data_30665 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR assignment and RNA structure of 5' UTR region stem loop from West Nile Virus ; _BMRB_accession_number 30665 _BMRB_flat_file_name bmr30665.str _Entry_type original _Submission_date 2019-09-01 _Accession_date 2019-09-01 _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 Sharma S. . . 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" 277 "13C chemical shifts" 215 "15N chemical shifts" 13 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-08-18 original BMRB . stop_ _Original_release_date 2019-09-06 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR structure of Dengue West Nile viruses stem-loop B: A key cis-acting element for flavivirus replication ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 32807496 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sharma S. . . 2 Varani G. . . stop_ _Journal_abbreviation 'Biochem. Biophys. Res. Commun.' _Journal_volume . _Journal_issue . _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year 2020 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name "5' UTR region stem loop" _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 11841.064 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 37 _Mol_residue_sequence ; GGUUUCUUAGCACGAAGAUC UCGAUGUCUAAGAAACC ; loop_ _Residue_seq_code _Residue_label 1 G 2 G 3 U 4 U 5 U 6 C 7 U 8 U 9 A 10 G 11 C 12 A 13 C 14 G 15 A 16 A 17 G 18 A 19 U 20 C 21 U 22 C 23 G 24 A 25 U 26 G 27 U 28 C 29 U 30 A 31 A 32 G 33 A 34 A 35 A 36 C 37 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 'West Nile virus' 11082 Viruses . Flavivirus 'West Nile virus' 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 '0.5 mM [U-99% 13C; U-99% 15N] WNV, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 0.5 mM '[U-99% 13C; U-99% 15N]' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement 'structure calculation' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name Sparky _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'AVANCE II' _Field_strength 600 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'AVANCE II' _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label $sample_1 save_ save_2D_1H-1H_TOCSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_1 save_ save_1H_proton_4 _Saveframe_category NMR_applied_experiment _Experiment_name '1H proton' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 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' 20 . mM pH 6.0 . pH pressure 1 . atm temperature 298 . 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 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-15N HSQC' '2D NOESY' '2D 1H-1H TOCSY' '1H proton' '2D 1H-13C HSQC' stop_ loop_ _Sample_label $sample_1 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 1 1 G H1' H 5.777 0.05 1 2 1 1 G H2' H 4.916 0.05 1 3 1 1 G H3' H 3.988 0.05 1 4 1 1 G H4' H 4.104 0.05 1 5 1 1 G H5' H 3.639 0.05 1 6 1 1 G H5'' H 3.560 0.05 1 7 1 1 G H8 H 8.085 0.05 1 8 1 1 G C1' C 90.549 0.3 1 9 1 1 G C2' C 74.875 0.3 1 10 1 1 G C3' C 69.281 0.3 1 11 1 1 G C4' C 77.569 0.3 1 12 1 1 G C5' C 64.572 0.3 1 13 1 1 G C8 C 141.937 0.3 1 14 2 2 G H1 H 13.228 0.05 1 15 2 2 G H1' H 5.871 0.05 1 16 2 2 G H2' H 4.532 0.05 1 17 2 2 G H3' H 3.967 0.05 1 18 2 2 G H4' H 4.086 0.05 1 19 2 2 G H5' H 4.020 0.05 1 20 2 2 G H5'' H 3.932 0.05 1 21 2 2 G H8 H 7.529 0.05 1 22 2 2 G C1' C 91.755 0.3 1 23 2 2 G C2' C 74.786 0.3 1 24 2 2 G C3' C 69.367 0.3 1 25 2 2 G C4' C 79.330 0.3 1 26 2 2 G C5' C 63.925 0.3 1 27 2 2 G C8 C 141.874 0.3 1 28 2 2 G N1 N 148.114 0.12 1 29 3 3 U H1' H 5.708 0.05 1 30 3 3 U H2' H 3.939 0.05 1 31 3 3 U H3 H 14.161 0.05 1 32 3 3 U H3' H 3.953 0.05 1 33 3 3 U H4' H 4.068 0.05 1 34 3 3 U H5 H 5.822 0.05 1 35 3 3 U H5' H 3.931 0.05 1 36 3 3 U H5'' H 3.502 0.05 1 37 3 3 U H6 H 7.79 0.05 1 38 3 3 U C1' C 91.692 0.3 1 39 3 3 U C2' C 72.968 0.3 1 40 3 3 U C3' C 69.373 0.3 1 41 3 3 U C4' C 79.298 0.3 1 42 3 3 U C5 C 100.050 0.3 1 43 3 3 U C5' C 63.815 0.3 1 44 3 3 U C6 C 140.189 0.3 1 45 3 3 U N3 N 162.214 0.12 1 46 4 4 U H1' H 5.168 0.05 1 47 4 4 U H2' H 4.341 0.05 1 48 4 4 U H3 H 13.652 0.05 1 49 4 4 U H3' H 3.943 0.05 1 50 4 4 U H4' H 4.058 0.05 1 51 4 4 U H5 H 5.385 0.05 1 52 4 4 U H5' H 3.826 0.05 1 53 4 4 U H5'' H 3.450 0.05 1 54 4 4 U H6 H 7.364 0.05 1 55 4 4 U C1' C 92.108 0.3 1 56 4 4 U C2' C 72.438 0.3 1 57 4 4 U C3' C 69.373 0.3 1 58 4 4 U C4' C 79.319 0.3 1 59 4 4 U C5 C 99.529 0.3 1 60 4 4 U C5' C 65.064 0.3 1 61 4 4 U C6 C 139.237 0.3 1 62 4 4 U N3 N 161.870 0.12 1 63 5 5 U H1' H 5.524 0.05 1 64 5 5 U H2' H 4.449 0.05 1 65 5 5 U H3 H 13.501 0.05 1 66 5 5 U H3' H 3.920 0.05 1 67 5 5 U H4' H 4.062 0.05 1 68 5 5 U H5 H 5.426 0.05 1 69 5 5 U H5' H 3.433 0.05 1 70 5 5 U H5'' H 3.303 0.05 1 71 5 5 U H6 H 7.490 0.05 1 72 5 5 U C1' C 90.696 0.3 1 73 5 5 U C2' C 71.795 0.3 1 74 5 5 U C3' C 70.041 0.3 1 75 5 5 U C4' C 79.261 0.3 1 76 5 5 U C5 C 101.393 0.3 1 77 5 5 U C5' C 62.075 0.3 1 78 5 5 U C6 C 138.285 0.3 1 79 5 5 U N3 N 162.605 0.12 1 80 6 6 C H1' H 5.478 0.05 1 81 6 6 C H2' H 4.451 0.05 1 82 6 6 C H3' H 3.936 0.05 1 83 6 6 C H4' H 4.105 0.05 1 84 6 6 C H5 H 5.236 0.05 1 85 6 6 C H5' H 4.070 0.05 1 86 6 6 C H5'' H 3.513 0.05 1 87 6 6 C H6 H 7.791 0.05 1 88 6 6 C H41 H 8.081 0.05 1 89 6 6 C H42 H 6.729 0.05 1 90 6 6 C C1' C 90.257 0.3 1 91 6 6 C C2' C 73.473 0.3 1 92 6 6 C C3' C 70.113 0.3 1 93 6 6 C C4' C 80.390 0.3 1 94 6 6 C C5 C 94.487 0.3 1 95 6 6 C C5' C 62.474 0.3 1 96 6 6 C C6 C 137.973 0.3 1 97 7 7 U H1' H 5.741 0.05 1 98 7 7 U H2' H 4.499 0.05 1 99 7 7 U H3 H 13.665 0.05 1 100 7 7 U H3' H 3.925 0.05 1 101 7 7 U H4' H 4.040 0.05 1 102 7 7 U H5 H 5.818 0.05 1 103 7 7 U H5' H 3.839 0.05 1 104 7 7 U H5'' H 3.415 0.05 1 105 7 7 U H6 H 7.791 0.05 1 106 7 7 U C1' C 89.847 0.3 1 107 7 7 U C2' C 73.311 0.3 1 108 7 7 U C3' C 70.408 0.3 1 109 7 7 U C4' C 80.319 0.3 1 110 7 7 U C5 C 100.420 0.3 1 111 7 7 U C5' C 62.277 0.3 1 112 7 7 U C6 C 139.752 0.3 1 113 7 7 U N3 N 162.537 0.12 1 114 8 8 U H1' H 5.590 0.05 1 115 8 8 U H2' H 4.431 0.05 1 116 8 8 U H3 H 12.733 0.05 1 117 8 8 U H3' H 3.931 0.05 1 118 8 8 U H4' H 4.027 0.05 1 119 8 8 U H5 H 5.368 0.05 1 120 8 8 U H5' H 3.804 0.05 1 121 8 8 U H5'' H 3.642 0.05 1 122 8 8 U H6 H 7.907 0.05 1 123 8 8 U C1' C 89.565 0.3 1 124 8 8 U C2' C 71.937 0.3 1 125 8 8 U C3' C 70.260 0.3 1 126 8 8 U C4' C 80.048 0.3 1 127 8 8 U C5 C 100.693 0.3 1 128 8 8 U C5' C 61.316 0.3 1 129 8 8 U C6 C 140.095 0.3 1 130 8 8 U N3 N 162.619 0.12 1 131 9 9 A H1' H 5.558 0.05 1 132 9 9 A H2 H 6.474 0.05 1 133 9 9 A H2' H 4.397 0.05 1 134 9 9 A H3' H 3.911 0.05 1 135 9 9 A H4' H 4.008 0.05 1 136 9 9 A H5' H 3.647 0.05 1 137 9 9 A H5'' H 3.646 0.05 1 138 9 9 A H8 H 7.894 0.05 1 139 9 9 A C1' C 89.927 0.3 1 140 9 9 A C2 C 150.255 0.3 1 141 9 9 A C2' C 71.826 0.3 1 142 9 9 A C3' C 69.929 0.3 1 143 9 9 A C4' C 80.933 0.3 1 144 9 9 A C5' C 62.243 0.3 1 145 9 9 A C8 C 136.334 0.3 1 146 10 10 G H1 H 12.291 0.05 1 147 10 10 G H1' H 5.348 0.05 1 148 10 10 G H2' H 4.390 0.05 1 149 10 10 G H3' H 3.853 0.05 1 150 10 10 G H4' H 4.003 0.05 1 151 10 10 G H5' H 4.312 0.05 1 152 10 10 G H5'' H 3.619 0.05 1 153 10 10 G H8 H 7.987 0.05 1 154 10 10 G C1' C 90.220 0.3 1 155 10 10 G C2' C 71.518 0.3 1 156 10 10 G C3' C 69.812 0.3 1 157 10 10 G C4' C 80.887 0.3 1 158 10 10 G C5' C 63.428 0.3 1 159 10 10 G C8 C 136.350 0.3 1 160 10 10 G N1 N 147.974 0.12 1 161 11 11 C H1' H 5.337 0.05 1 162 11 11 C H2' H 4.395 0.05 1 163 11 11 C H3' H 3.864 0.05 1 164 11 11 C H4' H 4.007 0.05 1 165 11 11 C H5 H 6.076 0.05 1 166 11 11 C H5' H 3.638 0.05 1 167 11 11 C H5'' H 3.445 0.05 1 168 11 11 C H6 H 7.652 0.05 1 169 11 11 C C1' C 90.014 0.3 1 170 11 11 C C2' C 71.529 0.3 1 171 11 11 C C3' C 69.683 0.3 1 172 11 11 C C4' C 80.835 0.3 1 173 11 11 C C5 C 95.240 0.3 1 174 11 11 C C5' C 63.015 0.3 1 175 11 11 C C6 C 134.368 0.3 1 176 12 12 A H1' H 5.458 0.05 1 177 12 12 A H2' H 4.553 0.05 1 178 12 12 A H3' H 3.844 0.05 1 179 12 12 A H4' H 3.985 0.05 1 180 12 12 A H5' H 4.246 0.05 1 181 12 12 A H5'' H 3.625 0.05 1 182 12 12 A H8 H 7.869 0.05 1 183 12 12 A C1' C 89.900 0.3 1 184 12 12 A C2 C 150.224 0.3 1 185 12 12 A C2' C 73.001 0.3 1 186 12 12 A C3' C 70.692 0.3 1 187 12 12 A C4' C 80.789 0.3 1 188 12 12 A C5' C 62.927 0.3 1 189 12 12 A C8 C 134.009 0.3 1 190 13 13 C H1' H 5.827 0.05 1 191 13 13 C H2' H 4.506 0.05 1 192 13 13 C H3' H 3.825 0.05 1 193 13 13 C H4' H 3.979 0.05 1 194 13 13 C H5 H 5.508 0.05 1 195 13 13 C H5' H 4.246 0.05 1 196 13 13 C H5'' H 3.625 0.05 1 197 13 13 C H6 H 8.024 0.05 1 198 13 13 C C1' C 90.043 0.3 1 199 13 13 C C2' C 72.868 0.3 1 200 13 13 C C3' C 70.581 0.3 1 201 13 13 C C4' C 81.744 0.3 1 202 13 13 C C5 C 95.497 0.3 1 203 13 13 C C5' C 64.444 0.3 1 204 13 13 C C6 C 137.427 0.3 1 205 14 14 G H1 H 12.042 0.05 1 206 14 14 G H1' H 5.468 0.05 1 207 14 14 G H2' H 4.519 0.05 1 208 14 14 G H3' H 3.828 0.05 1 209 14 14 G H4' H 3.964 0.05 1 210 14 14 G H5' H 4.022 0.05 1 211 14 14 G H5'' H 3.625 0.05 1 212 14 14 G H8 H 7.638 0.05 1 213 14 14 G C1' C 88.948 0.3 1 214 14 14 G C2' C 72.818 0.3 1 215 14 14 G C3' C 70.350 0.3 1 216 14 14 G C4' C 82.242 0.3 1 217 14 14 G C5' C 62.633 0.3 1 218 14 14 G C8 C 138.238 0.3 1 219 14 14 G N1 N 146.275 0.12 1 220 15 15 A H1' H 5.468 0.05 1 221 15 15 A H2 H 7.588 0.05 1 222 15 15 A H2' H 4.398 0.05 1 223 15 15 A H3' H 4.436 0.05 1 224 15 15 A H4' H 3.950 0.05 1 225 15 15 A H5' H 3.928 0.05 1 226 15 15 A H5'' H 3.615 0.05 1 227 15 15 A H8 H 7.704 0.05 1 228 15 15 A C1' C 89.671 0.3 1 229 15 15 A C2 C 151.753 0.3 1 230 15 15 A C2' C 72.622 0.3 1 231 15 15 A C3' C 70.186 0.3 1 232 15 15 A C4' C 83.037 0.3 1 233 15 15 A C5' C 62.446 0.3 1 234 15 15 A C8 C 139.627 0.3 1 235 16 16 A H2' H 4.388 0.05 1 236 16 16 A H3' H 3.856 0.05 1 237 16 16 A H4' H 3.936 0.05 1 238 16 16 A H5' H 3.842 0.05 1 239 16 16 A H5'' H 3.605 0.05 1 240 19 19 U H5 H 5.729 0.05 1 241 19 19 U H6 H 7.818 0.05 1 242 20 20 C H3' H 4.313 0.05 1 243 20 20 C H4' H 3.943 0.05 1 244 20 20 C H5 H 5.340 0.05 1 245 20 20 C H5' H 3.771 0.05 1 246 20 20 C H5'' H 3.599 0.05 1 247 20 20 C H6 H 7.511 0.05 1 248 21 21 U H1' H 5.357 0.05 1 249 21 21 U H2' H 4.118 0.05 1 250 21 21 U H3 H 14.211 0.12 1 251 21 21 U H3' H 4.301 0.05 1 252 21 21 U H4' H 3.953 0.05 1 253 21 21 U H5 H 5.359 0.05 1 254 21 21 U H5' H 3.597 0.05 1 255 21 21 U H5'' H 3.593 0.05 1 256 21 21 U H6 H 7.406 0.05 1 257 21 21 U C1' C 91.275 0.3 1 258 21 21 U C2' C 72.561 0.3 1 259 21 21 U C3' C 70.186 0.3 1 260 21 21 U C4' C 84.239 0.3 1 261 21 21 U C5 C 100.696 0.3 1 262 21 21 U C5' C 62.009 0.3 1 263 21 21 U C6 C 137.583 0.3 1 264 21 21 U N3 N 162.600 0.12 1 265 22 22 C H1' H 5.357 0.05 1 266 22 22 C H2' H 4.118 0.05 1 267 22 22 C H3' H 4.290 0.05 1 268 22 22 C H4' H 3.950 0.05 1 269 22 22 C H5 H 5.479 0.05 1 270 22 22 C H5' H 4.345 0.05 1 271 22 22 C H5'' H 3.591 0.05 1 272 22 22 C H6 H 7.406 0.05 1 273 22 22 C H41 H 8.129 0.05 1 274 22 22 C H42 H 6.669 0.05 1 275 22 22 C C1' C 91.164 0.3 1 276 22 22 C C2' C 72.517 0.3 1 277 22 22 C C3' C 70.045 0.3 1 278 22 22 C C4' C 79.410 0.3 1 279 22 22 C C5 C 94.951 0.3 1 280 22 22 C C5' C 63.382 0.3 1 281 22 22 C C6 C 139.596 0.3 1 282 23 23 G H1 H 12.094 0.05 1 283 23 23 G H1' H 5.838 0.05 1 284 23 23 G H2' H 4.602 0.05 1 285 23 23 G H3' H 4.255 0.05 1 286 23 23 G H4' H 3.935 0.05 1 287 23 23 G H5' H 4.175 0.05 1 288 23 23 G H5'' H 3.590 0.05 1 289 23 23 G H8 H 8.008 0.05 1 290 23 23 G C1' C 91.140 0.3 1 291 23 23 G C2' C 72.781 0.3 1 292 23 23 G C3' C 69.707 0.3 1 293 23 23 G C4' C 79.551 0.3 1 294 23 23 G C5' C 63.164 0.3 1 295 23 23 G C8 C 137.614 0.3 1 296 23 23 G N1 N 146.920 0.12 1 297 24 24 A H1' H 5.338 0.05 1 298 24 24 A H2' H 4.598 0.05 1 299 24 24 A H3' H 4.180 0.05 1 300 24 24 A H4' H 3.927 0.05 1 301 24 24 A H5' H 3.773 0.05 1 302 24 24 A H5'' H 3.525 0.05 1 303 24 24 A H8 H 7.961 0.05 1 304 24 24 A C1' C 91.103 0.3 1 305 24 24 A C2 C 150.193 0.3 1 306 24 24 A C2' C 72.609 0.3 1 307 24 24 A C3' C 69.338 0.3 1 308 24 24 A C4' C 79.598 0.3 1 309 24 24 A C5' C 61.806 0.3 1 310 24 24 A C8 C 141.906 0.3 1 311 25 25 U H1' H 5.351 0.05 1 312 25 25 U H2' H 4.343 0.05 1 313 25 25 U H3' H 4.163 0.05 1 314 25 25 U H4' H 3.932 0.05 1 315 25 25 U H5 H 5.779 0.05 1 316 25 25 U H5' H 3.878 0.05 1 317 25 25 U H5'' H 3.480 0.05 1 318 25 25 U H6 H 7.862 0.05 1 319 25 25 U C1' C 91.056 0.3 1 320 25 25 U C2' C 72.515 0.3 1 321 25 25 U C3' C 69.824 0.3 1 322 25 25 U C4' C 80.425 0.3 1 323 25 25 U C5 C 102.753 0.3 1 324 25 25 U C5' C 61.900 0.3 1 325 25 25 U C6 C 139.877 0.3 1 326 26 26 G H3' H 4.136 0.05 1 327 26 26 G H4' H 3.930 0.05 1 328 26 26 G H5' H 3.707 0.05 1 329 26 26 G H5'' H 3.481 0.05 1 330 26 26 G C3' C 69.360 0.3 1 331 26 26 G C4' C 80.503 0.3 1 332 26 26 G C5' C 64.631 0.3 1 333 26 26 G C8 C 133.010 0.3 1 334 26 26 G N1 N 148.114 0.12 1 335 27 27 U H1' H 5.952 0.05 1 336 27 27 U H2' H 4.462 0.05 1 337 27 27 U H3' H 4.092 0.05 1 338 27 27 U H4' H 3.892 0.05 1 339 27 27 U H5 H 5.918 0.05 1 340 27 27 U H5' H 3.847 0.05 1 341 27 27 U H5'' H 3.446 0.05 1 342 27 27 U H6 H 7.867 0.05 1 343 27 27 U C1' C 91.423 0.3 1 344 27 27 U C2' C 74.994 0.3 1 345 27 27 U C3' C 69.828 0.3 1 346 27 27 U C4' C 79.301 0.3 1 347 27 27 U C5 C 102.614 0.3 1 348 27 27 U C5' C 64.698 0.3 1 349 27 27 U C6 C 132.776 0.3 1 350 28 28 C H1' H 5.780 0.05 1 351 28 28 C H2' H 4.520 0.05 1 352 28 28 C H3' H 4.062 0.05 1 353 28 28 C H4' H 4.275 0.05 1 354 28 28 C H5 H 5.406 0.05 1 355 28 28 C H5' H 4.311 0.05 1 356 28 28 C H5'' H 3.437 0.05 1 357 28 28 C H6 H 7.572 0.05 1 358 28 28 C H41 H 8.054 0.05 1 359 28 28 C H42 H 6.522 0.05 1 360 28 28 C C1' C 91.244 0.3 1 361 28 28 C C2' C 74.081 0.3 1 362 28 28 C C3' C 70.124 0.3 1 363 28 28 C C4' C 79.129 0.3 1 364 28 28 C C5 C 94.272 0.3 1 365 28 28 C C5' C 62.789 0.3 1 366 28 28 C C6 C 137.907 0.3 1 367 29 29 U H1' H 5.839 0.05 1 368 29 29 U H2' H 4.395 0.05 1 369 29 29 U H3 H 13.102 0.05 1 370 29 29 U H3' H 3.953 0.05 1 371 29 29 U H4' H 4.265 0.05 1 372 29 29 U H5 H 5.237 0.05 1 373 29 29 U H5' H 4.245 0.05 1 374 29 29 U H5'' H 3.435 0.05 1 375 29 29 U H6 H 7.638 0.05 1 376 29 29 U C1' C 91.211 0.3 1 377 29 29 U C2' C 73.494 0.3 1 378 29 29 U C3' C 70.405 0.3 1 379 29 29 U C4' C 79.239 0.3 1 380 29 29 U C5 C 102.321 0.3 1 381 29 29 U C5' C 61.229 0.3 1 382 29 29 U C6 C 139.435 0.3 1 383 29 29 U N3 N 161.770 0.12 1 384 30 30 A H1' H 5.470 0.05 1 385 30 30 A H2 H 6.188 0.05 1 386 30 30 A H2' H 4.439 0.05 1 387 30 30 A H3' H 3.938 0.05 1 388 30 30 A H4' H 4.195 0.05 1 389 30 30 A H5' H 4.020 0.05 1 390 30 30 A H5'' H 3.439 0.05 1 391 30 30 A H8 H 8.023 0.05 1 392 30 30 A C1' C 90.968 0.3 1 393 30 30 A C2 C 150.068 0.3 1 394 30 30 A C2' C 74.551 0.3 1 395 30 30 A C3' C 69.594 0.3 1 396 30 30 A C4' C 79.332 0.3 1 397 30 30 A C5' C 61.556 0.3 1 398 30 30 A C8 C 136.524 0.3 1 399 31 31 A H1' H 5.839 0.05 1 400 31 31 A H2 H 7.074 0.05 1 401 31 31 A H2' H 4.419 0.05 1 402 31 31 A H3' H 3.933 0.05 1 403 31 31 A H4' H 4.177 0.05 1 404 31 31 A H5' H 3.929 0.05 1 405 31 31 A H5'' H 3.435 0.05 1 406 31 31 A H8 H 7.862 0.05 1 407 31 31 A C1' C 89.833 0.3 1 408 31 31 A C2 C 150.099 0.3 1 409 31 31 A C2' C 73.115 0.3 1 410 31 31 A C3' C 70.234 0.3 1 411 31 31 A C4' C 79.520 0.3 1 412 31 31 A C5' C 61.650 0.3 1 413 31 31 A C8 C 136.503 0.3 1 414 32 32 G H1 H 12.244 0.05 1 415 32 32 G H1' H 5.415 0.05 1 416 32 32 G H2' H 4.416 0.05 1 417 32 32 G H3' H 3.916 0.05 1 418 32 32 G H4' H 4.181 0.05 1 419 32 32 G H5' H 3.750 0.05 1 420 32 32 G H5'' H 3.432 0.05 1 421 32 32 G H8 H 7.542 0.05 1 422 32 32 G C1' C 89.571 0.3 1 423 32 32 G C2' C 72.481 0.3 1 424 32 32 G C3' C 69.984 0.3 1 425 32 32 G C4' C 79.707 0.3 1 426 32 32 G C5' C 61.806 0.3 1 427 32 32 G C8 C 135.684 0.3 1 428 32 32 G N1 N 146.595 0.12 1 429 33 33 A H1' H 5.335 0.05 1 430 33 33 A H2 H 6.874 0.05 1 431 33 33 A H2' H 4.376 0.05 1 432 33 33 A H3' H 3.929 0.05 1 433 33 33 A H4' H 4.186 0.05 1 434 33 33 A H5' H 3.625 0.05 1 435 33 33 A H5'' H 3.436 0.05 1 436 33 33 A H8 H 7.738 0.05 1 437 33 33 A C1' C 90.288 0.3 1 438 33 33 A C2 C 151.270 0.3 1 439 33 33 A C2' C 71.654 0.3 1 440 33 33 A C3' C 69.282 0.3 1 441 33 33 A C4' C 80.253 0.3 1 442 33 33 A C5' C 64.168 0.3 1 443 33 33 A C8 C 136.615 0.3 1 444 34 34 A H1' H 5.731 0.05 1 445 34 34 A H2 H 6.945 0.05 1 446 34 34 A H2' H 4.440 0.05 1 447 34 34 A H3' H 3.864 0.05 1 448 34 34 A H4' H 4.164 0.05 1 449 34 34 A H5' H 3.576 0.05 1 450 34 34 A H5'' H 3.371 0.05 1 451 34 34 A H8 H 7.722 0.05 1 452 34 34 A C1' C 90.990 0.3 1 453 34 34 A C2 C 151.207 0.3 1 454 34 34 A C2' C 72.762 0.3 1 455 34 34 A C3' C 70.686 0.3 1 456 34 34 A C4' C 79.083 0.3 1 457 34 34 A C5' C 62.009 0.3 1 458 34 34 A C8 C 136.396 0.3 1 459 35 35 A H1' H 5.515 0.05 1 460 35 35 A H2 H 7.602 0.05 1 461 35 35 A H2' H 4.418 0.05 1 462 35 35 A H3' H 3.855 0.05 1 463 35 35 A H4' H 4.172 0.05 1 464 35 35 A H5' H 3.666 0.05 1 465 35 35 A H5'' H 3.315 0.05 1 466 35 35 A H8 H 7.894 0.05 1 467 35 35 A C1' C 90.034 0.3 1 468 35 35 A C2 C 151.753 0.3 1 469 35 35 A C2' C 72.840 0.3 1 470 35 35 A C3' C 69.859 0.3 1 471 35 35 A C4' C 79.285 0.3 1 472 35 35 A C5' C 61.182 0.3 1 473 35 35 A C8 C 136.958 0.3 1 474 36 36 C H1' H 5.540 0.05 1 475 36 36 C H2' H 4.501 0.05 1 476 36 36 C H3' H 4.072 0.05 1 477 36 36 C H4' H 4.123 0.05 1 478 36 36 C H5 H 5.80 0.05 1 479 36 36 C H5' H 3.771 0.05 1 480 36 36 C H5'' H 3.304 0.05 1 481 36 36 C H6 H 7.373 0.05 1 482 36 36 C H41 H 8.204 0.05 1 483 36 36 C H42 H 6.816 0.05 1 484 36 36 C C1' C 90.054 0.3 1 485 36 36 C C2' C 71.888 0.3 1 486 36 36 C C3' C 69.797 0.3 1 487 36 36 C C4' C 82.282 0.3 1 488 36 36 C C5 C 94.818 0.3 1 489 36 36 C C5' C 61.432 0.3 1 490 36 36 C C6 C 137.910 0.3 1 491 37 37 C H1' H 5.540 0.05 1 492 37 37 C H2' H 3.939 0.05 1 493 37 37 C H3' H 4.082 0.05 1 494 37 37 C H4' H 4.098 0.05 1 495 37 37 C H5 H 5.377 0.05 1 496 37 37 C H5' H 3.677 0.05 1 497 37 37 C H5'' H 3.221 0.05 1 498 37 37 C H6 H 7.570 0.05 1 499 37 37 C C1' C 88.977 0.3 1 500 37 37 C C2' C 72.793 0.3 1 501 37 37 C C3' C 69.318 0.3 1 502 37 37 C C4' C 81.751 0.3 1 503 37 37 C C5 C 95.801 0.3 1 504 37 37 C C5' C 61.650 0.3 1 505 37 37 C C6 C 136.350 0.3 1 stop_ save_