5 C 104.94 . 1 153 8 8 U C5' C 68.565 . 1 154 8 8 U C6 C 142.598 . 1 155 8 8 U N1 N 147.085 . 1 156 8 8 U N3 N 155.142 . 1 157 9 9 G H1 H 12.231 . 1 158 9 9 G H1' H 5.872 . 1 159 9 9 G H2' H 4.725 . 1 160 9 9 G H3' H 4.633 . 1 161 9 9 G H4' H 4.547 . 1 162 9 9 G H5' H 4.499 . 1 163 9 9 G H5'' H 4.211 . 1 164 9 9 G H8 H 7.817 . 1 165 9 9 G H21 H 8.418 . 1 166 9 9 G H22 H 6.424 . 1 167 9 9 G C1' C 91.836 . 1 168 9 9 G C2' C 75.979 . 1 169 9 9 G C3' C 73.885 . 1 170 9 9 G C4' C 81.943 . 1 171 9 9 G C5 C 118.558 . 1 172 9 9 G C5' C 66.22 . 1 173 9 9 G C8 C 136.574 . 1 174 9 9 G N1 N 147.269 . 1 175 9 9 G N2 N 75.994 . 1 176 9 9 G N7 N 235.181 . 1 177 9 9 G N9 N 169.914 . 1 178 10 10 A H1' H 5.973 . 1 179 10 10 A H2 H 7.168 . 1 180 10 10 A H2' H 4.662 . 1 181 10 10 A H3' H 4.598 . 1 182 10 10 A H4' H 4.602 . 1 183 10 10 A H5' H 4.52 . 1 184 10 10 A H5'' H 4.215 . 1 185 10 10 A H8 H 7.792 . 1 186 10 10 A H61 H 8.452 . 1 187 10 10 A H62 H 6.773 . 1 188 10 10 A C1' C 93.288 . 1 189 10 10 A C2 C 152.907 . 1 190 10 10 A C2' C 75.253 . 1 191 10 10 A C3' C 73.425 . 1 192 10 10 A C4 C 148.398 . 1 193 10 10 A C4' C 82.236 . 1 194 10 10 A C5 C 120.971 . 1 195 10 10 A C5' C 66.346 . 1 196 10 10 A C6 C 157.398 . 1 197 10 10 A C8 C 139.782 . 1 198 10 10 A N1 N 221.542 . 1 199 10 10 A N3 N 212.091 . 1 200 10 10 A N6 N 82.867 . 1 201 10 10 A N9 N 169.882 . 1 202 11 11 A H1' H 6.001 . 1 203 11 11 A H2 H 7.831 . 1 204 11 11 A H2' H 4.51 . 1 205 11 11 A H3' H 4.645 . 1 206 11 11 A H4' H 4.525 . 1 207 11 11 A H5' H 4.64 . 1 208 11 11 A H5'' H 4.15 . 1 209 11 11 A H8 H 7.927 . 1 210 11 11 A H61 H 8.207 . 1 211 11 11 A H62 H 6.808 . 1 212 11 11 A C1' C 92.55 . 1 213 11 11 A C2 C 153.784 . 1 214 11 11 A C2' C 75.342 . 1 215 11 11 A C3' C 72.185 . 1 216 11 11 A C4 C 148.325 . 1 217 11 11 A C4' C 81.658 . 1 218 11 11 A C5 C 120.446 . 1 219 11 11 A C5' C 64.336 . 1 220 11 11 A C6 C 157.646 . 1 221 11 11 A C8 C 139.061 . 1 222 11 11 A N1 N 222.236 . 1 223 11 11 A N3 N 211.321 . 1 224 11 11 A N6 N 84.844 . 1 225 11 11 A N7 N 229.359 . 1 226 11 11 A N9 N 171.149 . 1 227 12 12 C H1' H 5.415 . 1 228 12 12 C H2' H 4.165 . 1 229 12 12 C H3' H 4.393 . 1 230 12 12 C H4' H 4.397 . 1 231 12 12 C H5 H 5.204 . 1 232 12 12 C H5' H 4.516 . 1 233 12 12 C H5'' H 4.052 . 1 234 12 12 C H6 H 7.484 . 1 235 12 12 C H41 H 8.429 . 1 236 12 12 C H42 H 7.001 . 1 237 12 12 C C1' C 93.523 . 1 238 12 12 C C2' C 75.593 . 1 239 12 12 C C3' C 71.902 . 1 240 12 12 C C4' C 81.554 . 1 241 12 12 C C5 C 97.207 . 1 242 12 12 C C5' C 64.174 . 1 243 12 12 C C6 C 140.383 . 1 244 12 12 C N1 N 151.017 . 1 245 12 12 C N3 N 197.159 . 1 246 12 12 C N4 N 98.676 . 1 247 13 13 C H1' H 5.558 . 1 248 13 13 C H2' H 4.491 . 1 249 13 13 C H3' H 4.487 . 1 250 13 13 C H5 H 5.373 . 1 251 13 13 C H5'' H 4.1 . 1 252 13 13 C H6 H 7.575 . 1 253 13 13 C H41 H 8.332 . 1 254 13 13 C H42 H 6.584 . 1 255 13 13 C C1' C 93.614 . 1 256 13 13 C C2' C 75.525 . 1 257 13 13 C C3' C 71.638 . 1 258 13 13 C C5 C 98.386 . 1 259 13 13 C C5' C 64.135 . 1 260 13 13 C C6 C 140.047 . 1 261 13 13 C N1 N 150.357 . 1 262 13 13 C N3 N 194.707 . 1 263 13 13 C N4 N 98.259 . 1 264 14 14 G H1 H 10.549 . 1 265 14 14 G H1' H 5.677 . 1 266 14 14 G H2' H 4.411 . 1 267 14 14 G H3' H 4.683 . 1 268 14 14 G H4' H 4.409 . 1 269 14 14 G H5' H 4.439 . 1 270 14 14 G H5'' H 4.143 . 1 271 14 14 G H8 H 7.52 . 1 272 14 14 G C1' C 93.225 . 1 273 14 14 G C2' C 75.816 . 1 274 14 14 G C3' C 72.393 . 1 275 14 14 G C4' C 82.072 . 1 276 14 14 G C5 C 118.947 . 1 277 14 14 G C5' C 64.658 . 1 278 14 14 G C8 C 136.121 . 1 279 14 14 G N1 N 145.907 . 1 280 14 14 G N9 N 170.16 . 1 281 15 15 A H1' H 5.679 . 1 282 15 15 A H2 H 7.802 . 1 283 15 15 A H2' H 4.767 . 1 284 15 15 A H3' H 4.453 . 1 285 15 15 A H4' H 4.234 . 1 286 15 15 A H5' H 4.25 . 1 287 15 15 A H5'' H 3.948 . 1 288 15 15 A H8 H 8.385 . 1 289 15 15 A C1' C 92.236 . 1 290 15 15 A C2 C 154.113 . 1 291 15 15 A C2' C 75.491 . 1 292 15 15 A C3' C 73.141 . 1 293 15 15 A C4 C 149.045 . 1 294 15 15 A C4' C 83.221 . 1 295 15 15 A C5 C 119.989 . 1 296 15 15 A C5' C 64.118 . 1 297 15 15 A C6 C 156.329 . 1 298 15 15 A C8 C 142.207 . 1 299 15 15 A N1 N 223.571 . 1 300 15 15 A N3 N 215.702 . 1 301 15 15 A N6 N 78.05 . 1 302 15 15 A N7 N 228.341 . 1 303 15 15 A N9 N 169.308 . 1 304 16 16 A H1' H 5.395 . 1 305 16 16 A H2 H 7.783 . 1 306 16 16 A H2' H 4.324 . 1 307 16 16 A H3' H 4.569 . 1 308 16 16 A H4' H 4.277 . 1 309 16 16 A H5'' H 3.923 . 1 310 16 16 A H8 H 7.935 . 1 311 16 16 A H61 H 6.494 . 1 312 16 16 A H62 H 6.494 . 1 313 16 16 A C1' C 92.411 . 1 314 16 16 A C2 C 154.338 . 1 315 16 16 A C2' C 75.968 . 1 316 16 16 A C3' C 73.64 . 1 317 16 16 A C4 C 147.966 . 1 318 16 16 A C4' C 83.181 . 1 319 16 16 A C5 C 119.643 . 1 320 16 16 A C5' C 64.569 . 1 321 16 16 A C6 C 155.818 . 1 322 16 16 A C8 C 140.148 . 1 323 16 16 A N1 N 223.563 . 1 324 16 16 A N3 N 215.68 . 1 325 16 16 A N6 N 79.003 . 1 326 16 16 A N7 N 226.254 . 1 327 16 16 A N9 N 169.786 . 1 328 16 16 A P P -0.111 . 1 329 17 17 A H1' H 5.996 . 1 330 17 17 A H2 H 8.132 . 1 331 17 17 A H2' H 4.61 . 1 332 17 17 A H3' H 5.075 . 1 333 17 17 A H4' H 4.445 . 1 334 17 17 A H8 H 8.205 . 1 335 17 17 A C1' C 91.899 . 1 336 17 17 A C2 C 155.36 . 1 337 17 17 A C2' C 76.502 . 1 338 17 17 A C4 C 148.362 . 1 339 17 17 A C4' C 82.24 . 1 340 17 17 A C5 C 119.718 . 1 341 17 17 A C6 C 156.786 . 1 342 17 17 A C8 C 140.766 . 1 343 17 17 A N1 N 226.078 . 1 344 17 17 A N3 N 215.923 . 1 345 17 17 A N6 N 80.176 . 1 346 17 17 A N7 N 230.859 . 1 347 17 17 A N9 N 172.678 . 1 348 17 17 A P P -1.865 . 1 349 18 18 G H1 H 12.557 . 1 350 18 18 G H1' H 3.606 . 1 351 18 18 G H2' H 4.468 . 1 352 18 18 G H3' H 4.178 . 1 353 18 18 G H4' H 4.276 . 1 354 18 18 G H5' H 4.247 . 1 355 18 18 G H5'' H 4.366 . 1 356 18 18 G H8 H 7.863 . 1 357 18 18 G C1' C 92.638 . 1 358 18 18 G C2' C 74.969 . 1 359 18 18 G C3' C 74.322 . 1 360 18 18 G C4' C 82.492 . 1 361 18 18 G C5 C 119.19 . 1 362 18 18 G C5' C 69.385 . 1 363 18 18 G C8 C 137.099 . 1 364 18 18 G N1 N 147.009 . 1 365 18 18 G N2 N 74.71 . 1 366 18 18 G N9 N 169.026 . 1 367 19 19 G H1 H 13.275 . 1 368 19 19 G H1' H 5.803 . 1 369 19 19 G H2' H 4.45 . 1 370 19 19 G H3' H 4.473 . 1 371 19 19 G H4' H 4.44 . 1 372 19 19 G H5' H 4.435 . 1 373 19 19 G H5'' H 4.039 . 1 374 19 19 G H8 H 7.207 . 1 375 19 19 G H21 H 8.418 . 1 376 19 19 G H22 H 6.743 . 1 377 19 19 G C1' C 93.018 . 1 378 19 19 G C2' C 74.717 . 1 379 19 19 G C3' C 72.525 . 1 380 19 19 G C4 C 151.839 . 1 381 19 19 G C4' C 81.88 . 1 382 19 19 G C5 C 118.893 . 1 383 19 19 G C5' C 64.493 . 1 384 19 19 G C8 C 136.14 . 1 385 19 19 G N1 N 148.18 . 1 386 19 19 G N2 N 74.319 . 1 387 19 19 G N9 N 169.234 . 1 388 20 20 U H1' H 5.59 . 1 389 20 20 U H2' H 4.464 . 1 390 20 20 U H3 H 14.452 . 1 391 20 20 U H3' H 4.459 . 1 392 20 20 U H5 H 5.09 . 1 393 20 20 U H6 H 7.815 . 1 394 20 20 U C1' C 93.721 . 1 395 20 20 U C2 C 152.934 . 1 396 20 20 U C2' C 75.087 . 1 397 20 20 U C3' C 72.072 . 1 398 20 20 U C4 C 168.985 . 1 399 20 20 U C5 C 102.479 . 1 400 20 20 U C6 C 141.735 . 1 401 20 20 U N1 N 146.464 . 1 402 20 20 U N3 N 162.376 . 1 403 21 21 U H1' H 5.716 . 1 404 21 21 U H2' H 4.491 . 1 405 21 21 U H3 H 13.621 . 1 406 21 21 U H3' H 4.541 . 1 407 21 21 U H4' H 4.458 . 1 408 21 21 U H5 H 5.611 . 1 409 21 21 U H5' H 4.575 . 1 410 21 21 U H5'' H 4.127 . 1 411 21 21 U H6 H 8.007 . 1 412 21 21 U C1' C 93.27 . 1 413 21 21 U C2 C 152.703 . 1 414 21 21 U C2' C 75.258 . 1 415 21 21 U C3' C 72.467 . 1 416 21 21 U C4 C 169.113 . 1 417 21 21 U C4' C 82.031 . 1 418 21 21 U C5 C 103.211 . 1 419 21 21 U C5' C 64.342 . 1 420 21 21 U C6 C 142.415 . 1 421 21 21 U N1 N 147.21 . 1 422 21 21 U N3 N 162.388 . 1 423 22 22 C H1' H 5.558 . 1 424 22 22 C H2' H 4.498 . 1 425 22 22 C H3' H 4.199 . 1 426 22 22 C H4' H 4.442 . 1 427 22 22 C H5 H 5.629 . 1 428 22 22 C H5' H 4.454 . 1 429 22 22 C H5'' H 4.109 . 1 430 22 22 C H6 H 7.716 . 1 431 22 22 C H41 H 8.198 . 1 432 22 22 C H42 H 6.988 . 1 433 22 22 C C1' C 93.641 . 1 434 22 22 C C2' C 75.424 . 1 435 22 22 C C3' C 72.44 . 1 436 22 22 C C4' C 81.601 . 1 437 22 22 C C5 C 97.837 . 1 438 22 22 C C5' C 65.223 . 1 439 22 22 C C6 C 141.232 . 1 440 22 22 C N1 N 151.731 . 1 441 22 22 C N3 N 196.547 . 1 442 22 22 C N4 N 98.525 . 1 443 23 23 U H1' H 5.429 . 1 444 23 23 U H2' H 4.124 . 1 445 23 23 U H3 H 11.362 . 1 446 23 23 U H3' H 4.312 . 1 447 23 23 U H4' H 4.359 . 1 448 23 23 U H5 H 5.619 . 1 449 23 23 U H6 H 7.749 . 1 450 23 23 U C1' C 94.694 . 1 451 23 23 U C2 C 154.168 . 1 452 23 23 U C2' C 74.874 . 1 453 23 23 U C3' C 72.126 . 1 454 23 23 U C4 C 166.662 . 1 455 23 23 U C4' C 82.472 . 1 456 23 23 U C5 C 104.779 . 1 457 23 23 U C6 C 140.735 . 1 458 23 23 U N1 N 145.523 . 1 459 23 23 U N3 N 157.583 . 1 460 24 24 U H1' H 5.814 . 1 461 24 24 U H2' H 4.14 . 1 462 24 24 U H3 H 11.095 . 1 463 24 24 U H3' H 4.668 . 1 464 24 24 U H4' H 4.56 . 1 465 24 24 U H5 H 5.506 . 1 466 24 24 U H5' H 4.488 . 1 467 24 24 U H5'' H 4.017 . 1 468 24 24 U H6 H 7.694 . 1 469 24 24 U C1' C 89.018 . 1 470 24 24 U C2 C 153.52 . 1 471 24 24 U C2' C 75.869 . 1 472 24 24 U C3' C 78.082 . 1 473 24 24 U C4 C 167.362 . 1 474 24 24 U C4' C 85.742 . 1 475 24 24 U C5 C 104.584 . 1 476 24 24 U C5' C 67.268 . 1 477 24 24 U C6 C 142.943 . 1 478 24 24 U N1 N 142.559 . 1 479 24 24 U N3 N 157.51 . 1 480 25 25 G H1 H 9.864 . 1 481 25 25 G H1' H 5.691 . 1 482 25 25 G H2' H 4.872 . 1 483 25 25 G H3' H 4.675 . 1 484 25 25 G H4' H 4.79 . 1 485 25 25 G H5' H 4.411 . 1 486 25 25 G H5'' H 4.172 . 1 487 25 25 G H8 H 7.962 . 1 488 25 25 G C1' C 94.162 . 1 489 25 25 G C2 C 154.752 . 1 490 25 25 G C2' C 74.713 . 1 491 25 25 G C3' C 71.971 . 1 492 25 25 G C4 C 149.922 . 1 493 25 25 G C4' C 82.694 . 1 494 25 25 G C5 C 119.401 . 1 495 25 25 G C5' C 64.9 . 1 496 25 25 G C6 C 158.553 . 1 497 25 25 G C8 C 138.351 . 1 498 25 25 G N1 N 145.499 . 1 499 25 25 G N2 N 71.495 . 1 500 25 25 G N7 N 232.127 . 1 501 25 25 G N9 N 170.183 . 1 502 26 26 G H1 H 13.038 . 1 503 26 26 G H1' H 5.652 . 1 504 26 26 G H2' H 4.502 . 1 505 26 26 G H3' H 4.455 . 1 506 26 26 G H4' H 4.448 . 1 507 26 26 G H8 H 7.272 . 1 508 26 26 G H21 H 8.574 . 1 509 26 26 G H22 H 6.623 . 1 510 26 26 G C1' C 92.783 . 1 511 26 26 G C2' C 75.137 . 1 512 26 26 G C3' C 71.819 . 1 513 26 26 G C4' C 81.954 . 1 514 26 26 G C5 C 119.45 . 1 515 26 26 G C8 C 136.046 . 1 516 26 26 G N1 N 151.321 . 1 517 26 26 G N2 N 73.654 . 1 518 26 26 G N7 N 233.965 . 1 519 26 26 G N9 N 170.44 . 1 520 27 27 C H1' H 5.515 . 1 521 27 27 C H2' H 4.168 . 1 522 27 27 C H3' H 4.452 . 1 523 27 27 C H5 H 5.202 . 1 524 27 27 C H6 H 7.429 . 1 525 27 27 C H41 H 8.324 . 1 526 27 27 C H42 H 6.912 . 1 527 27 27 C C1' C 94.486 . 1 528 27 27 C C2' C 74.981 . 1 529 27 27 C C3' C 71.613 . 1 530 27 27 C C5 C 97.228 . 1 531 27 27 C C6 C 140.232 . 1 532 27 27 C N1 N 150.912 . 1 533 27 27 C N3 N 197.19 . 1 534 27 27 C N4 N 98.68 . 1 535 28 28 U H1' H 5.389 . 1 536 28 28 U H2' H 4.472 . 1 537 28 28 U H3 H 13.581 . 1 538 28 28 U H3' H 4.629 . 1 539 28 28 U H4' H 4.401 . 1 540 28 28 U H5 H 5.341 . 1 541 28 28 U H6 H 7.884 . 1 542 28 28 U C1' C 93.328 . 1 543 28 28 U C2 C 152.403 . 1 544 28 28 U C2' C 74.994 . 1 545 28 28 U C3' C 71.769 . 1 546 28 28 U C4 C 169.312 . 1 547 28 28 U C4' C 81.801 . 1 548 28 28 U C5 C 103.113 . 1 549 28 28 U C6 C 141.434 . 1 550 28 28 U N1 N 145.467 . 1 551 28 28 U N3 N 162.155 . 1 552 29 29 G H1 H 12.424 . 1 553 29 29 G H1' H 5.754 . 1 554 29 29 G H2' H 4.452 . 1 555 29 29 G H3' H 4.571 . 1 556 29 29 G H4' H 4.453 . 1 557 29 29 G H5' H 4.481 . 1 558 29 29 G H5'' H 4.099 . 1 559 29 29 G H8 H 7.645 . 1 560 29 29 G C1' C 92.254 . 1 561 29 29 G C2' C 75.083 . 1 562 29 29 G C3' C 72.518 . 1 563 29 29 G C4 C 151.722 . 1 564 29 29 G C4' C 81.75 . 1 565 29 29 G C5 C 118.481 . 1 566 29 29 G C5' C 64.823 . 1 567 29 29 G C8 C 136.002 . 1 568 29 29 G N1 N 147.153 . 1 569 29 29 G N2 N 75.37 . 1 570 29 29 G N7 N 233.664 . 1 571 29 29 G N9 N 169.461 . 1 572 30 30 C H1' H 5.433 . 1 573 30 30 C H2' H 4.412 . 1 574 30 30 C H3' H 4.214 . 1 575 30 30 C H4' H 4.398 . 1 576 30 30 C H5 H 5.111 . 1 577 30 30 C H5' H 4.478 . 1 578 30 30 C H5'' H 4.043 . 1 579 30 30 C H6 H 7.445 . 1 580 30 30 C H41 H 8.466 . 1 581 30 30 C H42 H 6.852 . 1 582 30 30 C C1' C 93.55 . 1 583 30 30 C C2' C 75.124 . 1 584 30 30 C C3' C 71.678 . 1 585 30 30 C C4' C 81.553 . 1 586 30 30 C C5 C 97.032 . 1 587 30 30 C C5' C 64.174 . 1 588 30 30 C C6 C 140.345 . 1 589 30 30 C N1 N 151.122 . 1 590 30 30 C N3 N 195.641 . 1 591 30 30 C N4 N 99.31 . 1 592 31 31 U H1' H 5.627 . 1 593 31 31 U H2' H 3.755 . 1 594 31 31 U H3 H 11.691 . 1 595 31 31 U H3' H 4.514 . 1 596 31 31 U H4' H 4.338 . 1 597 31 31 U H5 H 5.686 . 1 598 31 31 U H5' H 4.487 . 1 599 31 31 U H5'' H 4.079 . 1 600 31 31 U H6 H 7.731 . 1 601 31 31 U C1' C 94.353 . 1 602 31 31 U C2 C 152.931 . 1 603 31 31 U C2' C 75.732 . 1 604 31 31 U C3' C 72.999 . 1 605 31 31 U C4 C 167.816 . 1 606 31 31 U C4' C 82.276 . 1 607 31 31 U C5 C 104.961 . 1 608 31 31 U C5' C 64.156 . 1 609 31 31 U C6 C 140.488 . 1 610 31 31 U N1 N 146.737 . 1 611 31 31 U N3 N 159.617 . 1 612 32 32 U H1' H 6.095 . 1 613 32 32 U H2' H 4.648 . 1 614 32 32 U H3' H 4.017 . 1 615 32 32 U H4' H 4.472 . 1 616 32 32 U H5 H 5.845 . 1 617 32 32 U H5' H 4.222 . 1 618 32 32 U H5'' H 3.998 . 1 619 32 32 U H6 H 8.006 . 1 620 32 32 U HO2' H 6.574 . 1 621 32 32 U C1' C 89.113 . 1 622 32 32 U C2 C 155.037 . 1 623 32 32 U C2' C 74.52 . 1 624 32 32 U C3' C 77.614 . 1 625 32 32 U C4 C 168.833 . 1 626 32 32 U C4' C 86.884 . 1 627 32 32 U C5 C 105.379 . 1 628 32 32 U C5' C 67.701 . 1 629 32 32 U C6 C 144.552 . 1 630 32 32 U N1 N 143.704 . 1 631 32 32 U P P -2.072 . 1 632 33 33 C H1' H 5.927 . 1 633 33 33 C H2' H 4.086 . 1 634 33 33 C H3' H 4.466 . 1 635 33 33 C H4' H 3.78 . 1 636 33 33 C H5 H 6.109 . 1 637 33 33 C H5' H 3.589 . 1 638 33 33 C H5'' H 2.682 . 1 639 33 33 C H6 H 7.675 . 1 640 33 33 C H41 H 7.169 . 1 641 33 33 C H42 H 6.297 . 1 642 33 33 C C1' C 88.948 . 1 643 33 33 C C2' C 77.402 . 1 644 33 33 C C3' C 80.065 . 1 645 33 33 C C4' C 84.241 . 1 646 33 33 C C5 C 98.514 . 1 647 33 33 C C5' C 67.187 . 1 648 33 33 C C6 C 142.695 . 1 649 33 33 C N1 N 150.503 . 1 650 33 33 C N3 N 202.71 . 1 651 33 33 C N4 N 93.548 . 1 652 34 34 G H1 H 9.904 . 1 653 34 34 G H1' H 5.96 . 1 654 34 34 G H2' H 4.808 . 1 655 34 34 G H3' H 5.601 . 1 656 34 34 G H4' H 4.381 . 1 657 34 34 G H5' H 4.188 . 1 658 34 34 G H5'' H 4.392 . 1 659 34 34 G H8 H 7.856 . 1 660 34 34 G C1' C 94.421 . 1 661 34 34 G C2 C 155.493 . 1 662 34 34 G C2' C 77.066 . 1 663 34 34 G C3' C 75.778 . 1 664 34 34 G C4' C 82.862 . 1 665 34 34 G C5 C 118.667 . 1 666 34 34 G C5' C 68.855 . 1 667 34 34 G C6 C 161.448 . 1 668 34 34 G C8 C 142.817 . 1 669 34 34 G N1 N 143.166 . 1 670 34 34 G N2 N 74.269 . 1 671 34 34 G N7 N 231.367 . 1 672 34 34 G N9 N 171.571 . 1 673 35 35 G H1 H 13.368 . 1 674 35 35 G H1' H 4.418 . 1 675 35 35 G H2' H 4.411 . 1 676 35 35 G H3' H 4.226 . 1 677 35 35 G H4' H 4.379 . 1 678 35 35 G H5' H 4.262 . 1 679 35 35 G H5'' H 4.476 . 1 680 35 35 G H8 H 8.271 . 1 681 35 35 G H21 H 8.757 . 1 682 35 35 G H22 H 6.441 . 1 683 35 35 G C1' C 93.115 . 1 684 35 35 G C2 C 156.89 . 1 685 35 35 G C2' C 74.726 . 1 686 35 35 G C3' C 74.453 . 1 687 35 35 G C4 C 152.138 . 1 688 35 35 G C4' C 82.937 . 1 689 35 35 G C5 C 119.046 . 1 690 35 35 G C5' C 69.561 . 1 691 35 35 G C6 C 162.274 . 1 692 35 35 G C8 C 138.749 . 1 693 35 35 G N1 N 148.072 . 1 694 35 35 G N2 N 75.511 . 1 695 35 35 G N7 N 232.304 . 1 696 35 35 G N9 N 170.277 . 1 697 36 36 C H1' H 5.475 . 1 698 36 36 C H2' H 4.66 . 1 699 36 36 C H3' H 4.498 . 1 700 36 36 C H4' H 4.357 . 1 701 36 36 C H5 H 5.232 . 1 702 36 36 C H5' H 4.465 . 1 703 36 36 C H5'' H 4.02 . 1 704 36 36 C H6 H 7.648 . 1 705 36 36 C H41 H 8.466 . 1 706 36 36 C H42 H 6.806 . 1 707 36 36 C C1' C 93.598 . 1 708 36 36 C C2' C 75.115 . 1 709 36 36 C C3' C 71.825 . 1 710 36 36 C C4' C 81.539 . 1 711 36 36 C C5 C 97.137 . 1 712 36 36 C C5' C 64.029 . 1 713 36 36 C C6 C 140.835 . 1 714 36 36 C N1 N 151.056 . 1 715 36 36 C N3 N 196.615 . 1 716 36 36 C N4 N 97.389 . 1 717 37 37 A H1' H 5.893 . 1 718 37 37 A H2 H 6.807 . 1 719 37 37 A H2' H 4.665 . 1 720 37 37 A H3' H 4.541 . 1 721 37 37 A H4' H 4.511 . 1 722 37 37 A H5' H 4.458 . 1 723 37 37 A H5'' H 4.1 . 1 724 37 37 A H8 H 7.884 . 1 725 37 37 A H61 H 6.304 . 1 726 37 37 A H62 H 6.304 . 1 727 37 37 A C1' C 93.101 . 1 728 37 37 A C2 C 151.887 . 1 729 37 37 A C2' C 75.178 . 1 730 37 37 A C3' C 72.851 . 1 731 37 37 A C4 C 148.229 . 1 732 37 37 A C4' C 81.749 . 1 733 37 37 A C5 C 120.711 . 1 734 37 37 A C5' C 65.405 . 1 735 37 37 A C6 C 156.96 . 1 736 37 37 A C8 C 139.155 . 1 737 37 37 A N1 N 219.972 . 1 738 37 37 A N3 N 214.036 . 1 739 37 37 A N6 N 81.786 . 1 740 37 37 A N7 N 229.924 . 1 741 37 37 A N9 N 170.264 . 1 742 38 38 G H1 H 12.736 . 1 743 38 38 G H1' H 5.466 . 1 744 38 38 G H2' H 4.158 . 1 745 38 38 G H3' H 4.587 . 1 746 38 38 G H4' H 4.402 . 1 747 38 38 G H5' H 4.548 . 1 748 38 38 G H5'' H 4.061 . 1 749 38 38 G H8 H 7.17 . 1 750 38 38 G H21 H 7.165 . 1 751 38 38 G H22 H 5.703 . 1 752 38 38 G C1' C 92.609 . 1 753 38 38 G C2' C 75.215 . 1 754 38 38 G C3' C 72.485 . 1 755 38 38 G C4 C 151.229 . 1 756 38 38 G C4' C 81.828 . 1 757 38 38 G C5 C 118.583 . 1 758 38 38 G C5' C 64.57 . 1 759 38 38 G C8 C 136.237 . 1 760 38 38 G N1 N 147.394 . 1 761 38 38 G N2 N 72.976 . 1 762 38 38 G N9 N 169.215 . 1 763 39 39 A H1' H 5.999 . 1 764 39 39 A H2 H 8.012 . 1 765 39 39 A H2' H 4.717 . 1 766 39 39 A H3' H 4.624 . 1 767 39 39 A H8 H 7.786 . 1 768 39 39 A H61 H 6.32 . 1 769 39 39 A H62 H 6.32 . 1 770 39 39 A C1' C 92.609 . 1 771 39 39 A C2 C 155.062 . 1 772 39 39 A C2' C 75.307 . 1 773 39 39 A C3' C 71.778 . 1 774 39 39 A C4 C 148.092 . 1 775 39 39 A C5 C 119.346 . 1 776 39 39 A C6 C 157.337 . 1 777 39 39 A C8 C 139.044 . 1 778 39 39 A N1 N 222.195 . 1 779 39 39 A N3 N 212.282 . 1 780 39 39 A N6 N 83.186 . 1 781 39 39 A N9 N 170.929 . 1 782 40 40 G H1 H 11.36 . 1 783 40 40 G H1' H 5.43 . 1 784 40 40 G H2' H 3.969 . 1 785 40 40 G H3' H 4.543 . 1 786 40 40 G H4' H 4.354 . 1 787 40 40 G H5' H 4.495 . 1 788 40 40 G H5'' H 4.081 . 1 789 40 40 G H8 H 7.719 . 1 790 40 40 G H21 H 6.204 . 1 791 40 40 G H22 H 5.925 . 1 792 40 40 G C1' C 91.711 . 1 793 40 40 G C2' C 75.605 . 1 794 40 40 G C3' C 71.74 . 1 795 40 40 G C4' C 81.299 . 1 796 40 40 G C5 C 117.909 . 1 797 40 40 G C5' C 64.182 . 1 798 40 40 G C8 C 136.679 . 1 799 40 40 G N1 N 146.977 . 1 800 40 40 G N2 N 77.406 . 1 801 40 40 G N7 N 235.705 . 1 802 40 40 G N9 N 170.941 . 1 803 41 41 G H1 H 12.332 . 1 804 41 41 G H1' H 5.147 . 1 805 41 41 G H2' H 4.555 . 1 806 41 41 G H3' H 4.571 . 1 807 41 41 G H4' H 4.129 . 1 808 41 41 G H5' H 4.115 . 1 809 41 41 G H5'' H 4.177 . 1 810 41 41 G H8 H 7.718 . 1 811 41 41 G H21 H 8.605 . 1 812 41 41 G H22 H 6.412 . 1 813 41 41 G C1' C 83.321 . 1 814 41 41 G C2' C 72.51 . 1 815 41 41 G C3' C 76.388 . 1 816 41 41 G C4' C 85.771 . 1 817 41 41 G C5 C 117.317 . 1 818 41 41 G C5' C 67.291 . 1 819 41 41 G C8 C 136.611 . 1 820 41 41 G N1 N 146.336 . 1 821 41 41 G N2 N 83.378 . 1 822 41 41 G N7 N 237.186 . 1 823 41 41 G N9 N 161.426 . 1 824 42 42 U H1' H 5.554 . 1 825 42 42 U H2' H 4.122 . 1 826 42 42 U H3 H 12.942 . 1 827 42 42 U H3' H 4.577 . 1 828 42 42 U H4' H 3.188 . 1 829 42 42 U H5 H 5.195 . 1 830 42 42 U H5' H 3.332 . 1 831 42 42 U H5'' H 3.74 . 1 832 42 42 U H6 H 7.428 . 1 833 42 42 U C1' C 86.949 . 1 834 42 42 U C2 C 153.289 . 1 835 42 42 U C2' C 74.206 . 1 836 42 42 U C3' C 76.199 . 1 837 42 42 U C4 C 168.878 . 1 838 42 42 U C4' C 84.353 . 1 839 42 42 U C5 C 105.449 . 1 840 42 42 U C5' C 67.509 . 1 841 42 42 U C6 C 143.957 . 1 842 42 42 U N1 N 142.296 . 1 843 42 42 U N3 N 160.874 . 1 844 43 43 A H1' H 6.186 . 1 845 43 43 A H2 H 8.237 . 1 846 43 43 A H2' H 5.168 . 1 847 43 43 A H3' H 4.997 . 1 848 43 43 A H4' H 4.472 . 1 849 43 43 A H5' H 4.332 . 1 850 43 43 A H5'' H 4.125 . 1 851 43 43 A H8 H 8.371 . 1 852 43 43 A C1' C 91.007 . 1 853 43 43 A C2 C 155.206 . 1 854 43 43 A C2' C 74.706 . 1 855 43 43 A C3' C 74.627 . 1 856 43 43 A C4 C 150.404 . 1 857 43 43 A C4' C 83.307 . 1 858 43 43 A C5 C 121.13 . 1 859 43 43 A C5' C 66.465 . 1 860 43 43 A C6 C 157.63 . 1 861 43 43 A C8 C 141.388 . 1 862 43 43 A N1 N 223.707 . 1 863 43 43 A N3 N 217.538 . 1 864 43 43 A N6 N 78.475 . 1 865 43 43 A N7 N 234.084 . 1 866 43 43 A N9 N 169.166 . 1 867 44 44 C H1' H 5.722 . 1 868 44 44 C H2' H 4.59 . 1 869 44 44 C H3' H 4.648 . 1 870 44 44 C H4' H 4.523 . 1 871 44 44 C H5 H 5.71 . 1 872 44 44 C H5' H 4.216 . 1 873 44 44 C H5'' H 4.364 . 1 874 44 44 C H6 H 7.723 . 1 875 44 44 C H41 H 8.203 . 1 876 44 44 C H42 H 6.735 . 1 877 44 44 C C1' C 90.246 . 1 878 44 44 C C2' C 73.351 . 1 879 44 44 C C3' C 74.84 . 1 880 44 44 C C4' C 84.169 . 1 881 44 44 C C5 C 99.379 . 1 882 44 44 C C5' C 67.939 . 1 883 44 44 C C6 C 142.719 . 1 884 44 44 C N1 N 151.445 . 1 885 44 44 C N3 N 196.782 . 1 886 44 44 C N4 N 97.127 . 1 887 45 45 G H1 H 12.693 . 1 888 45 45 G H1' H 5.746 . 1 889 45 45 G H2' H 4.506 . 1 890 45 45 G H3' H 4.428 . 1 891 45 45 G H4' H 4.57 . 1 892 45 45 G H5' H 4.429 . 1 893 45 45 G H5'' H 4.363 . 1 894 45 45 G H8 H 7.746 . 1 895 45 45 G C1' C 93.076 . 1 896 45 45 G C2' C 74.963 . 1 897 45 45 G C3' C 73.789 . 1 898 45 45 G C4' C 83.069 . 1 899 45 45 G C5 C 118.842 . 1 900 45 45 G C5' C 68.037 . 1 901 45 45 G C8 C 137 . 1 902 45 45 G N1 N 147.165 . 1 903 45 45 G N2 N 74.701 . 1 904 45 45 G N7 N 233.998 . 1 905 45 45 G N9 N 168.063 . 1 906 46 46 U H1' H 5.55 . 1 907 46 46 U H2' H 4.486 . 1 908 46 46 U H3 H 14.418 . 1 909 46 46 U H3' H 4.469 . 1 910 46 46 U H5 H 4.959 . 1 911 46 46 U H6 H 7.827 . 1 912 46 46 U C1' C 93.683 . 1 913 46 46 U C2 C 152.711 . 1 914 46 46 U C2' C 74.93 . 1 915 46 46 U C3' C 71.96 . 1 916 46 46 U C4 C 168.921 . 1 917 46 46 U C5 C 102.228 . 1 918 46 46 U C6 C 141.866 . 1 919 46 46 U N1 N 146.749 . 1 920 46 46 U N3 N 162.831 . 1 921 47 47 C H1' H 5.551 . 1 922 47 47 C H2' H 4.165 . 1 923 47 47 C H3' H 4.434 . 1 924 47 47 C H4' H 4.387 . 1 925 47 47 C H5 H 5.603 . 1 926 47 47 C H5' H 4.514 . 1 927 47 47 C H5'' H 4.059 . 1 928 47 47 C H6 H 7.85 . 1 929 47 47 C H41 H 8.365 . 1 930 47 47 C H42 H 6.93 . 1 931 47 47 C C1' C 94.369 . 1 932 47 47 C C2' C 75.354 . 1 933 47 47 C C3' C 72.101 . 1 934 47 47 C C4' C 81.855 . 1 935 47 47 C C5 C 97.429 . 1 936 47 47 C C5' C 64.298 . 1 937 47 47 C C6 C 141.678 . 1 938 47 47 C N1 N 151.672 . 1 939 47 47 C N3 N 198.095 . 1 940 47 47 C N4 N 98.219 . 1 941 48 48 C H1' H 6.035 . 1 942 48 48 C H2' H 4.582 . 1 943 48 48 C H3' H 4.926 . 1 944 48 48 C H5 H 5.5 . 1 945 48 48 C H5' H 4.511 . 1 946 48 48 C H5'' H 4.082 . 1 947 48 48 C H6 H 7.457 . 1 948 48 48 C H41 H 8.441 . 1 949 48 48 C H42 H 7.034 . 1 950 48 48 C C1' C 91.774 . 1 951 48 48 C C3' C 77.709 . 1 952 48 48 C C5 C 99.028 . 1 953 48 48 C C5' C 65.493 . 1 954 48 48 C C6 C 141.61 . 1 955 48 48 C N1 N 149.954 . 1 956 48 48 C N3 N 197.952 . 1 957 48 48 C N4 N 98.773 . 1 stop_ save_