data_6239 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Chemical shifts assignments for stem-loop VI of the VS ribozyme. ; _BMRB_accession_number 6239 _BMRB_flat_file_name bmr6239.str _Entry_type original _Submission_date 2004-06-15 _Accession_date 2004-06-17 _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 Dieckmann Thorsten . . 2 Flinders Jeremy . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 183 "13C chemical shifts" 139 "15N chemical shifts" 1 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2004-09-20 original author . stop_ _Original_release_date 2004-09-20 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; The Solution Structure of the VS Ribozyme Active Site Loop Reveals a Dynamic 'Hotspot' ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15328609 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Flinders Jeremy . . 2 Dieckmann Thorsten . . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 341 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 935 _Page_last 949 _Year 2004 _Details . loop_ _Keyword 'protonated adenine' 'rna structure' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'VSVI RNA' _Abbreviation_common 'VSVI RNA' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'VSVI RNA' $VSVI_RNA stop_ _System_molecular_weight 7000 _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_VSVI_RNA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common 'VSVI RNA' _Abbreviation_common APP _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 22 _Mol_residue_sequence ; GGUGACGCCGUAAGGCGCAG CC ; loop_ _Residue_seq_code _Residue_label 1 G 2 G 3 U 4 G 5 A 6 C 7 G 8 C 9 C 10 G 11 U 12 A 13 A 14 G 15 G 16 C 17 G 18 C 19 A 20 G 21 C 22 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 $VSVI_RNA 'Neurospora crassa' 5141 Eukaryota Metazoa Neurospora crassa 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 $VSVI_RNA 'enzymatic semisynthesis' . . . . . 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 $VSVI_RNA 1.5 mM . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $VSVI_RNA 1.2 mM '[U-95% 13C; U-95% 15N]' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $VSVI_RNA 1.5 mM '[U-95% 15N]' stop_ save_ ############################ # Computer software used # ############################ save_XWIN-NMR_1 _Saveframe_category software _Name XWIN-NMR _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker ; Bruker BioSpin Corporation 15 Fortune Drive Manning Road Billerica, MA 01821-3991 ; www.bruker-biospin.de stop_ loop_ _Task Acquisition Processing stop_ _Details . save_ save_Sparky_2 _Saveframe_category software _Name SPARKY _Version 3.106 loop_ _Vendor _Address _Electronic_address UCSF 'University of California, San Francisco San Francisco, CA 94143' www.cgl.ucsf.edu/home/sparky/ stop_ loop_ _Task 'Analysis (Peak Picking)' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details 'Equiped with a single-axis cryoprobe.' save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label . save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 0.1 pH temperature 293 0.2 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 _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 protons ppm 0 external indirect . . . 0.251449530 $citation_1 $citation_1 DSS H 1 protons ppm 0 external direct . . . 1.0 $citation_1 $citation_1 DSS N 15 protons ppm 0 external indirect . . . 0.101329118 $citation_1 $citation_1 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_shift_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Ex-cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'VSVI RNA' _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 C1' C 88.9 0.1 1 2 . 1 G C2' C 72.9 0.1 1 3 . 1 G C3' C 72.0 0.1 1 4 . 1 G C4' C 80.6 0.1 1 5 . 1 G C5' C 64.4 0.1 1 6 . 1 G C8 C 133.8 0.1 1 7 . 1 G H1' H 5.68 0.02 1 8 . 1 G H2' H 4.80 0.02 1 9 . 1 G H3' H 4.54 0.02 1 10 . 1 G H4' H 4.40 0.02 1 11 . 1 G H5' H 4.11 0.02 1 12 . 1 G H5'' H 4.28 0.02 1 13 . 1 G H8 H 8.01 0.02 1 14 . 1 G H1 H 11.97 0.02 1 15 . 2 G C1' C 89.9 0.1 1 16 . 2 G C2' C 73.2 0.1 1 17 . 2 G C3' C 70.7 0.1 1 18 . 2 G C4' C 79.9 0.1 1 19 . 2 G C5' C 63.8 0.1 1 20 . 2 G C8 C 131.5 0.1 1 21 . 2 G H1' H 5.78 0.02 1 22 . 2 G H2' H 4.57 0.02 1 23 . 2 G H3' H 4.28 0.02 1 24 . 2 G H4' H 4.34 0.02 1 25 . 2 G H5' H 4.07 0.02 1 26 . 2 G H5'' H 4.37 0.02 1 27 . 2 G H8 H 7.35 0.02 1 28 . 2 G H1 H 13.23 0.02 1 29 . 3 U C1' C 91.1 0.1 1 30 . 3 U C2' C 72.5 0.1 1 31 . 3 U C3' C 70.4 0.1 1 32 . 3 U C4' C 80.0 0.1 1 33 . 3 U C5 C 100.7 0.1 1 34 . 3 U C5' C 62.2 0.1 1 35 . 3 U C6 C 134.5 0.1 1 36 . 3 U H1' H 5.26 0.02 1 37 . 3 U H2' H 4.35 0.02 1 38 . 3 U H3' H 4.35 0.02 1 39 . 3 U H4' H 4.26 0.02 1 40 . 3 U H5 H 5.27 0.02 1 41 . 3 U H5' H 3.95 0.02 1 42 . 3 U H5'' H 4.34 0.02 1 43 . 3 U H6 H 7.39 0.02 1 44 . 3 U H3 H 11.32 0.02 1 45 . 4 G C1' C 87.8 0.1 1 46 . 4 G C2' C 73.5 0.1 1 47 . 4 G C3' C 72.6 0.1 1 48 . 4 G C4' C 81.8 0.1 1 49 . 4 G C5' C 63.9 0.1 1 50 . 4 G C8 C 134.9 0.1 1 51 . 4 G H1' H 5.57 0.02 1 52 . 4 G H2' H 4.70 0.02 1 53 . 4 G H3' H 4.33 0.02 1 54 . 4 G H4' H 4.01 0.02 1 55 . 4 G H5' H 3.82 0.02 1 56 . 4 G H5'' H 4.17 0.02 1 57 . 4 G H8 H 7.67 0.02 1 58 . 4 G H1 H 13.06 0.02 1 59 . 5 A C1' C 90.2 0.1 1 60 . 5 A C2 C 141.6 0.1 1 61 . 5 A C2' C 73.3 0.1 1 62 . 5 A C3' C 70.9 0.1 1 63 . 5 A C4' C 80.5 0.1 1 64 . 5 A C5' C 64.7 0.1 1 65 . 5 A C8 C 138.2 0.1 1 66 . 5 A H1' H 5.87 0.02 1 67 . 5 A H2 H 7.66 0.02 1 68 . 5 A H2' H 4.58 0.02 1 69 . 5 A H3' H 4.36 0.02 1 70 . 5 A H4' H 4.47 0.02 1 71 . 5 A H5' H 4.23 0.02 1 72 . 5 A H5'' H 4.36 0.02 1 73 . 5 A H8 H 8.43 0.02 1 74 . 5 A N1 N 151.9 0.1 1 75 . 6 C C1' C 90.0 0.1 1 76 . 6 C C2' C 73.2 0.1 1 77 . 6 C C3' C 69.3 0.1 1 78 . 6 C C4' C 78.9 0.1 1 79 . 6 C C5 C 94.5 0.1 1 80 . 6 C C5' C 61.5 0.1 1 81 . 6 C C6 C 135.0 0.1 1 82 . 6 C H1' H 5.07 0.02 1 83 . 6 C H2' H 4.16 0.02 1 84 . 6 C H3' H 4.35 0.02 1 85 . 6 C H4' H 4.22 0.02 1 86 . 6 C H5 H 5.28 0.02 1 87 . 6 C H5' H 3.96 0.02 1 88 . 6 C H5'' H 4.36 0.02 1 89 . 6 C H6 H 7.50 0.02 1 90 . 6 C H41 H 7.99 0.02 1 91 . 6 C H42 H 6.81 0.02 1 92 . 7 G C1' C 89.5 0.1 1 93 . 7 G C2' C 73.1 0.1 1 94 . 7 G C3' C 70.6 0.1 1 95 . 7 G C4' C 79.7 0.1 1 96 . 7 G C5' C 62.3 0.1 1 97 . 7 G C8 C 130.7 0.1 1 98 . 7 G H1' H 5.53 0.02 1 99 . 7 G H2' H 4.33 0.02 1 100 . 7 G H3' H 4.40 0.02 1 101 . 7 G H4' H 4.29 0.02 1 102 . 7 G H5' H 3.93 0.02 1 103 . 7 G H5'' H 4.32 0.02 1 104 . 7 G H8 H 7.35 0.02 1 105 . 7 G H1 H 12.57 0.02 1 106 . 8 C C1' C 90.8 0.1 1 107 . 8 C C2' C 73.3 0.1 1 108 . 8 C C3' C 70.0 0.1 1 109 . 8 C C4' C 79.3 0.1 1 110 . 8 C C5 C 93.7 0.1 1 111 . 8 C C5' C 62.4 0.1 1 112 . 8 C C6 C 135.6 0.1 1 113 . 8 C H1' H 5.34 0.02 1 114 . 8 C H2' H 4.20 0.02 1 115 . 8 C H3' H 4.28 0.02 1 116 . 8 C H4' H 4.22 0.02 1 117 . 8 C H5 H 5.01 0.02 1 118 . 8 C H5' H 3.91 0.02 1 119 . 8 C H5'' H 4.36 0.02 1 120 . 8 C H6 H 7.48 0.02 1 121 . 8 C H41 H 8.20 0.02 1 122 . 8 C H42 H 6.61 0.02 1 123 . 9 C C1' C 91.2 0.1 1 124 . 9 C C2' C 72.8 0.1 1 125 . 9 C C3' C 70.1 0.1 1 126 . 9 C C4' C 79.5 0.1 1 127 . 9 C C5 C 94.6 0.1 1 128 . 9 C C5' C 63.2 0.1 1 129 . 9 C C6 C 135.6 0.1 1 130 . 9 C H1' H 5.29 0.02 1 131 . 9 C H2' H 4.32 0.02 1 132 . 9 C H3' H 4.20 0.02 1 133 . 9 C H4' H 12.58 0.02 1 134 . 9 C H5 H 5.18 0.02 1 135 . 9 C H5' H 3.92 0.02 1 136 . 9 C H5'' H 4.33 0.02 1 137 . 9 C H6 H 7.33 0.02 1 138 . 9 C H41 H 7.90 0.02 1 139 . 9 C H42 H 6.35 0.02 1 140 . 10 G C1' C 88.1 0.1 1 141 . 10 G C2' C 74.0 0.1 1 142 . 10 G C3' C 72.0 0.1 1 143 . 10 G C4' C 80.0 0.1 1 144 . 10 G C5' C 62.5 0.1 1 145 . 10 G C8 C 131.7 0.1 1 146 . 10 G H1' H 5.44 0.02 1 147 . 10 G H2' H 4.46 0.02 1 148 . 10 G H3' H 4.60 0.02 1 149 . 10 G H4' H 4.26 0.02 1 150 . 10 G H5' H 3.95 0.02 1 151 . 10 G H5'' H 4.27 0.02 1 152 . 10 G H8 H 7.68 0.02 1 153 . 10 G H1 H 10.30 0.02 1 154 . 11 U C1' C 87.9 0.1 1 155 . 11 U C5 C 101.0 0.1 1 156 . 11 U C6 C 138.3 0.1 1 157 . 11 U H1' H 5.58 0.02 1 158 . 11 U H2' H 4.31 0.02 1 159 . 11 U H5 H 5.56 0.02 1 160 . 11 U H6 H 7.71 0.02 1 161 . 12 A C1' C 88.3 0.1 1 162 . 12 A C2 C 148.4 0.1 1 163 . 12 A C2' C 75.1 0.1 1 164 . 12 A C3' C 74.9 0.1 1 165 . 12 A C4' C 81.6 0.1 1 166 . 12 A C5' C 63.9 0.1 1 167 . 12 A C8 C 135.6 0.1 1 168 . 12 A H1' H 5.41 0.02 1 169 . 12 A H2 H 7.80 0.02 1 170 . 12 A H2' H 4.07 0.02 1 171 . 12 A H3' H 4.08 0.02 1 172 . 12 A H4' H 3.93 0.02 1 173 . 12 A H5' H 3.28 0.02 1 174 . 12 A H5'' H 3.62 0.02 1 175 . 12 A H8 H 7.77 0.02 1 176 . 13 A C1' C 89.7 0.1 1 177 . 13 A C2 C 148.3 0.1 1 178 . 13 A C2' C 74.6 0.1 1 179 . 13 A C3' C 73.0 0.1 1 180 . 13 A C4' C 80.5 0.1 1 181 . 13 A C5' C 65.7 0.1 1 182 . 13 A C8 C 137.5 0.1 1 183 . 13 A H1' H 5.96 0.02 1 184 . 13 A H2 H 7.78 0.02 1 185 . 13 A H2' H 4.60 0.02 1 186 . 13 A H3' H 5.45 0.02 1 187 . 13 A H4' H 4.36 0.02 1 188 . 13 A H5' H 4.20 0.02 1 189 . 13 A H5'' H 4.43 0.02 1 190 . 13 A H8 H 8.08 0.02 1 191 . 14 G C1' C 89.1 0.1 1 192 . 14 G C2' C 72.1 0.1 1 193 . 14 G C3' C 72.9 0.1 1 194 . 14 G C4' C 80.1 0.1 1 195 . 14 G C5' C 67.3 0.1 1 196 . 14 G C8 C 132.0 0.1 1 197 . 14 G H1' H 3.78 0.02 1 198 . 14 G H2' H 4.07 0.02 1 199 . 14 G H3' H 4.24 0.02 1 200 . 14 G H4' H 4.20 0.02 1 201 . 14 G H5' H 4.12 0.02 1 202 . 14 G H5'' H 4.23 0.02 1 203 . 14 G H8 H 7.60 0.02 1 204 . 14 G H1 H 12.28 0.02 1 205 . 15 G C1' C 90.0 0.1 1 206 . 15 G C2' C 72.8 0.1 1 207 . 15 G C3' C 70.5 0.1 1 208 . 15 G C4' C 79.0 0.1 1 209 . 15 G C5' C 63.0 0.1 1 210 . 15 G C8 C 130.9 0.1 1 211 . 15 G H1' H 5.58 0.02 1 212 . 15 G H2' H 4.32 0.02 1 213 . 15 G H3' H 4.27 0.02 1 214 . 15 G H4' H 4.19 0.02 1 215 . 15 G H5' H 3.86 0.02 1 216 . 15 G H5'' H 4.28 0.02 1 217 . 15 G H8 H 7.04 0.02 1 218 . 15 G H1 H 12.83 0.02 1 219 . 16 C C1' C 90.5 0.1 1 220 . 16 C C2' C 73.1 0.1 1 221 . 16 C C3' C 70.3 0.1 1 222 . 16 C C4' C 79.2 0.1 1 223 . 16 C C5 C 94.0 0.1 1 224 . 16 C C5' C 62.7 0.1 1 225 . 16 C C6 C 135.1 0.1 1 226 . 16 C H1' H 5.34 0.02 1 227 . 16 C H2' H 4.47 0.02 1 228 . 16 C H3' H 4.27 0.02 1 229 . 16 C H4' H 4.25 0.02 1 230 . 16 C H5 H 5.01 0.02 1 231 . 16 C H5' H 3.90 0.02 1 232 . 16 C H5'' H 4.33 0.02 1 233 . 16 C H6 H 7.37 0.02 1 234 . 16 C H41 H 8.11 0.02 1 235 . 16 C H42 H 6.45 0.02 1 236 . 17 G C1' C 89.9 0.1 1 237 . 17 G C2' C 72.9 0.1 1 238 . 17 G C3' C 71.0 0.1 1 239 . 17 G C4' C 79.4 0.1 1 240 . 17 G C5' C 62.8 0.1 1 241 . 17 G C8 C 131.0 0.1 1 242 . 17 G H1' H 5.55 0.02 1 243 . 17 G H2' H 4.48 0.02 1 244 . 17 G H3' H 4.24 0.02 1 245 . 17 G H4' H 4.29 0.02 1 246 . 17 G H5' H 3.93 0.02 1 247 . 17 G H5'' H 4.36 0.02 1 248 . 17 G H8 H 7.32 0.02 1 249 . 17 G H1 H 12.47 0.02 1 250 . 18 C C1' C 90.2 0.1 1 251 . 18 C C2' C 73.7 0.1 1 252 . 18 C C3' C 70.6 0.1 1 253 . 18 C C4' C 79.9 0.1 1 254 . 18 C C5 C 94.3 0.1 1 255 . 18 C C5' C 62.6 0.1 1 256 . 18 C C6 C 135.9 0.1 1 257 . 18 C H1' H 5.34 0.02 1 258 . 18 C H2' H 4.12 0.02 1 259 . 18 C H3' H 4.40 0.02 1 260 . 18 C H4' H 4.25 0.02 1 261 . 18 C H5 H 5.42 0.02 1 262 . 18 C H5' H 3.94 0.02 1 263 . 18 C H5'' H 4.38 0.02 1 264 . 18 C H6 H 7.65 0.02 1 265 . 19 A C1' C 88.8 0.1 1 266 . 19 A C2' C 72.9 0.1 1 267 . 19 A C3' C 72.6 0.1 1 268 . 19 A C4' C 80.6 0.1 1 269 . 19 A C5' C 65.1 0.1 1 270 . 19 A C8 C 135.6 0.1 1 271 . 19 A H1' H 5.83 0.02 1 272 . 19 A H2 H 7.74 0.02 1 273 . 19 A H2' H 4.68 0.02 1 274 . 19 A H3' H 4.34 0.02 1 275 . 19 A H4' H 4.43 0.02 1 276 . 19 A H5' H 4.02 0.02 1 277 . 19 A H5'' H 4.28 0.02 1 278 . 19 A H8 H 8.02 0.02 1 279 . 20 G C1' C 79.8 0.1 1 280 . 20 G C2' C 72.8 0.1 1 281 . 20 G C3' C 70.8 0.1 1 282 . 20 G C4' C 80.1 0.1 1 283 . 20 G C5 C 94.2 0.1 1 284 . 20 G C5' C 63.4 0.1 1 285 . 20 G C8 C 131.4 0.1 1 286 . 20 G H1' H 5.08 0.02 1 287 . 20 G H2' H 4.34 0.02 1 288 . 20 G H3' H 4.14 0.02 1 289 . 20 G H4' H 4.30 0.02 1 290 . 20 G H5' H 4.02 0.02 1 291 . 20 G H5'' H 4.20 0.02 1 292 . 20 G H8 H 7.22 0.02 1 293 . 20 G H1 H 11.15 0.02 1 294 . 21 C C1' C 90.9 0.1 1 295 . 21 C C2' C 73.4 0.1 1 296 . 21 C C3' C 69.4 0.1 1 297 . 21 C C4' C 78.9 0.1 1 298 . 21 C C5 C 93.9 0.1 1 299 . 21 C C5' C 62.1 0.1 1 300 . 21 C H1' H 5.33 0.02 1 301 . 21 C H2' H 3.99 0.02 1 302 . 21 C H3' H 4.31 0.02 1 303 . 21 C H4' H 4.22 0.02 1 304 . 21 C H5 H 5.16 0.02 1 305 . 21 C H5' H 3.88 0.02 1 306 . 21 C H5'' H 4.33 0.02 1 307 . 21 C H6 H 7.48 0.02 1 308 . 21 C H41 H 8.11 0.02 1 309 . 21 C H42 H 6.73 0.02 1 310 . 22 C C1' C 89.9 0.1 1 311 . 22 C C2' C 75.1 0.1 1 312 . 22 C C3' C 67.6 0.1 1 313 . 22 C C4' C 80.7 0.1 1 314 . 22 C C5 C 94.5 0.1 1 315 . 22 C C5' C 62.2 0.1 1 316 . 22 C H1' H 5.54 0.02 1 317 . 22 C H2' H 3.87 0.02 1 318 . 22 C H3' H 4.02 0.02 1 319 . 22 C H4' H 4.02 0.02 1 320 . 22 C H5 H 5.30 0.02 1 321 . 22 C H5' H 3.86 0.02 1 322 . 22 C H5'' H 4.29 0.02 1 323 . 22 C H6 H 7.51 0.02 1 stop_ save_