data_26568 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; The structure of the SOLE element of oskar mRNA ; _BMRB_accession_number 26568 _BMRB_flat_file_name bmr26568.str _Entry_type original _Submission_date 2015-04-28 _Accession_date 2015-04-28 _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 Simon Bernd . . 2 Masiewicz P. . . 3 Ephrussi A. . . 4 Carlomagno T. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 251 "13C chemical shifts" 213 "15N chemical shifts" 38 "31P chemical shifts" 30 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-07-12 update BMRB 'update entry citation' 2015-05-04 original author 'original release' stop_ _Original_release_date 2015-05-04 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; The structure of the SOLE element of oskar mRNA ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26089324 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Simon Bernd . . 2 Masiewicz P. . . 3 Ephrussi A. . . 4 Carlomagno T. . . stop_ _Journal_abbreviation RNA _Journal_name_full RNA _Journal_volume 21 _Journal_issue 8 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1444 _Page_last 1453 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'The structure of the SOLE element of oskar mRNA' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'OSKAR MRNA' $OSKAR_MRNA stop_ _System_molecular_weight 10376.25762 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_OSKAR_MRNA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common OSKAR_MRNA _Molecular_mass 10376.25762 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 32 _Mol_residue_sequence ; GACGAUAUCGAGCAUCAAGA GUGAAUAUCGUC ; loop_ _Residue_seq_code _Residue_label 1 G 2 A 3 C 4 G 5 A 6 U 7 A 8 U 9 C 10 G 11 A 12 G 13 C 14 A 15 U 16 C 17 A 18 A 19 G 20 A 21 G 22 U 23 G 24 A 25 A 26 U 27 A 28 U 29 C 30 G 31 U 32 C stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value UNP P25158 P25158 . . . . . PDB 5A17 5A17 . . . . . PDB 5A18 5A18 . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $OSKAR_MRNA 'fruit fly' 7227 Eukaryota Metazoa Drosophila melanogaster 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 $OSKAR_MRNA 'recombinant technology' 'in vitro transcription' . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '0.3-0.4 mmol/l' loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $OSKAR_MRNA 0.35 mM 0.3 0.4 '[U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_AutoDep _Saveframe_category software _Name AutoDep _Version 4.3 loop_ _Vendor _Address _Electronic_address PDBe . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_CNS _Saveframe_category software _Name CNS _Version 1.1 loop_ _Vendor _Address _Electronic_address 'Brunger, Adams, Clore, Gros, Nilges and Read' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details 'REFINEMENT IN WATER' save_ save_FELIX _Saveframe_category software _Name FELIX _Version any loop_ _Vendor _Address _Electronic_address 'Accelrys Software Inc.' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Bruker_Avance-600 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_Bruker_Avance-800 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_HBCNB/HSCNB_1 _Saveframe_category NMR_applied_experiment _Experiment_name HBCNB/HSCNB _Sample_label $sample_1 save_ save_HCCH-COSY-TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-COSY-TOCSY _Sample_label $sample_1 save_ save_3D_EDITED_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D EDITED NOESY' _Sample_label $sample_1 save_ save_HBCNB/HSCNB_4 _Saveframe_category NMR_applied_experiment _Experiment_name HBCNB/HSCNB _Sample_label $sample_1 save_ save_HCCH-COSY-TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-COSY-TOCSY _Sample_label $sample_1 save_ save_3D_13C_EDITED_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C EDITED NOESY' _Sample_label $sample_1 save_ save_2D_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label $sample_1 save_ save_2D_HNN-COSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D HNN-COSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details 'pH [6.4], temp [308], pressure [0.0], ionStrength [0.0]' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.0 . mM pH 6.400 . pH pressure 1 . atm temperature 308.000 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio HDO C 13 protons ppm 4.676 internal indirect . . . 0.25144953 HDO H 1 protons ppm 4.676 internal indirect . . . 1 HDO N 15 protons ppm 4.676 internal indirect . . . 0.101329118 HDO P 31 protons ppm 4.676 internal indirect . . . 0.40480864 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Saveframe_category assigned_chemical_shifts _Details 'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/5a17/ebi/oskar_3_1.str.csh' loop_ _Software_label $CNS stop_ loop_ _Experiment_label HBCNB/HSCNB HCCH-COSY-TOCSY '3D EDITED NOESY' '3D 13C EDITED NOESY' '2D NOESY' '2D HNN-COSY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'OSKAR MRNA' _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 12.63 . 1 2 1 1 G H1' H 5.87 . 1 3 1 1 G H2' H 5.00 . 1 4 1 1 G H3' H 4.87 . 1 5 1 1 G H4' H 4.65 . 1 6 1 1 G H5' H 4.48 . 1 7 1 1 G H8 H 8.22 . 1 8 1 1 G C1' C 88.04 . 1 9 1 1 G C2' C 72.50 . 1 10 1 1 G C3' C 72.50 . 1 11 1 1 G C4' C 81.20 . 1 12 1 1 G C5' C 64.60 . 1 13 1 1 G C8 C 136.58 . 1 14 1 1 G N1 N 146.60 . 1 15 1 1 G N9 N 167.60 . 1 16 1 1 G P P -3.78 . 1 17 2 2 A H1' H 6.22 . 1 18 2 2 A H2 H 8.05 . 1 19 2 2 A H2' H 4.69 . 1 20 2 2 A H3' H 4.76 . 1 21 2 2 A H4' H 4.70 . 1 22 2 2 A H5' H 4.65 . 2 23 2 2 A H5'' H 4.48 . 2 24 2 2 A H8 H 8.25 . 1 25 2 2 A C1' C 90.40 . 1 26 2 2 A C2 C 151.40 . 1 27 2 2 A C2' C 73.00 . 1 28 2 2 A C3' C 70.60 . 1 29 2 2 A C4' C 80.04 . 1 30 2 2 A C5' C 63.30 . 1 31 2 2 A C8 C 137.75 . 1 32 2 2 A N9 N 170.70 . 1 33 2 2 A P P -3.94 . 1 34 3 3 C H1' H 5.58 . 1 35 3 3 C H2' H 4.54 . 1 36 3 3 C H3' H 4.52 . 1 37 3 3 C H4' H 4.52 . 1 38 3 3 C H5 H 5.31 . 1 39 3 3 C H5' H 4.20 . 2 40 3 3 C H5'' H 4.63 . 2 41 3 3 C H6 H 7.55 . 1 42 3 3 C C1' C 90.70 . 1 43 3 3 C C2' C 73.00 . 1 44 3 3 C C3' C 69.90 . 1 45 3 3 C C4' C 78.90 . 1 46 3 3 C C5 C 94.94 . 1 47 3 3 C C5' C 62.30 . 1 48 3 3 C C6 C 137.60 . 1 49 3 3 C N1 N 150.00 . 1 50 3 3 C P P -4.33 . 1 51 4 4 G H1 H 12.13 . 1 52 4 4 G H1' H 5.80 . 1 53 4 4 G H2' H 4.74 . 1 54 4 4 G H3' H 4.67 . 1 55 4 4 G H4' H 4.58 . 1 56 4 4 G H5' H 4.58 . 2 57 4 4 G H5'' H 4.23 . 2 58 4 4 G H8 H 7.58 . 1 59 4 4 G C1' C 90.30 . 1 60 4 4 G C2' C 72.80 . 1 61 4 4 G C3' C 70.10 . 1 62 4 4 G C4' C 79.60 . 1 63 4 4 G C5' C 63.30 . 1 64 4 4 G C8 C 133.70 . 1 65 4 4 G N1 N 146.60 . 1 66 4 4 G N9 N 168.70 . 1 67 4 4 G P P -4.46 . 1 68 5 5 A H1' H 6.04 . 1 69 5 5 A H2 H 7.79 . 1 70 5 5 A H2' H 4.58 . 1 71 5 5 A H3' H 4.70 . 1 72 5 5 A H4' H 4.62 . 1 73 5 5 A H5' H 4.68 . 2 74 5 5 A H5'' H 4.24 . 2 75 5 5 A H8 H 7.89 . 1 76 5 5 A C1' C 90.50 . 1 77 5 5 A C2 C 151.30 . 1 78 5 5 A C2' C 72.90 . 1 79 5 5 A C3' C 70.10 . 1 80 5 5 A C4' C 79.70 . 1 81 5 5 A C5' C 62.30 . 1 82 5 5 A C8 C 136.80 . 1 83 5 5 A N9 N 170.50 . 1 84 6 6 U H1' H 5.57 . 1 85 6 6 U H2' H 4.53 . 1 86 6 6 U H3 H 13.37 . 1 87 6 6 U H3' H 4.58 . 1 88 6 6 U H4' H 4.38 . 1 89 6 6 U H5 H 5.17 . 1 90 6 6 U H5' H 4.63 . 2 91 6 6 U H5'' H 4.20 . 2 92 6 6 U H6 H 7.67 . 1 93 6 6 U C1' C 90.50 . 1 94 6 6 U C2' C 73.10 . 1 95 6 6 U C3' C 69.60 . 1 96 6 6 U C5 C 100.30 . 1 97 6 6 U C5' C 61.70 . 1 98 6 6 U C6 C 138.50 . 1 99 6 6 U N1 N 145.50 . 1 100 6 6 U N3 N 161.90 . 1 101 6 6 U P P -1.08 . 1 102 7 7 A H1' H 6.11 . 1 103 7 7 A H2 H 7.26 . 1 104 7 7 A H2' H 4.54 . 1 105 7 7 A H3' H 4.71 . 1 106 7 7 A H4' H 4.63 . 1 107 7 7 A H5' H 4.28 . 2 108 7 7 A H5'' H 4.65 . 2 109 7 7 A H8 H 8.18 . 1 110 7 7 A C1' C 90.14 . 1 111 7 7 A C2 C 150.70 . 1 112 7 7 A C2' C 73.20 . 1 113 7 7 A C3' C 70.60 . 1 114 7 7 A C4' C 79.80 . 1 115 7 7 A C5' C 62.90 . 1 116 7 7 A C8 C 137.10 . 1 117 7 7 A N9 N 170.70 . 1 118 7 7 A P P -4.25 . 1 119 8 8 U H1' H 5.58 . 1 120 8 8 U H2' H 4.37 . 1 121 8 8 U H3 H 13.22 . 1 122 8 8 U H3' H 4.49 . 1 123 8 8 U H4' H 4.49 . 1 124 8 8 U H5 H 5.16 . 1 125 8 8 U H5' H 4.17 . 1 126 8 8 U H6 H 7.55 . 1 127 8 8 U C1' C 90.30 . 1 128 8 8 U C2' C 72.70 . 1 129 8 8 U C3' C 70.70 . 1 130 8 8 U C4' C 80.04 . 1 131 8 8 U C5 C 100.50 . 1 132 8 8 U C5' C 62.80 . 1 133 8 8 U C6 C 138.80 . 1 134 8 8 U N1 N 145.30 . 1 135 8 8 U P P -4.63 . 1 136 9 9 C H1' H 5.62 . 1 137 9 9 C H2' H 4.40 . 1 138 9 9 C H3' H 4.57 . 1 139 9 9 C H4' H 4.47 . 1 140 9 9 C H5 H 5.73 . 1 141 9 9 C H5' H 4.19 . 2 142 9 9 C H5'' H 4.50 . 2 143 9 9 C H6 H 7.82 . 1 144 9 9 C C1' C 90.70 . 1 145 9 9 C C2' C 73.00 . 1 146 9 9 C C3' C 70.90 . 1 147 9 9 C C4' C 80.00 . 1 148 9 9 C C5 C 95.55 . 1 149 9 9 C C5' C 62.80 . 1 150 9 9 C C6 C 139.00 . 1 151 9 9 C N1 N 150.40 . 1 152 9 9 C P P -4.45 . 1 153 10 10 G H1' H 5.50 . 1 154 10 10 G H2' H 4.60 . 1 155 10 10 G H3' H 4.64 . 1 156 10 10 G H4' H 4.50 . 1 157 10 10 G H5' H 4.43 . 2 158 10 10 G H5'' H 4.23 . 2 159 10 10 G H8 H 7.66 . 1 160 10 10 G C1' C 88.60 . 1 161 10 10 G C2' C 72.50 . 1 162 10 10 G C3' C 72.30 . 1 163 10 10 G C4' C 80.90 . 1 164 10 10 G C5' C 63.80 . 1 165 10 10 G C8 C 135.30 . 1 166 10 10 G N9 N 168.70 . 1 167 10 10 G P P -4.13 . 1 168 11 11 A H1' H 5.83 . 1 169 11 11 A H2 H 7.97 . 1 170 11 11 A H2' H 4.64 . 1 171 11 11 A H3' H 4.76 . 1 172 11 11 A H4' H 4.51 . 1 173 11 11 A H5' H 4.43 . 2 174 11 11 A H5'' H 4.23 . 2 175 11 11 A H8 H 8.02 . 1 176 11 11 A C1' C 89.00 . 1 177 11 11 A C2 C 151.90 . 1 178 11 11 A C2' C 73.50 . 1 179 11 11 A C3' C 71.30 . 1 180 11 11 A C4' C 81.00 . 1 181 11 11 A C5' C 63.50 . 1 182 11 11 A C8 C 137.70 . 1 183 11 11 A N9 N 169.10 . 1 184 11 11 A P P -4.09 . 1 185 12 12 G H1' H 5.61 . 1 186 12 12 G H2' H 4.55 . 1 187 12 12 G H3' H 4.71 . 1 188 12 12 G H4' H 4.45 . 1 189 12 12 G H5' H 4.41 . 2 190 12 12 G H5'' H 4.20 . 2 191 12 12 G H8 H 7.66 . 1 192 12 12 G C1' C 88.80 . 1 193 12 12 G C2' C 72.70 . 1 194 12 12 G C3' C 72.50 . 1 195 12 12 G C4' C 81.20 . 1 196 12 12 G C5' C 63.80 . 1 197 12 12 G C8 C 135.30 . 1 198 12 12 G N9 N 168.70 . 1 199 12 12 G P P -4.08 . 1 200 13 13 C H1' H 5.73 . 1 201 13 13 C H2' H 4.45 . 1 202 13 13 C H3' H 4.61 . 1 203 13 13 C H4' H 4.42 . 1 204 13 13 C H5 H 5.57 . 1 205 13 13 C H5' H 4.20 . 1 206 13 13 C H6 H 7.65 . 1 207 13 13 C C1' C 90.16 . 1 208 13 13 C C2' C 73.00 . 1 209 13 13 C C3' C 71.80 . 1 210 13 13 C C4' C 81.00 . 1 211 13 13 C C5 C 95.50 . 1 212 13 13 C C5' C 63.80 . 1 213 13 13 C C6 C 139.20 . 1 214 13 13 C P P -4.23 . 1 215 14 14 A H1' H 6.03 . 1 216 14 14 A H2 H 7.91 . 1 217 14 14 A H2' H 4.61 . 1 218 14 14 A H3' H 4.76 . 1 219 14 14 A H4' H 4.58 . 1 220 14 14 A H5' H 4.46 . 2 221 14 14 A H5'' H 4.26 . 2 222 14 14 A H8 H 8.29 . 1 223 14 14 A C1' C 88.70 . 1 224 14 14 A C2 C 152.10 . 1 225 14 14 A C2' C 73.70 . 1 226 14 14 A C3' C 72.50 . 1 227 14 14 A C4' C 81.20 . 1 228 14 14 A C5' C 63.50 . 1 229 14 14 A C8 C 138.20 . 1 230 14 14 A N9 N 169.10 . 1 231 14 14 A P P -4.08 . 1 232 15 15 U H1' H 5.64 . 1 233 15 15 U H2' H 4.30 . 1 234 15 15 U H3' H 4.56 . 1 235 15 15 U H4' H 4.37 . 1 236 15 15 U H5 H 5.56 . 1 237 15 15 U H5' H 4.16 . 2 238 15 15 U H5'' H 4.37 . 2 239 15 15 U H6 H 7.62 . 1 240 15 15 U C1' C 88.50 . 1 241 15 15 U C2' C 73.00 . 1 242 15 15 U C3' C 73.20 . 1 243 15 15 U C4' C 81.80 . 1 244 15 15 U C5 C 102.00 . 1 245 15 15 U C5' C 64.00 . 1 246 15 15 U C6 C 139.80 . 1 247 15 15 U N1 N 143.60 . 1 248 15 15 U P P -4.33 . 1 249 16 16 C H1' H 5.83 . 1 250 16 16 C H2' H 4.36 . 1 251 16 16 C H3' H 4.58 . 1 252 16 16 C H4' H 4.35 . 1 253 16 16 C H5 H 5.91 . 1 254 16 16 C H5' H 4.20 . 2 255 16 16 C H5'' H 4.08 . 2 256 16 16 C H6 H 7.77 . 1 257 16 16 C C1' C 89.07 . 1 258 16 16 C C2' C 73.50 . 1 259 16 16 C C3' C 73.50 . 1 260 16 16 C C4' C 81.45 . 1 261 16 16 C C5 C 96.10 . 1 262 16 16 C C5' C 64.30 . 1 263 16 16 C C6 C 140.50 . 1 264 16 16 C N1 N 150.60 . 1 265 16 16 C P P -4.25 . 1 266 17 17 A H1' H 5.89 . 1 267 17 17 A H2 H 7.92 . 1 268 17 17 A H2' H 4.78 . 1 269 17 17 A H3' H 4.92 . 1 270 17 17 A H4' H 4.52 . 1 271 17 17 A H5' H 4.28 . 2 272 17 17 A H5'' H 4.17 . 2 273 17 17 A H8 H 8.31 . 1 274 17 17 A C1' C 88.00 . 1 275 17 17 A C2 C 152.30 . 1 276 17 17 A C2' C 73.45 . 1 277 17 17 A C3' C 73.50 . 1 278 17 17 A C4' C 81.90 . 1 279 17 17 A C5' C 64.30 . 1 280 17 17 A C8 C 139.10 . 1 281 17 17 A N9 N 168.30 . 1 282 17 17 A P P -4.08 . 1 283 18 18 A H1' H 5.91 . 1 284 18 18 A H2 H 8.10 . 1 285 18 18 A H2' H 4.67 . 1 286 18 18 A H3' H 4.82 . 1 287 18 18 A H4' H 4.50 . 1 288 18 18 A H5' H 4.34 . 2 289 18 18 A H5'' H 4.24 . 2 290 18 18 A H8 H 8.20 . 1 291 18 18 A C1' C 87.75 . 1 292 18 18 A C2 C 152.50 . 1 293 18 18 A C2' C 74.15 . 1 294 18 18 A C3' C 74.10 . 1 295 18 18 A C4' C 82.10 . 1 296 18 18 A C5' C 64.50 . 1 297 18 18 A C8 C 138.70 . 1 298 18 18 A N9 N 168.30 . 1 299 18 18 A P P -3.85 . 1 300 19 19 G H1' H 5.55 . 1 301 19 19 G H2' H 4.66 . 1 302 19 19 G H3' H 4.77 . 1 303 19 19 G H4' H 4.51 . 1 304 19 19 G H5' H 4.36 . 2 305 19 19 G H5'' H 4.26 . 2 306 19 19 G H8 H 7.82 . 1 307 19 19 G C1' C 88.20 . 1 308 19 19 G C2' C 72.50 . 1 309 19 19 G C3' C 73.45 . 1 310 19 19 G C4' C 81.70 . 1 311 19 19 G C5' C 64.60 . 1 312 19 19 G C8 C 136.30 . 1 313 19 19 G N9 N 167.90 . 1 314 19 19 G P P -4.06 . 1 315 20 20 A H1' H 5.98 . 1 316 20 20 A H2 H 7.99 . 1 317 20 20 A H2' H 4.67 . 1 318 20 20 A H3' H 4.80 . 1 319 20 20 A H4' H 4.59 . 1 320 20 20 A H5' H 4.44 . 2 321 20 20 A H5'' H 4.26 . 2 322 20 20 A H8 H 8.18 . 1 323 20 20 A C1' C 88.40 . 1 324 20 20 A C2 C 152.20 . 1 325 20 20 A C2' C 73.60 . 1 326 20 20 A C3' C 72.80 . 1 327 20 20 A C4' C 81.30 . 1 328 20 20 A C5' C 64.00 . 1 329 20 20 A C8 C 138.30 . 1 330 20 20 A N9 N 168.50 . 1 331 20 20 A P P -4.06 . 1 332 21 21 G H1' H 5.66 . 1 333 21 21 G H2' H 4.62 . 1 334 21 21 G H3' H 4.66 . 1 335 21 21 G H4' H 4.51 . 1 336 21 21 G H5' H 4.24 . 1 337 21 21 G H8 H 7.75 . 1 338 21 21 G C1' C 88.70 . 1 339 21 21 G C2' C 73.00 . 1 340 21 21 G C3' C 72.00 . 1 341 21 21 G C4' C 81.20 . 1 342 21 21 G C8 C 135.60 . 1 343 21 21 G N9 N 168.70 . 1 344 21 21 G P P -0.66 . 1 345 22 22 U H1' H 5.75 . 1 346 22 22 U H2' H 4.39 . 1 347 22 22 U H3' H 4.70 . 1 348 22 22 U H4' H 4.41 . 1 349 22 22 U H5 H 5.51 . 1 350 22 22 U H5' H 4.41 . 2 351 22 22 U H5'' H 4.23 . 2 352 22 22 U H6 H 7.75 . 1 353 22 22 U C1' C 89.07 . 1 354 22 22 U C2' C 72.70 . 1 355 22 22 U C3' C 72.50 . 1 356 22 22 U C4' C 81.20 . 1 357 22 22 U C5 C 102.10 . 1 358 22 22 U C5' C 64.00 . 1 359 22 22 U C6 C 139.50 . 1 360 22 22 U N1 N 146.10 . 1 361 23 23 G H1' H 5.84 . 1 362 23 23 G H2' H 4.77 . 1 363 23 23 G H3' H 4.88 . 1 364 23 23 G H4' H 4.62 . 1 365 23 23 G H5' H 4.32 . 2 366 23 23 G H5'' H 4.24 . 2 367 23 23 G H8 H 8.05 . 1 368 23 23 G C1' C 86.80 . 1 369 23 23 G C2' C 73.45 . 1 370 23 23 G C3' C 73.90 . 1 371 23 23 G C4' C 82.40 . 1 372 23 23 G C5' C 64.20 . 1 373 23 23 G C8 C 135.80 . 1 374 23 23 G N9 N 167.30 . 1 375 23 23 G P P -4.25 . 1 376 24 24 A H1' H 5.69 . 1 377 24 24 A H2 H 7.92 . 1 378 24 24 A H2' H 4.66 . 1 379 24 24 A H3' H 4.61 . 1 380 24 24 A H4' H 4.41 . 1 381 24 24 A H5' H 4.20 . 1 382 24 24 A H8 H 8.25 . 1 383 24 24 A C1' C 89.70 . 1 384 24 24 A C2 C 152.10 . 1 385 24 24 A C2' C 72.70 . 1 386 24 24 A C3' C 71.68 . 1 387 24 24 A C4' C 80.00 . 1 388 24 24 A C8 C 138.80 . 1 389 24 24 A N9 N 168.30 . 1 390 24 24 A P P -4.14 . 1 391 25 25 A H1' H 6.02 . 1 392 25 25 A H2 H 7.87 . 1 393 25 25 A H2' H 4.78 . 1 394 25 25 A H3' H 4.75 . 1 395 25 25 A H4' H 4.66 . 1 396 25 25 A H5' H 4.50 . 2 397 25 25 A H5'' H 4.29 . 2 398 25 25 A H8 H 8.03 . 1 399 25 25 A C1' C 88.60 . 1 400 25 25 A C2 C 151.40 . 1 401 25 25 A C2' C 73.30 . 1 402 25 25 A C3' C 72.70 . 1 403 25 25 A C4' C 81.40 . 1 404 25 25 A C5' C 63.80 . 1 405 25 25 A C8 C 137.70 . 1 406 25 25 A N9 N 169.10 . 1 407 25 25 A P P -4.48 . 1 408 26 26 U H1' H 5.62 . 1 409 26 26 U H2' H 4.56 . 1 410 26 26 U H3 H 13.35 . 1 411 26 26 U H3' H 4.59 . 1 412 26 26 U H4' H 4.59 . 1 413 26 26 U H5 H 5.16 . 1 414 26 26 U H5' H 4.59 . 2 415 26 26 U H5'' H 4.26 . 2 416 26 26 U H6 H 7.67 . 1 417 26 26 U C1' C 90.50 . 1 418 26 26 U C2' C 72.90 . 1 419 26 26 U C3' C 70.40 . 1 420 26 26 U C4' C 79.80 . 1 421 26 26 U C5 C 100.50 . 1 422 26 26 U C5' C 62.80 . 1 423 26 26 U C6 C 139.00 . 1 424 26 26 U N1 N 145.50 . 1 425 26 26 U N3 N 161.90 . 1 426 26 26 U P P -4.25 . 1 427 27 27 A H1' H 6.12 . 1 428 27 27 A H2 H 7.28 . 1 429 27 27 A H2' H 4.59 . 1 430 27 27 A H3' H 4.74 . 1 431 27 27 A H4' H 4.63 . 1 432 27 27 A H5' H 4.28 . 2 433 27 27 A H5'' H 4.65 . 2 434 27 27 A H8 H 8.25 . 1 435 27 27 A C1' C 90.16 . 1 436 27 27 A C2 C 150.60 . 1 437 27 27 A C2' C 73.00 . 1 438 27 27 A C3' C 70.60 . 1 439 27 27 A C4' C 79.75 . 1 440 27 27 A C5' C 62.80 . 1 441 27 27 A C8 C 137.30 . 1 442 27 27 A N9 N 170.80 . 1 443 27 27 A P P -4.48 . 1 444 28 28 U H1' H 5.57 . 1 445 28 28 U H2' H 4.43 . 1 446 28 28 U H3 H 14.06 . 1 447 28 28 U H3' H 4.51 . 1 448 28 28 U H4' H 4.53 . 1 449 28 28 U H5 H 5.10 . 1 450 28 28 U H5' H 4.65 . 2 451 28 28 U H5'' H 4.20 . 2 452 28 28 U H6 H 7.72 . 1 453 28 28 U C1' C 90.70 . 1 454 28 28 U C2' C 73.00 . 1 455 28 28 U C3' C 69.80 . 1 456 28 28 U C4' C 79.10 . 1 457 28 28 U C5 C 99.96 . 1 458 28 28 U C5' C 61.90 . 1 459 28 28 U C6 C 138.93 . 1 460 28 28 U N1 N 146.10 . 1 461 28 28 U N3 N 162.30 . 1 462 28 28 U P P -4.63 . 1 463 29 29 C H1' H 5.67 . 1 464 29 29 C H2' H 4.64 . 1 465 29 29 C H3' H 4.61 . 1 466 29 29 C H4' H 4.53 . 1 467 29 29 C H5 H 5.67 . 1 468 29 29 C H5' H 4.59 . 2 469 29 29 C H5'' H 4.21 . 2 470 29 29 C H6 H 7.87 . 1 471 29 29 C C1' C 90.90 . 1 472 29 29 C C2' C 73.00 . 1 473 29 29 C C3' C 70.15 . 1 474 29 29 C C4' C 79.30 . 1 475 29 29 C C5 C 95.30 . 1 476 29 29 C C5' C 62.40 . 1 477 29 29 C C6 C 138.60 . 1 478 29 29 C N1 N 150.30 . 1 479 29 29 C P P -4.08 . 1 480 30 30 G H1 H 12.90 . 1 481 30 30 G H1' H 5.76 . 1 482 30 30 G H2' H 4.59 . 1 483 30 30 G H3' H 4.59 . 1 484 30 30 G H4' H 4.57 . 1 485 30 30 G H5' H 4.56 . 2 486 30 30 G H5'' H 4.20 . 2 487 30 30 G H8 H 7.64 . 1 488 30 30 G C1' C 90.80 . 1 489 30 30 G C2' C 72.70 . 1 490 30 30 G C3' C 70.40 . 1 491 30 30 G C4' C 79.60 . 1 492 30 30 G C5' C 63.10 . 1 493 30 30 G C8 C 133.70 . 1 494 30 30 G N1 N 147.20 . 1 495 30 30 G N9 N 168.30 . 1 496 30 30 G P P -4.25 . 1 497 31 31 U H1' H 5.68 . 1 498 31 31 U H2' H 4.28 . 1 499 31 31 U H3 H 14.61 . 1 500 31 31 U H3' H 4.61 . 1 501 31 31 U H4' H 4.50 . 1 502 31 31 U H5 H 5.17 . 1 503 31 31 U H5' H 4.69 . 2 504 31 31 U H5'' H 4.17 . 2 505 31 31 U H6 H 7.87 . 1 506 31 31 U C1' C 91.60 . 1 507 31 31 U C2' C 73.00 . 1 508 31 31 U C3' C 69.50 . 1 509 31 31 U C4' C 79.80 . 1 510 31 31 U C5 C 100.00 . 1 511 31 31 U C5' C 61.80 . 1 512 31 31 U C6 C 139.60 . 1 513 31 31 U N1 N 146.40 . 1 514 31 31 U N3 N 163.00 . 1 515 31 31 U P P -4.98 . 1 516 32 32 C H1' H 6.32 . 1 517 32 32 C H2' H 4.76 . 1 518 32 32 C H3' H 5.09 . 1 519 32 32 C H4' H 4.53 . 1 520 32 32 C H5 H 5.82 . 1 521 32 32 C H5' H 4.61 . 2 522 32 32 C H5'' H 4.23 . 2 523 32 32 C H6 H 7.65 . 1 524 32 32 C C1' C 89.14 . 1 525 32 32 C C2' C 82.40 . 1 526 32 32 C C3' C 75.30 . 1 527 32 32 C C4' C 82.60 . 1 528 32 32 C C5 C 96.70 . 1 529 32 32 C C5' C 63.20 . 1 530 32 32 C C6 C 139.80 . 1 531 32 32 C N1 N 150.00 . 1 532 32 32 C P P -4.56 . 1 stop_ save_