data_30257 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structure of wild type pre-miR21 apical loop ; _BMRB_accession_number 30257 _BMRB_flat_file_name bmr30257.str _Entry_type original _Submission_date 2017-02-27 _Accession_date 2017-02-27 _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 Shortridge M. D. . 2 Varani G. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 180 "13C chemical shifts" 129 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-03-15 update BMRB 'update entry citation' 2017-06-08 original author 'original release' stop_ _Original_release_date 2017-05-02 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; A macrocyclic peptide ligand binds the oncogenic microRNA-21 precursor and suppresses Dicer processing. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 28437065 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shortridge M. D. . 2 Walker M. J. . 3 Pavelitz T. . . 4 Chen Y. . . 5 Yang W. . . 6 Varani G. . . stop_ _Journal_abbreviation 'ACS Chem. Biol.' _Journal_volume 12 _Journal_issue 6 _Journal_ISSN 1554-8937 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1611 _Page_last 1620 _Year 2017 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name pre-miR-21 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common entity_1 _Molecular_mass 9912.896 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 31 _Mol_residue_sequence ; GGUGUUGACUGUUGAAUCUC AUGGCAACACC ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 22 G 2 23 G 3 24 U 4 25 G 5 26 U 6 27 U 7 28 G 8 29 A 9 30 C 10 31 U 11 32 G 12 33 U 13 34 U 14 35 G 15 36 A 16 37 A 17 38 U 18 39 C 19 40 U 20 41 C 21 42 A 22 43 U 23 44 G 24 45 G 25 46 C 26 47 A 27 48 A 28 49 C 29 50 A 30 51 C 31 52 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 $entity_1 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 $entity_1 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details ; 1.1 mM pre-miR-21, 10 mM potassium phosphate, 10 mM sodium chloride, 0.01 mM EDTA, 95% H2O/5% D2O. ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling EDTA 0.01 mM 'natural abundance' 'potassium phosphate' 10 mM 'natural abundance' $entity_1 1.1 mM 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '1.1 mM pre-miR-21, 10 mM potassium phosphate, 10 mM sodium chloride, 0.01 mM EDTA, 100% D2O.' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling EDTA 0.01 mM 'natural abundance' 'potassium phosphate' 10 mM 'natural abundance' $entity_1 1.1 mM 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details '0.5 mM [U-99% 13C; U-99% 15N] pre-miR-21, 10 mM potassium phosphate, 10 mM sodium chloride, 0.01 mM EDTA, 100% D2O.' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling EDTA 0.01 mM 'natural abundance' 'potassium phosphate' 10 mM 'natural abundance' $entity_1 0.5 mM '[U-99% 13C; U-99% 15N]' 'sodium chloride' 10 mM 'natural abundance' stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details '0.5 mM [U-99% 13C; U-99% 15N] pre-miR-21, 10 mM potassium phosphate, 10 mM sodium chloride, 0.01 g/L EDTA, 95% H2O/5% D2O.' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling EDTA 0.01 g/L 'natural abundance' 'potassium phosphate' 10 mM 'natural abundance' $entity_1 0.5 mM '[U-99% 13C; U-99% 15N]' 'sodium chloride' 10 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name Analysis _Version . loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3 _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_software_4 _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_5 _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 500 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AvanceIII _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-1H_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_3 save_ save_2D_1H-1H_TOCSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_2 save_ save_2D_1H-15N_HSQC_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_4 save_ save_3D_1H-15N_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_4 save_ save_2D_1H-1H_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_2 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 10 . mM pH 6.5 . pH pressure 1 . atm temperature 278 . K stop_ save_ save_sample_conditions_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 10 . mM pH 6.5 . pH pressure 1 . atm temperature 310 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 DSS C 13 'methyl protons' ppm 0.000 internal indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0.000 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.000 internal indirect . . . 0.10132912 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-1H NOESY' '3D 1H-13C NOESY' '2D 1H-1H TOCSY' '2D 1H-15N HSQC' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 $sample_3 $sample_2 $sample_4 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name entity_1 _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 22 1 G H1' H 5.83 . . 2 22 1 G H3' H 4.73 . . 3 22 1 G H4' H 4.51 . . 4 22 1 G H5' H 4.46 . . 5 22 1 G H5'' H 4.28 . . 6 22 1 G H8 H 8.24 . . 7 22 1 G C1' C 89.91 . . 8 22 1 G C2' C 72.42 . . 9 22 1 G C3' C 70.15 . . 10 22 1 G C4' C 80.53 . . 11 22 1 G C5' C 63.72 . . 12 22 1 G C8 C 136.84 . . 13 22 1 G HO2' H 4.95 . . 14 23 2 G H1 H 13.39 . . 15 23 2 G H1' H 5.9 . . 16 23 2 G H3' H 4.58 . . 17 23 2 G H4' H 4.53 . . 18 23 2 G H5' H 4.52 . . 19 23 2 G H5'' H 4.19 . . 20 23 2 G H8 H 7.62 . . 21 23 2 G H21 H 6.33 . . 22 23 2 G C1' C 90.57 . . 23 23 2 G C2' C 72.74 . . 24 23 2 G C3' C 70.23 . . 25 23 2 G C4' C 79.82 . . 26 23 2 G C5' C 62.89 . . 27 23 2 G C8 C 134.47 . . 28 23 2 G HO2' H 4.49 . . 29 24 3 U H1' H 5.57 . . 30 24 3 U H3 H 13.74 . . 31 24 3 U H3' H 4.56 . . 32 24 3 U H4' H 4.47 . . 33 24 3 U H5 H 5.14 . . 34 24 3 U H5' H 4.57 . . 35 24 3 U H5'' H 4.12 . . 36 24 3 U H6 H 7.72 . . 37 24 3 U C1' C 90.89 . . 38 24 3 U C2' C 72.77 . . 39 24 3 U C3' C 69.8 . . 40 24 3 U C4' C 79.35 . . 41 24 3 U C5 C 100.4 . . 42 24 3 U C5' C 62.1 . . 43 24 3 U C6 C 138.58 . . 44 24 3 U HO2' H 4.69 . . 45 25 4 G H1 H 12.61 . . 46 25 4 G H1' H 5.76 . . 47 25 4 G H3' H 4.5 . . 48 25 4 G H4' H 4.49 . . 49 25 4 G H5' H 4.47 . . 50 25 4 G H5'' H 4.15 . . 51 25 4 G H8 H 7.69 . . 52 25 4 G H21 H 6.51 . . 53 25 4 G C1' C 90.3 . . 54 25 4 G C2' C 72.8 . . 55 25 4 G C3' C 70.94 . . 56 25 4 G C4' C 79.49 . . 57 25 4 G C5' C 63.62 . . 58 25 4 G C8 C 133.76 . . 59 25 4 G HO2' H 4.46 . . 60 26 5 U H1' H 5.45 . . 61 26 5 U H3 H 14.3 . . 62 26 5 U H3' H 4.45 . . 63 26 5 U H4' H 4.42 . . 64 26 5 U H5 H 5.04 . . 65 26 5 U H5' H 4.58 . . 66 26 5 U H5'' H 4.14 . . 67 26 5 U H6 H 7.76 . . 68 26 5 U C1' C 91.22 . . 69 26 5 U C2' C 72.521 . . 70 26 5 U C3' C 69.55 . . 71 26 5 U C4' C 79.63 . . 72 26 5 U C5 C 99.9 . . 73 26 5 U C5' C 62.03 . . 74 26 5 U C6 C 139.276 . . 75 26 5 U HO2' H 4.43 . . 76 27 6 U H1' H 5.6 . . 77 27 6 U H3 H 13.12 . . 78 27 6 U H3' H 4.7 . . 79 27 6 U H4' H 4.56 . . 80 27 6 U H5 H 5.554 . . 81 27 6 U H5'' H 4.15 . . 82 27 6 U H6 H 7.93 . . 83 27 6 U C1' C 90.71 . . 84 27 6 U C2' C 72.95 . . 85 27 6 U C3' C 69.8 . . 86 27 6 U C4' C 79.35 . . 87 27 6 U C5 C 101.2 . . 88 27 6 U C5' C 62.01 . . 89 27 6 U C6 C 139.24 . . 90 27 6 U HO2' H 4.52 . . 91 28 7 G H1 H 11.77 . . 92 28 7 G H1' H 5.68 . . 93 28 7 G H8 H 7.7 . . 94 28 7 G H21 H 7.22 . . 95 28 7 G H22 H 5.96 . . 96 28 7 G C1' C 89.79 . . 97 28 7 G C2' C 73.14 . . 98 28 7 G C8 C 134.33 . . 99 28 7 G HO2' H 4.41 . . 100 29 8 A H1' H 5.94 . . 101 29 8 A H2 H 8.06 . . 102 29 8 A H8 H 8.13 . . 103 29 8 A H61 H 10.4 . . 104 29 8 A H62 H 9.08 . . 105 29 8 A C1' C 88.96 . . 106 29 8 A C8 C 138.46 . . 107 29 8 A HO2' H 4.6 . . 108 30 9 C H5 H 5.32 . . 109 30 9 C H6 H 7.33 . . 110 31 10 U H1' H 5.376 . . 111 31 10 U H5 H 5.47 . . 112 31 10 U H6 H 7.6 . . 113 31 10 U C1' C 90.45 . . 114 31 10 U C5 C 101.38 . . 115 31 10 U C6 C 139.43 . . 116 31 10 U HO2' H 4.41 . . 117 32 11 G H4' H 4.28 . . 118 32 11 G H8 H 7.74 . . 119 32 11 G C1' C 88.95 . . 120 32 11 G C2' C 72.98 . . 121 32 11 G C4' C 81.67 . . 122 32 11 G C8 C 134.54 . . 123 32 11 G HO2' H 4.54 . . 124 33 12 U H1' H 5.65 . . 125 33 12 U H5 H 5.65 . . 126 33 12 U H6 H 7.706 . . 127 33 12 U C1' C 88.8 . . 128 33 12 U C5 C 102.35 . . 129 33 12 U C6 C 140.59 . . 130 33 12 U HO2' H 4.26 . . 131 34 13 U H1' H 5.64 . . 132 34 13 U H4' H 4.31 . . 133 34 13 U H5 H 5.54 . . 134 34 13 U H6 H 7.64 . . 135 34 13 U C1' C 87.52 . . 136 34 13 U C4' C 81.84 . . 137 34 13 U C5 C 102.139 . . 138 34 13 U C6 C 140.36 . . 139 34 13 U HO2' H 4.505 . . 140 35 14 G H1' H 5.63 . . 141 35 14 G H4' H 4.36 . . 142 35 14 G H8 H 7.82 . . 143 35 14 G C1' C 88.13 . . 144 35 14 G C4' C 81.74 . . 145 35 14 G C8 C 135.51 . . 146 35 14 G HO2' H 4.66 . . 147 36 15 A H1' H 5.83 . . 148 36 15 A H2 H 7.94 . . 149 36 15 A H4' H 4.47 . . 150 36 15 A H8 H 8.14 . . 151 36 15 A C1' C 87.97 . . 152 36 15 A C4' C 82.32 . . 153 36 15 A C8 C 139.14 . . 154 36 15 A HO2' H 4.64 . . 155 37 16 A H1' H 5.65 . . 156 37 16 A H2 H 7.824 . . 157 37 16 A H8 H 7.82 . . 158 37 16 A C1' C 88.59 . . 159 37 16 A C2' C 73.05 . . 160 37 16 A C8 C 136.84 . . 161 37 16 A HO2' H 4.29 . . 162 38 17 U H1' H 5.77 . . 163 38 17 U H4' H 4.39 . . 164 38 17 U H5 H 5.68 . . 165 38 17 U H6 H 7.69 . . 166 38 17 U C1' C 88.22 . . 167 38 17 U C2' C 73.94 . . 168 38 17 U C4' C 82.6 . . 169 38 17 U C5 C 102.47 . . 170 38 17 U C6 C 140.9 . . 171 38 17 U HO2' H 4.55 . . 172 39 18 C H1' H 5.84 . . 173 39 18 C H5 H 5.91 . . 174 39 18 C H6 H 7.76 . . 175 39 18 C C1' C 89.24 . . 176 39 18 C C2' C 73.39 . . 177 39 18 C C5 C 96.17 . . 178 39 18 C C6 C 141.38 . . 179 39 18 C HO2' H 4.34 . . 180 40 19 U H1' H 5.78 . . 181 40 19 U H3' H 4.51 . . 182 40 19 U H5 H 5.79 . . 183 40 19 U H6 H 7.81 . . 184 40 19 U C1' C 88.83 . . 185 40 19 U C2' C 72.78 . . 186 40 19 U C5 C 102.42 . . 187 40 19 U C6 C 140.91 . . 188 40 19 U HO2' H 4.4 . . 189 41 20 C H1' H 5.69 . . 190 41 20 C H4' H 4.41 . . 191 41 20 C H5 H 5.86 . . 192 41 20 C H6 H 7.7 . . 193 41 20 C C1' C 90.34 . . 194 41 20 C C2' C 73.58 . . 195 41 20 C C4' C 80.95 . . 196 41 20 C C5 C 95.91 . . 197 41 20 C C6 C 140.56 . . 198 41 20 C HO2' H 4.67 . . 199 42 21 A H1' H 5.85 . . 200 42 21 A H2 H 7.53 . . 201 42 21 A H8 H 8.14 . . 202 42 21 A C1' C 87.73 . . 203 42 21 A C8 C 139.08 . . 204 43 22 U H5 H 5.53 . . 205 43 22 U H6 H 7.68 . . 206 44 23 G H8 H 7.74 . . 207 44 23 G HO2' H 4.67 . . 208 45 24 G H1' H 5.85 . . 209 45 24 G H8 H 8.14 . . 210 45 24 G C1' C 90.07 . . 211 45 24 G C2' C 72.22 . . 212 45 24 G C8 C 138.99 . . 213 45 24 G HO2' H 4.53 . . 214 46 25 C H5 H 5.25 . . 215 46 25 C H6 H 7.61 . . 216 46 25 C H41 H 8.37 . . 217 46 25 C H42 H 7.08 . . 218 47 26 A H1' H 5.76 . . 219 47 26 A H2 H 6.63 . . 220 47 26 A H3' H 4.75 . . 221 47 26 A H8 H 7.98 . . 222 47 26 A H61 H 7.82 . . 223 47 26 A H62 H 6.43 . . 224 47 26 A C1' C 90.22 . . 225 47 26 A C2 C 149.62 . . 226 47 26 A C2' C 72.98 . . 227 47 26 A C3' C 70.15 . . 228 47 26 A C8 C 137.01 . . 229 47 26 A HO2' H 4.47 . . 230 48 27 A H1' H 5.84 . . 231 48 27 A H2 H 7.58 . . 232 48 27 A H3' H 4.63 . . 233 48 27 A H4' H 4.46 . . 234 48 27 A H5' H 4.58 . . 235 48 27 A H5'' H 4.12 . . 236 48 27 A H8 H 7.87 . . 237 48 27 A H61 H 8.03 . . 238 48 27 A H62 H 6.7 . . 239 48 27 A C1' C 89.87 . . 240 48 27 A C2 C 151.25 . . 241 48 27 A C2' C 73.01 . . 242 48 27 A C3' C 69.88 . . 243 48 27 A C4' C 79.18 . . 244 48 27 A C5' C 61.98 . . 245 48 27 A C8 C 136.57 . . 246 48 27 A HO2' H 4.32 . . 247 49 28 C H1' H 5.28 . . 248 49 28 C H3' H 4.44 . . 249 49 28 C H4' H 4.36 . . 250 49 28 C H5 H 5.17 . . 251 49 28 C H5' H 4.47 . . 252 49 28 C H5'' H 4.04 . . 253 49 28 C H6 H 7.44 . . 254 49 28 C H41 H 8.27 . . 255 49 28 C H42 H 7 . . 256 49 28 C C1' C 90.63 . . 257 49 28 C C2' C 72.82 . . 258 49 28 C C3' C 69.59 . . 259 49 28 C C4' C 79.04 . . 260 49 28 C C5 C 94.8 . . 261 49 28 C C5' C 61.9 . . 262 49 28 C C6 C 137.69 . . 263 49 28 C HO2' H 4.19 . . 264 50 29 A H1' H 5.89 . . 265 50 29 A H2 H 7.42 . . 266 50 29 A H3' H 4.64 . . 267 50 29 A H4' H 4.44 . . 268 50 29 A H8 H 8 . . 269 50 29 A H61 H 8.06 . . 270 50 29 A H62 H 6.36 . . 271 50 29 A C1' C 90.29 . . 272 50 29 A C2 C 151.02 . . 273 50 29 A C2' C 72.87 . . 274 50 29 A C3' C 70.01 . . 275 50 29 A C4' C 79.35 . . 276 50 29 A C8 C 136.92 . . 277 50 29 A HO2' H 4.49 . . 278 51 30 C H1' H 5.39 . . 279 51 30 C H3' H 4.35 . . 280 51 30 C H4' H 4.36 . . 281 51 30 C H5 H 5.18 . . 282 51 30 C H5' H 4.48 . . 283 51 30 C H5'' H 4.03 . . 284 51 30 C H6 H 7.49 . . 285 51 30 C H41 H 8.39 . . 286 51 30 C H42 H 7.08 . . 287 51 30 C C1' C 91.23 . . 288 51 30 C C2' C 73.2 . . 289 51 30 C C3' C 69.6 . . 290 51 30 C C4' C 79.28 . . 291 51 30 C C5 C 94.4 . . 292 51 30 C C5' C 61.96 . . 293 51 30 C C6 C 138.125 . . 294 51 30 C HO2' H 4.1 . . 295 52 31 C H1' H 5.73 . . 296 52 31 C H3' H 4.13 . . 297 52 31 C H4' H 4.13 . . 298 52 31 C H5 H 5.46 . . 299 52 31 C H5' H 4.44 . . 300 52 31 C H5'' H 4.01 . . 301 52 31 C H6 H 7.64 . . 302 52 31 C C1' C 90.24 . . 303 52 31 C C2' C 74.8 . . 304 52 31 C C3' C 67.26 . . 305 52 31 C C4' C 80.9 . . 306 52 31 C C5 C 95.5 . . 307 52 31 C C5' C 62.56 . . 308 52 31 C C6 C 139.32 . . 309 52 31 C HO2' H 3.97 . . stop_ save_