data_6477 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the P2b-P3 pseudoknot from human telomerase RNA ; _BMRB_accession_number 6477 _BMRB_flat_file_name bmr6477.str _Entry_type original _Submission_date 2005-02-02 _Accession_date 2005-02-08 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Theimer C. A. . 2 Blois C. A. . 3 Feigon J. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 336 "13C chemical shifts" 273 "15N chemical shifts" 73 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2006-02-17 original author . stop_ _Original_release_date 2006-02-17 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structure of the human telomerase RNA pseudoknot reveals conserved tertiary interactions essential for function. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15749017 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Theimer C. A. . 2 Blois C. A. . 3 Feigon J. . . stop_ _Journal_abbreviation 'Mol. Cell' _Journal_volume 17 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 671 _Page_last 682 _Year 2005 _Details . loop_ _Keyword Hoogsteen non-canonical pseudoknot 'tertiary structure' triplex stop_ save_ ################################## # Molecular system description # ################################## save_system_P2b-P3 _Saveframe_category molecular_system _Mol_system_name 'Telomerase RNA P2b-P3 pseudoknot' _Abbreviation_common 'Telomerase RNA P2b-P3 pseudoknot' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Telomerase RNA P2b-P3 pseudoknot' $P2b-P3 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_P2b-P3 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common 'Telomerase RNA P2b-P3 pseudoknot' _Abbreviation_common 'Telomerase RNA P2b-P3 pseudoknot' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 47 _Mol_residue_sequence ; GGGCUGUUUUUCUCGCUGAC UUUCAGCCCCAAACAAAAAA GUCAGCA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 . G 2 . G 3 . G 4 96 C 5 97 U 6 98 G 7 99 U 8 100 U 9 101 U 10 102 U 11 103 U 12 104 C 13 105 U 14 106 C 15 107 G 16 108 C 17 109 U 18 110 G 19 111 A 20 112 C 21 113 U 22 114 U 23 115 U 24 116 C 25 117 A 26 118 G 27 . C 28 . C 29 . C 30 . C 31 167 A 32 168 A 33 169 A 34 170 C 35 171 A 36 172 A 37 173 A 38 174 A 39 175 A 40 176 A 41 177 G 42 178 U 43 179 C 44 180 A 45 181 G 46 182 C 47 183 A 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 $P2b-P3 Human 9606 Eukaryota Metazoa Homo sapiens 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 $P2b-P3 'enzymatic semi-synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM . 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM . 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ save_sample_5 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-A' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_6 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-A' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ save_sample_7 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-C' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_8 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-C' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ save_sample_9 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-G' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_10 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-G' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ save_sample_11 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-U' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . H2O 95 % . D2O 5 % . stop_ save_ save_sample_12 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $P2b-P3 0.8 mM '[U-13C; U-15N]-U' 'sodium phosphate buffer' 10 mM . KCl 200 mM . EDTA 50 uM . 'sodium azide' 0.2 % . D2O 100 % . stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Saveframe_category software _Name xwinnmr _Version 2.6 loop_ _Task collection processing stop_ _Details Bruker save_ save_AURELIA _Saveframe_category software _Name AURELIA _Version 3.108 loop_ _Task 'data analysis' stop_ _Details Brunger save_ save_XPLOR-NIH _Saveframe_category software _Name 'X-PLOR NIH' _Version 1.0.6 loop_ _Task refinement 'structure solution' stop_ _Details NIH save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_NOESY_(11echo_and_watergate)_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY (11echo and watergate)' _Sample_label . save_ save_2D_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label . save_ save_2D_TOCSY_(presat)_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D TOCSY (presat)' _Sample_label . save_ save_2D_15N-HMQC_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-HMQC' _Sample_label . save_ save_2D_15N-CPMG-NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-CPMG-NOESY' _Sample_label . save_ save_2D_JNN-HNN-COSY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '2D JNN-HNN-COSY' _Sample_label . save_ save_2D_13C-HSQC_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 13C-HSQC' _Sample_label . save_ save_2D_HCCH_COSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D HCCH COSY' _Sample_label . save_ save_3D_HCCH-TOCSY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label . save_ save_2D_13C_filtered/edited_NOESYs_10 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 13C filtered/edited NOESYs' _Sample_label . save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY (11echo and watergate)' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D TOCSY (presat)' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-HMQC' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-CPMG-NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_6 _Saveframe_category NMR_applied_experiment _Experiment_name '2D JNN-HNN-COSY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 13C-HSQC' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_9 _Saveframe_category NMR_applied_experiment _Experiment_name '2D HCCH COSY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_11 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 13C filtered/edited NOESYs' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 200 . mM pH 6.3 . pH pressure 1 . atm temperature 283 . K stop_ save_ save_sample_cond_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 200 . mM pH 6.3 . pH pressure 1 . atm temperature 293 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 H2O H 1 protons ppm . internal direct . internal . 1.0 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 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_chemical_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 $sample_2 $sample_3 $sample_4 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Telomerase RNA P2b-P3 pseudoknot' _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 G H1 H 13.052 . 1 2 . 1 G H8 H 8.171 . 1 3 . 1 G C8 C 138.972 . 1 4 . 1 G N1 N 146.518 . 1 5 . 1 G H1' H 5.855 . 1 6 . 1 G H2' H 4.959 . 1 7 . 1 G H3' H 4.804 . 1 8 . 1 G H4' H 4.592 . 1 9 . 1 G C1' C 92.726 . 1 10 . 1 G C2' C 74.926 . 1 11 . 1 G C3' C 74.360 . 1 12 . 1 G C4' C 83.273 . 1 13 . 2 G H1 H 13.529 . 1 14 . 2 G H8 H 7.717 . 1 15 . 2 G C8 C 136.440 . 1 16 . 2 G N1 N 147.630 . 1 17 . 2 G H1' H 6.062 . 1 18 . 2 G H2' H 5.045 . 1 19 . 2 G H3' H 4.650 . 1 20 . 2 G H4' H 4.627 . 1 21 . 2 G C1' C 92.595 . 1 22 . 2 G C2' C 75.677 . 1 23 . 2 G C3' C 73.107 . 1 24 . 2 G C4' C 82.206 . 1 25 . 3 G H1 H 13.462 . 1 26 . 3 G H21 H 8.691 . 1 27 . 3 G H22 H 7.002 . 1 28 . 3 G H8 H 7.115 . 1 29 . 3 G C8 C 136.146 . 1 30 . 3 G N1 N 149.193 . 1 31 . 3 G N2 N 76.219 . 1 32 . 3 G H1' H 5.933 . 1 33 . 3 G H2' H 4.469 . 1 34 . 3 G H3' H 4.262 . 1 35 . 3 G H4' H 4.647 . 1 36 . 3 G C1' C 94.273 . 1 37 . 3 G C2' C 73.908 . 1 38 . 3 G C3' C 73.871 . 1 39 . 3 G C4' C 82.423 . 1 40 . 4 C H41 H 8.892 . 1 41 . 4 C H42 H 6.714 . 1 42 . 4 C H5 H 5.019 . 1 43 . 4 C H6 H 7.434 . 1 44 . 4 C C5 C 96.132 . 1 45 . 4 C C6 C 141.540 . 1 46 . 4 C N3 N 196.550 . 1 47 . 4 C N4 N 97.314 . 1 48 . 4 C H1' H 3.730 . 1 49 . 4 C H2' H 4.107 . 1 50 . 4 C H3' H 3.739 . 1 51 . 4 C H4' H 4.041 . 1 52 . 4 C C1' C 93.584 . 1 53 . 4 C C2' C 70.868 . 1 54 . 4 C C3' C 71.882 . 1 55 . 4 C C4' C 74.170 . 1 56 . 5 U H3 H 14.325 . 1 57 . 5 U H5 H 5.384 . 1 58 . 5 U H6 H 7.805 . 1 59 . 5 U C5 C 102.910 . 1 60 . 5 U C6 C 141.238 . 1 61 . 5 U N3 N 162.419 . 1 62 . 5 U H1' H 5.584 . 1 63 . 5 U H2' H 4.470 . 1 64 . 5 U H3' H 4.514 . 1 65 . 5 U H4' H 4.446 . 1 66 . 5 U C1' C 93.356 . 1 67 . 5 U C2' C 72.019 . 1 68 . 5 U C3' C 75.132 . 1 69 . 5 U C4' C 81.899 . 1 70 . 6 G H1 H 12.696 . 1 71 . 6 G H21 H 7.776 . 1 72 . 6 G H22 H 6.743 . 1 73 . 6 G H8 H 7.811 . 1 74 . 6 G C8 C 136.582 . 1 75 . 6 G N1 N 148.081 . 1 76 . 6 G N2 N 76.688 . 1 77 . 6 G H1' H 5.882 . 1 78 . 6 G H2' H 3.979 . 1 79 . 6 G H3' H 4.784 . 1 80 . 6 G H4' H 4.525 . 1 81 . 6 G C1' C 91.543 . 1 82 . 6 G C2' C 76.723 . 1 83 . 6 G C3' C 72.746 . 1 84 . 6 G C4' C 81.605 . 1 85 . 7 U H3 H 12.747 . 1 86 . 7 U H5 H 5.761 . 1 87 . 7 U H6 H 7.822 . 1 88 . 7 U C5 C 104.989 . 1 89 . 7 U C6 C 142.198 . 1 90 . 7 U N3 N 160.487 . 1 91 . 7 U H1' H 5.339 . 1 92 . 7 U H2' H 4.344 . 1 93 . 7 U H3' H 4.263 . 1 94 . 7 U H4' H 4.429 . 1 95 . 7 U C1' C 93.880 . 1 96 . 7 U C2' C 74.787 . 1 97 . 7 U C3' C 72.204 . 1 98 . 7 U C4' C 82.326 . 1 99 . 8 U H3 H 12.711 . 1 100 . 8 U H5 H 5.471 . 1 101 . 8 U H6 H 7.961 . 1 102 . 8 U C5 C 103.599 . 1 103 . 8 U C6 C 141.993 . 1 104 . 8 U N3 N 160.888 . 1 105 . 8 U H1' H 5.803 . 1 106 . 8 U H2' H 4.696 . 1 107 . 8 U H3' H 4.388 . 1 108 . 8 U H4' H 4.386 . 1 109 . 8 U C1' C 93.476 . 1 110 . 8 U C2' C 75.328 . 1 111 . 8 U C3' C 71.778 . 1 112 . 8 U C4' C 81.459 . 1 113 . 9 U H3 H 12.205 . 1 114 . 9 U H5 H 5.442 . 1 115 . 9 U H6 H 7.535 . 1 116 . 9 U C5 C 103.688 . 1 117 . 9 U C6 C 141.077 . 1 118 . 9 U N3 N 159.872 . 1 119 . 9 U H1' H 5.422 . 1 120 . 9 U H2' H 4.482 . 1 121 . 9 U H3' H 4.048 . 1 122 . 9 U H4' H 4.487 . 1 123 . 9 U C1' C 94.570 . 1 124 . 9 U C2' C 75.143 . 1 125 . 9 U C3' C 73.259 . 1 126 . 9 U C4' C 82.277 . 1 127 . 10 U H3 H 11.737 . 1 128 . 10 U H5 H 5.369 . 1 129 . 10 U H6 H 7.441 . 1 130 . 10 U C5 C 103.218 . 1 131 . 10 U C6 C 140.807 . 1 132 . 10 U N3 N 159.220 . 1 133 . 10 U H1' H 5.235 . 1 134 . 10 U H2' H 4.257 . 1 135 . 10 U H3' H 4.214 . 1 136 . 10 U H4' H 4.375 . 1 137 . 10 U C1' C 94.494 . 1 138 . 10 U C2' C 75.463 . 1 139 . 10 U C3' C 71.850 . 1 140 . 10 U C4' C 81.664 . 1 141 . 11 U H3 H 11.822 . 1 142 . 11 U H5 H 5.468 . 1 143 . 11 U H6 H 7.457 . 1 144 . 11 U C5 C 102.787 . 1 145 . 11 U C6 C 141.184 . 1 146 . 11 U N3 N 157.576 . 1 147 . 11 U H1' H 5.974 . 1 148 . 11 U H2' H 4.639 . 1 149 . 11 U H3' H 4.392 . 1 150 . 11 U H4' H 4.475 . 1 151 . 11 U H5' H 4.270 . 2 152 . 11 U H5'' H 4.139 . 2 153 . 11 U C1' C 90.913 . 1 154 . 11 U C2' C 75.903 . 1 155 . 11 U C3' C 75.783 . 1 156 . 11 U C4' C 84.618 . 1 157 . 11 U C5' C 66.825 . 1 158 . 12 C H5 H 5.897 . 1 159 . 12 C H6 H 7.939 . 1 160 . 12 C C5 C 98.451 . 1 161 . 12 C C6 C 142.511 . 1 162 . 12 C H1' H 5.609 . 1 163 . 12 C H2' H 4.210 . 1 164 . 12 C H3' H 4.512 . 1 165 . 12 C H4' H 4.422 . 1 166 . 12 C C1' C 92.554 . 1 167 . 12 C C2' C 75.800 . 1 168 . 12 C C3' C 73.768 . 1 169 . 12 C C4' C 83.059 . 1 170 . 13 U H3 H 13.328 . 1 171 . 13 U H5 H 5.348 . 1 172 . 13 U H6 H 7.583 . 1 173 . 13 U C5 C 104.081 . 1 174 . 13 U N3 N 161.726 . 1 175 . 13 U H1' H 5.476 . 1 176 . 13 U H2' H 4.186 . 1 177 . 13 U H3' H 4.472 . 1 178 . 13 U H4' H 4.362 . 1 179 . 13 U C1' C 93.364 . 1 180 . 13 U C2' C 75.932 . 1 181 . 13 U C3' C 72.475 . 1 182 . 13 U C4' C 82.539 . 1 183 . 14 C H5 H 5.865 . 1 184 . 14 C H6 H 7.885 . 1 185 . 14 C C5 C 99.098 . 1 186 . 14 C C6 C 143.320 . 1 187 . 14 C H1' H 5.921 . 1 188 . 14 C H2' H 4.423 . 1 189 . 14 C H3' H 4.652 . 1 190 . 14 C H4' H 4.465 . 1 191 . 14 C C1' C 92.211 . 1 192 . 14 C C2' C 75.578 . 1 193 . 14 C C3' C 75.300 . 1 194 . 14 C C4' C 84.113 . 1 195 . 15 G H1 H 11.226 . 1 196 . 15 G H8 H 8.023 . 1 197 . 15 G C8 C 138.134 . 1 198 . 15 G N1 N 144.026 . 1 199 . 15 G H1' H 5.813 . 1 200 . 15 G H2' H 4.753 . 1 201 . 15 G H3' H 4.774 . 1 202 . 15 G H4' H 4.532 . 1 203 . 15 G C1' C 91.725 . 1 204 . 15 G C2' C 74.659 . 1 205 . 15 G C3' C 74.487 . 1 206 . 15 G C4' C 83.172 . 1 207 . 16 C H41 H 8.415 . 1 208 . 16 C H42 H 6.604 . 1 209 . 16 C H5 H 5.494 . 1 210 . 16 C H6 H 7.664 . 1 211 . 16 C N3 N 196.550 . 1 212 . 16 C N4 N 93.428 . 1 213 . 16 C H1' H 5.505 . 1 214 . 16 C H2' H 4.399 . 1 215 . 16 C H3' H 4.427 . 1 216 . 16 C H4' H 4.383 . 1 217 . 16 C C1' C 92.849 . 1 218 . 16 C C2' C 76.004 . 1 219 . 16 C C3' C 72.209 . 1 220 . 16 C C4' C 81.336 . 1 221 . 17 U H3 H 13.466 . 1 222 . 17 U H5 H 5.443 . 1 223 . 17 U H6 H 7.818 . 1 224 . 17 U C5 C 104.135 . 1 225 . 17 U C6 C 143.449 . 1 226 . 17 U N3 N 161.241 . 1 227 . 17 U H1' H 5.563 . 1 228 . 17 U H2' H 4.701 . 1 229 . 17 U H3' H 4.575 . 1 230 . 17 U H4' H 4.442 . 1 231 . 17 U C1' C 93.527 . 1 232 . 17 U C2' C 75.335 . 1 233 . 17 U C3' C 72.279 . 1 234 . 17 U C4' C 81.834 . 1 235 . 18 G H1 H 11.777 . 1 236 . 18 G H8 H 7.698 . 1 237 . 18 G C8 C 136.289 . 1 238 . 18 G N1 N 145.565 . 1 239 . 18 G N2 N 73.758 . 1 240 . 18 G H1' H 5.731 . 1 241 . 18 G H2' H 4.571 . 1 242 . 18 G H3' H 4.601 . 1 243 . 18 G H4' H 4.532 . 1 244 . 18 G C1' C 92.590 . 1 245 . 18 G C2' C 75.255 . 1 246 . 18 G C3' C 72.803 . 1 247 . 18 G C4' C 81.864 . 1 248 . 19 A H2 H 7.743 . 1 249 . 19 A H8 H 7.831 . 1 250 . 19 A C2 C 153.866 . 1 251 . 19 A C8 C 139.186 . 1 252 . 19 A N1 N 222.083 . 1 253 . 19 A N3 N 213.214 . 1 254 . 19 A N6 N 83.778 . 1 255 . 19 A H1' H 5.946 . 1 256 . 19 A H2' H 4.655 . 1 257 . 19 A H3' H 4.536 . 1 258 . 19 A H4' H 4.485 . 1 259 . 19 A C1' C 92.615 . 1 260 . 19 A C2' C 75.331 . 1 261 . 19 A C3' C 72.139 . 1 262 . 19 A C4' C 81.661 . 1 263 . 20 C H41 H 8.219 . 1 264 . 20 C H42 H 7.142 . 1 265 . 20 C H5 H 5.239 . 1 266 . 20 C H6 H 7.150 . 1 267 . 20 C C5 C 97.420 . 1 268 . 20 C C6 C 140.192 . 1 269 . 20 C N3 N 197.706 . 1 270 . 20 C N4 N 96.693 . 1 271 . 20 C H1' H 5.282 . 1 272 . 20 C H2' H 4.198 . 1 273 . 20 C H3' H 4.202 . 1 274 . 20 C H4' H 4.415 . 1 275 . 20 C C1' C 93.780 . 1 276 . 20 C C2' C 75.511 . 1 277 . 20 C C3' C 72.416 . 1 278 . 20 C C4' C 81.610 . 1 279 . 21 U H3 H 13.684 . 1 280 . 21 U H5 H 5.321 . 1 281 . 21 U H6 H 7.696 . 1 282 . 21 U C5 C 103.596 . 1 283 . 21 U C6 C 141.993 . 1 284 . 21 U N3 N 161.903 . 1 285 . 21 U H1' H 5.598 . 1 286 . 21 U H2' H 4.559 . 1 287 . 21 U H3' H 4.428 . 1 288 . 21 U H4' H 4.450 . 1 289 . 21 U C1' C 93.749 . 1 290 . 21 U C2' C 75.077 . 1 291 . 21 U C3' C 72.249 . 1 292 . 21 U C4' C 81.985 . 1 293 . 22 U H3 H 13.482 . 1 294 . 22 U H5 H 5.689 . 1 295 . 22 U H6 H 7.835 . 1 296 . 22 U C5 C 104.998 . 1 297 . 22 U C6 C 142.964 . 1 298 . 22 U N3 N 162.818 . 1 299 . 22 U H1' H 5.623 . 1 300 . 22 U H2' H 4.647 . 1 301 . 22 U H3' H 4.427 . 1 302 . 22 U H4' H 4.522 . 1 303 . 22 U C1' C 93.650 . 1 304 . 22 U C2' C 74.984 . 1 305 . 22 U C3' C 72.196 . 1 306 . 22 U C4' C 81.966 . 1 307 . 23 U H3 H 13.643 . 1 308 . 23 U H5 H 5.062 . 1 309 . 23 U H6 H 7.551 . 1 310 . 23 U C5 C 102.140 . 1 311 . 23 U C6 C 139.998 . 1 312 . 23 U N3 N 161.849 . 1 313 . 23 U H1' H 5.374 . 1 314 . 23 U H2' H 4.650 . 1 315 . 23 U H3' H 4.286 . 1 316 . 23 U H4' H 4.517 . 1 317 . 23 U C1' C 93.552 . 1 318 . 23 U C2' C 75.587 . 1 319 . 23 U C3' C 72.209 . 1 320 . 23 U C4' C 82.110 . 1 321 . 24 C H41 H 8.562 . 1 322 . 24 C H42 H 7.240 . 1 323 . 24 C H5 H 6.056 . 1 324 . 24 C H6 H 8.283 . 1 325 . 24 C C5 C 99.799 . 1 326 . 24 C C6 C 141.594 . 1 327 . 24 C N3 N 197.224 . 1 328 . 24 C N4 N 96.435 . 1 329 . 24 C H1' H 5.134 . 1 330 . 24 C H2' H 4.571 . 1 331 . 24 C H3' H 4.717 . 1 332 . 24 C H4' H 4.475 . 1 333 . 24 C C1' C 94.957 . 1 334 . 24 C C2' C 73.655 . 1 335 . 24 C C3' C 71.572 . 1 336 . 24 C C4' C 82.146 . 1 337 . 25 A H2 H 7.149 . 1 338 . 25 A H8 H 8.136 . 1 339 . 25 A C2 C 152.635 . 1 340 . 25 A C8 C 139.303 . 1 341 . 25 A N1 N 216.687 . 1 342 . 25 A N6 N 80.731 . 1 343 . 25 A H1' H 6.047 . 1 344 . 25 A H2' H 4.773 . 1 345 . 25 A H3' H 4.846 . 1 346 . 25 A H4' H 4.280 . 1 347 . 25 A C1' C 92.516 . 1 348 . 25 A C2' C 74.405 . 1 349 . 25 A C3' C 71.318 . 1 350 . 25 A C4' C 81.554 . 1 351 . 26 G H1 H 13.660 . 1 352 . 26 G H8 H 7.240 . 1 353 . 26 G C8 C 135.056 . 1 354 . 26 G N1 N 147.620 . 1 355 . 26 G N2 N 77.039 . 1 356 . 26 G H1' H 5.461 . 1 357 . 26 G H2' H 4.781 . 1 358 . 26 G H3' H 4.405 . 1 359 . 26 G H4' H 3.823 . 1 360 . 26 G C1' C 92.038 . 1 361 . 26 G C2' C 74.926 . 1 362 . 26 G C3' C 71.861 . 1 363 . 26 G C4' C 80.948 . 1 364 . 27 C H41 H 8.207 . 1 365 . 27 C H42 H 6.898 . 1 366 . 27 C H5 H 5.392 . 1 367 . 27 C H6 H 7.187 . 1 368 . 27 C C5 C 97.370 . 1 369 . 27 C C6 C 140.623 . 1 370 . 27 C N3 N 199.922 . 1 371 . 27 C N4 N 93.739 . 1 372 . 27 C H1' H 5.402 . 1 373 . 27 C H2' H 4.424 . 1 374 . 27 C H3' H 4.110 . 1 375 . 27 C H4' H 4.234 . 1 376 . 27 C C1' C 94.810 . 1 377 . 27 C C2' C 75.258 . 1 378 . 27 C C3' C 73.024 . 1 379 . 27 C C4' C 81.589 . 1 380 . 28 C H41 H 8.392 . 1 381 . 28 C H42 H 6.934 . 1 382 . 28 C H5 H 5.427 . 1 383 . 28 C H6 H 7.868 . 1 384 . 28 C C5 C 96.563 . 1 385 . 28 C C6 C 142.295 . 1 386 . 28 C N3 N 197.899 . 1 387 . 28 C N4 N 98.230 . 1 388 . 28 C H1' H 6.303 . 1 389 . 28 C H2' H 4.595 . 1 390 . 28 C H3' H 4.501 . 1 391 . 28 C H4' H 4.625 . 1 392 . 28 C C1' C 95.153 . 1 393 . 28 C C2' C 74.003 . 1 394 . 28 C C3' C 72.124 . 1 395 . 28 C C4' C 81.969 . 1 396 . 29 C H5 H 5.651 . 1 397 . 29 C H6 H 7.881 . 1 398 . 29 C C5 C 99.098 . 1 399 . 29 C C6 C 143.643 . 1 400 . 29 C H1' H 6.125 . 1 401 . 29 C H2' H 4.174 . 1 402 . 29 C H3' H 4.544 . 1 403 . 29 C H4' H 3.898 . 1 404 . 29 C C1' C 89.515 . 1 405 . 29 C C2' C 76.614 . 1 406 . 29 C C3' C 79.555 . 1 407 . 29 C C4' C 84.732 . 1 408 . 30 C H5 H 6.048 . 1 409 . 30 C H6 H 7.366 . 1 410 . 30 C C5 C 99.100 . 1 411 . 30 C C6 C 143.374 . 1 412 . 30 C H1' H 5.475 . 1 413 . 30 C H2' H 4.409 . 1 414 . 30 C H3' H 4.113 . 1 415 . 30 C H4' H 3.871 . 1 416 . 30 C H5' H 3.572 . 2 417 . 30 C H5'' H 3.205 . 2 418 . 30 C C1' C 90.790 . 1 419 . 30 C C2' C 78.405 . 1 420 . 30 C C3' C 76.449 . 1 421 . 30 C C4' C 83.350 . 1 422 . 30 C C5' C 66.310 . 1 423 . 31 A H2 H 8.157 . 1 424 . 31 A H8 H 8.088 . 1 425 . 31 A C2 C 155.361 . 1 426 . 31 A C8 C 140.768 . 1 427 . 31 A N1 N 225.854 . 1 428 . 31 A N3 N 214.231 . 1 429 . 31 A H1' H 5.518 . 1 430 . 31 A H2' H 4.284 . 1 431 . 31 A H3' H 4.626 . 1 432 . 31 A H4' H 4.449 . 1 433 . 31 A H5' H 4.054 . 2 434 . 31 A H5'' H 4.007 . 2 435 . 31 A C1' C 87.602 . 1 436 . 31 A C2' C 73.476 . 1 437 . 31 A C3' C 75.266 . 1 438 . 31 A C4' C 83.830 . 1 439 . 31 A C5' C 68.860 . 1 440 . 32 A H2 H 8.492 . 1 441 . 32 A H8 H 8.243 . 1 442 . 32 A C2 C 157.412 . 1 443 . 32 A C8 C 142.438 . 1 444 . 32 A H1' H 6.267 . 1 445 . 32 A H2' H 4.718 . 1 446 . 32 A H3' H 4.949 . 1 447 . 32 A H4' H 4.426 . 1 448 . 32 A C1' C 92.516 . 1 449 . 32 A C2' C 76.164 . 1 450 . 32 A C3' C 75.399 . 1 451 . 32 A C4' C 83.090 . 1 452 . 33 A H2 H 8.005 . 1 453 . 33 A H8 H 8.344 . 1 454 . 33 A C2 C 154.540 . 1 455 . 33 A C8 C 140.416 . 1 456 . 33 A N1 N 223.857 . 1 457 . 33 A N3 N 213.832 . 1 458 . 33 A H1' H 6.081 . 1 459 . 33 A H2' H 4.662 . 1 460 . 33 A H3' H 4.725 . 1 461 . 33 A H4' H 4.589 . 1 462 . 33 A C1' C 93.008 . 1 463 . 33 A C2' C 75.784 . 1 464 . 33 A C3' C 72.565 . 1 465 . 33 A C4' C 81.971 . 1 466 . 34 C H5 H 5.208 . 1 467 . 34 C H6 H 7.467 . 1 468 . 34 C C5 C 96.941 . 1 469 . 34 C C6 C 140.623 . 1 470 . 34 C H1' H 5.519 . 1 471 . 34 C H2' H 4.339 . 1 472 . 34 C H3' H 4.398 . 1 473 . 34 C H4' H 4.359 . 1 474 . 34 C C1' C 93.682 . 1 475 . 34 C C2' C 75.444 . 1 476 . 34 C C3' C 72.022 . 1 477 . 34 C C4' C 81.770 . 1 478 . 35 A H2 H 7.463 . 1 479 . 35 A H61 H 7.708 . 1 480 . 35 A H62 H 6.894 . 1 481 . 35 A H8 H 7.886 . 1 482 . 35 A C2 C 152.430 . 1 483 . 35 A C8 C 139.625 . 1 484 . 35 A N1 N 219.171 . 1 485 . 35 A N3 N 213.977 . 1 486 . 35 A N6 N 82.352 . 1 487 . 35 A H1' H 5.444 . 1 488 . 35 A H2' H 4.878 . 1 489 . 35 A H3' H 4.481 . 1 490 . 35 A H4' H 4.480 . 1 491 . 35 A C1' C 94.777 . 1 492 . 35 A C2' C 74.249 . 1 493 . 35 A C3' C 73.876 . 1 494 . 35 A C4' C 83.817 . 1 495 . 36 A H2 H 7.177 . 1 496 . 36 A H61 H 8.639 . 1 497 . 36 A H62 H 6.396 . 1 498 . 36 A H8 H 7.888 . 1 499 . 36 A C2 C 154.774 . 1 500 . 36 A C8 C 141.706 . 1 501 . 36 A N6 N 82.738 . 1 502 . 36 A H1' H 5.720 . 1 503 . 36 A H2' H 4.112 . 1 504 . 36 A H3' H 4.932 . 1 505 . 36 A H4' H 4.424 . 1 506 . 36 A C1' C 92.320 . 1 507 . 36 A C2' C 76.800 . 1 508 . 36 A C3' C 72.809 . 1 509 . 36 A C4' C 82.359 . 1 510 . 37 A H2 H 7.726 . 1 511 . 37 A H61 H 7.950 . 1 512 . 37 A H62 H 7.216 . 1 513 . 37 A H8 H 7.729 . 1 514 . 37 A C2 C 154.319 . 1 515 . 37 A C8 C 140.533 . 1 516 . 37 A N1 N 218.626 . 1 517 . 37 A N3 N 211.398 . 1 518 . 37 A N6 N 83.540 . 1 519 . 37 A N7 N 228.345 . 1 520 . 37 A H1' H 6.148 . 1 521 . 37 A H2' H 4.993 . 1 522 . 37 A H3' H 4.821 . 1 523 . 37 A H4' H 4.669 . 1 524 . 37 A C1' C 91.307 . 1 525 . 37 A C2' C 75.064 . 1 526 . 37 A C3' C 76.374 . 1 527 . 37 A C4' C 83.524 . 1 528 . 38 A H2 H 7.444 . 1 529 . 38 A H61 H 8.081 . 1 530 . 38 A H62 H 6.696 . 1 531 . 38 A H8 H 7.358 . 1 532 . 38 A C2 C 153.427 . 1 533 . 38 A C8 C 139.830 . 1 534 . 38 A N1 N 221.215 . 1 535 . 38 A N3 N 212.016 . 1 536 . 38 A N6 N 84.376 . 1 537 . 38 A N7 N 228.634 . 1 538 . 38 A H1' H 5.913 . 1 539 . 38 A H2' H 4.706 . 1 540 . 38 A H3' H 4.813 . 1 541 . 38 A H4' H 4.633 . 1 542 . 38 A C1' C 92.025 . 1 543 . 38 A C2' C 76.255 . 1 544 . 38 A C3' C 76.328 . 1 545 . 38 A C4' C 85.076 . 1 546 . 39 A H2 H 7.066 . 1 547 . 39 A H61 H 7.823 . 1 548 . 39 A H62 H 7.354 . 1 549 . 39 A H8 H 7.272 . 1 550 . 39 A C2 C 152.373 . 1 551 . 39 A C8 C 139.566 . 1 552 . 39 A N1 N 220.252 . 1 553 . 39 A N3 N 214.849 . 1 554 . 39 A N6 N 83.016 . 1 555 . 39 A H1' H 6.025 . 1 556 . 39 A H2' H 4.882 . 1 557 . 39 A H3' H 4.792 . 1 558 . 39 A H4' H 4.551 . 1 559 . 39 A C1' C 93.106 . 1 560 . 39 A C2' C 75.991 . 1 561 . 39 A C3' C 74.921 . 1 562 . 39 A C4' C 83.879 . 1 563 . 40 A H2 H 7.616 . 1 564 . 40 A H61 H 7.800 . 1 565 . 40 A H62 H 7.565 . 1 566 . 40 A H8 H 7.377 . 1 567 . 40 A C2 C 153.046 . 1 568 . 40 A C8 C 139.361 . 1 569 . 40 A N1 N 220.541 . 1 570 . 40 A N3 N 213.396 . 1 571 . 40 A N6 N 82.313 . 1 572 . 40 A H1' H 6.092 . 1 573 . 40 A H2' H 5.043 . 1 574 . 40 A H3' H 4.635 . 1 575 . 40 A H4' H 4.622 . 1 576 . 40 A C1' C 93.794 . 1 577 . 40 A C2' C 76.174 . 1 578 . 40 A C3' C 74.848 . 1 579 . 40 A C4' C 83.153 . 1 580 . 41 G H1 H 13.406 . 1 581 . 41 G H21 H 8.832 . 1 582 . 41 G H22 H 6.415 . 1 583 . 41 G H8 H 7.142 . 1 584 . 41 G C8 C 137.530 . 1 585 . 41 G N1 N 148.191 . 1 586 . 41 G N2 N 74.109 . 1 587 . 41 G H1' H 5.702 . 1 588 . 41 G H2' H 4.587 . 1 589 . 41 G H3' H 4.190 . 1 590 . 41 G H4' H 4.627 . 1 591 . 41 G C1' C 93.538 . 1 592 . 41 G C2' C 75.199 . 1 593 . 41 G C3' C 74.556 . 1 594 . 41 G C4' C 82.598 . 1 595 . 42 U H3 H 14.289 . 1 596 . 42 U H5 H 5.076 . 1 597 . 42 U H6 H 7.796 . 1 598 . 42 U C6 C 142.971 . 1 599 . 42 U N3 N 162.323 . 1 600 . 42 U H1' H 5.665 . 1 601 . 42 U H2' H 4.643 . 1 602 . 42 U H3' H 4.524 . 1 603 . 42 U H4' H 4.497 . 1 604 . 42 U C1' C 93.947 . 1 605 . 42 U C2' C 75.093 . 1 606 . 42 U C3' C 72.100 . 1 607 . 42 U C4' C 82.240 . 1 608 . 43 C H41 H 8.390 . 1 609 . 43 C H42 H 7.167 . 1 610 . 43 C H5 H 5.692 . 1 611 . 43 C H6 H 7.841 . 1 612 . 43 C C5 C 98.019 . 1 613 . 43 C C6 C 141.432 . 1 614 . 43 C N3 N 196.839 . 1 615 . 43 C N4 N 96.728 . 1 616 . 43 C H1' H 5.572 . 1 617 . 43 C H2' H 4.652 . 1 618 . 43 C H3' H 4.416 . 1 619 . 43 C H4' H 4.496 . 1 620 . 43 C C1' C 94.172 . 1 621 . 43 C C2' C 72.573 . 1 622 . 43 C C3' C 72.353 . 1 623 . 43 C C4' C 81.914 . 1 624 . 44 A H2 H 6.991 . 1 625 . 44 A H8 H 8.083 . 1 626 . 44 A C2 C 152.460 . 1 627 . 44 A C8 C 92.811 . 1 628 . 44 A N1 N 218.807 . 1 629 . 44 A N3 N 212.524 . 1 630 . 44 A N6 N 81.668 . 1 631 . 44 A H1' H 5.880 . 1 632 . 44 A H2' H 4.707 . 1 633 . 44 A H3' H 4.704 . 1 634 . 44 A H4' H 4.532 . 1 635 . 44 A C1' C 92.811 . 1 636 . 44 A C2' C 72.261 . 1 637 . 44 A C3' C 72.605 . 1 638 . 44 A C4' C 81.623 . 1 639 . 45 G H1 H 13.519 . 1 640 . 45 G H8 H 7.335 . 1 641 . 45 G C8 C 135.593 . 1 642 . 45 G N1 N 147.630 . 1 643 . 45 G H1' H 5.643 . 1 644 . 45 G H2' H 4.396 . 1 645 . 45 G H3' H 4.486 . 1 646 . 45 G H4' H 4.441 . 1 647 . 45 G C1' C 92.533 . 1 648 . 45 G C2' C 75.232 . 1 649 . 45 G C3' C 72.059 . 1 650 . 45 G C4' C 81.808 . 1 651 . 46 C H41 H 8.672 . 1 652 . 46 C H42 H 7.236 . 1 653 . 46 C H5 H 5.373 . 1 654 . 46 C H6 H 7.809 . 1 655 . 46 C C5 C 97.372 . 1 656 . 46 C C6 C 141.648 . 1 657 . 46 C N4 N 98.525 . 1 658 . 46 C H1' H 5.772 . 1 659 . 46 C H2' H 3.996 . 1 660 . 46 C H3' H 4.163 . 1 661 . 46 C H4' H 4.180 . 1 662 . 46 C C1' C 92.603 . 1 663 . 46 C C2' C 77.552 . 1 664 . 46 C C3' C 69.674 . 1 665 . 46 C C4' C 83.481 . 1 666 . 47 A H2 H 7.666 . 1 667 . 47 A H8 H 8.222 . 1 668 . 47 A C2 C 154.921 . 1 669 . 47 A C8 C 141.090 . 1 670 . 47 A N1 N 224.684 . 1 671 . 47 A N3 N 214.631 . 1 672 . 47 A H1' H 5.968 . 1 673 . 47 A H2' H 4.231 . 1 674 . 47 A H3' H 4.363 . 1 675 . 47 A H4' H 4.276 . 1 676 . 47 A H5' H 4.395 . 2 677 . 47 A H5'' H 4.075 . 2 678 . 47 A C1' C 90.618 . 1 679 . 47 A C2' C 77.551 . 1 680 . 47 A C3' C 71.201 . 1 681 . 47 A C4' C 84.878 . 1 682 . 47 A C5' C 66.364 . 1 stop_ save_