data_5278 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; PEMV-1 P1-P2 Frameshifting Pseudoknot Regularized Average Structure ; _BMRB_accession_number 5278 _BMRB_flat_file_name bmr5278.str _Entry_type original _Submission_date 2002-02-06 _Accession_date 2002-02-06 _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 Nixon P. L. . 2 Giedroc D. P. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 173 "13C chemical shifts" 36 "15N chemical shifts" 66 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2003-02-20 original author . stop_ _Original_release_date 2003-02-20 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution Structure of a Luteoviral P1-P2 frameshifting mRNA Pseudoknot' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 22213647 _PubMed_ID 12225754 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Nixon P. L. . 2 Rangan A. . . 3 Kim Y-G. . . 4 Rich A. . . 5 Hoffman D. W. . 6 Hennig M. . . 7 Giedroc D. P. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 322 _Journal_issue 3 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 621 _Page_last 633 _Year 2002 _Details . loop_ _Keyword Pseudoknot NMR Frameshifting Luteovirus 'Triple Helix' 'Protonated Cytidine' 'Ribonucleic Acid' stop_ save_ ################################## # Molecular system description # ################################## save_system_PEMV-1 _Saveframe_category molecular_system _Mol_system_name 'Pea Enation Mosaic Virus P1-P2 frameshifting pseudoknot' _Abbreviation_common PEMV-1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'P1-P2 frameshifting pseudoknot' $PEMV-1 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_PEMV-1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common 'Pea Enation Mosaic Virus Pseudoknot' _Abbreviation_common PEMV-1 _Molecular_mass . _Mol_thiol_state 'not present' _Details 'Minor Groove Triplex and an A(n-1)C+G-C(n) base quadruple.' ############################## # Polymer residue sequence # ############################## _Residue_count 33 _Mol_residue_sequence ; GAAUUCCGGUXGACUCCGGA GAAACAAAGUCAA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 0 G 2 1 A 3 2 A 4 3 U 5 4 U 6 5 C 7 6 C 8 7 G 9 8 G 10 9 U 11 10 CH 12 11 G 13 12 A 14 13 C 15 14 U 16 15 C 17 16 C 18 17 G 19 18 G 20 19 A 21 20 G 22 21 A 23 22 A 24 23 A 25 24 C 26 25 A 27 26 A 28 27 A 29 28 G 30 29 U 31 30 C 32 31 A 33 32 A stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ###################### # Polymer residues # ###################### save_chem_comp_CH _Saveframe_category polymer_residue _Mol_type 'RNA linking' _Name_common 'N3-PROTONATED CYTIDINE-5'-MONOPHOSPHATE' _BMRB_code . _PDB_code CH _Standard_residue_derivative . _Molecular_mass 324.204 _Mol_paramagnetic . _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Thu Jun 9 09:58:16 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons OP3 OP3 O . 0 . ? P P P . 0 . ? OP1 OP1 O . 0 . ? OP2 OP2 O . 0 . ? O5' O5' O . 0 . ? C5' C5' C . 0 . ? C4' C4' C . 0 . ? O4' O4' O . 0 . ? C3' C3' C . 0 . ? O3' O3' O . 0 . ? C2' C2' C . 0 . ? O2' O2' O . 0 . ? C1' C1' C . 0 . ? N1 N1 N . 1 . ? C2 C2 C . 0 . ? O2 O2 O . 0 . ? N3 N3 N . 0 . ? C4 C4 C . 0 . ? N4 N4 N . 0 . ? C5 C5 C . 0 . ? C6 C6 C . 0 . ? HOP3 HOP3 H . 0 . ? HOP2 HOP2 H . 0 . ? H5' H5' H . 0 . ? H5'' H5'' H . 0 . ? H4' H4' H . 0 . ? H3' H3' H . 0 . ? HO3' HO3' H . 0 . ? H2' H2' H . 0 . ? HO2' HO2' H . 0 . ? H1' H1' H . 0 . ? HN3 HN3 H . 0 . ? H41 H41 H . 0 . ? H42 H42 H . 0 . ? H5 H5 H . 0 . ? H6 H6 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name SING OP3 P ? ? SING OP3 HOP3 ? ? DOUB P OP1 ? ? SING P OP2 ? ? SING P O5' ? ? SING OP2 HOP2 ? ? SING O5' C5' ? ? SING C5' C4' ? ? SING C5' H5' ? ? SING C5' H5'' ? ? SING C4' O4' ? ? SING C4' C3' ? ? SING C4' H4' ? ? SING O4' C1' ? ? SING C3' O3' ? ? SING C3' C2' ? ? SING C3' H3' ? ? SING O3' HO3' ? ? SING C2' O2' ? ? SING C2' C1' ? ? SING C2' H2' ? ? SING O2' HO2' ? ? SING C1' N1 ? ? SING C1' H1' ? ? SING N1 C2 ? ? DOUB N1 C6 ? ? DOUB C2 O2 ? ? SING C2 N3 ? ? SING N3 C4 ? ? SING N3 HN3 ? ? SING C4 N4 ? ? DOUB C4 C5 ? ? SING N4 H41 ? ? SING N4 H42 ? ? SING C5 C6 ? ? SING C5 H5 ? ? SING C6 H6 ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $PEMV-1 'Pea enation mosaic virus' 12290 Viruses . Enamovirus 'Pea enation mosaic 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 $PEMV-1 '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 $PEMV-1 2 mM . KPO4 10 mM . KCl 100 mM . MgCl2 5 mM . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PEMV-1 0.2 mM '[U-95% 15N]' KPO4 10 mM . KCl 100 mM . MgCl2 5 mM . stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PEMV-1 0.3 mM '[U-95% 13C; U-95% 15N]' KPO4 10 mM . KCl 100 mM . MgCl2 5 mM . stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR _Saveframe_category software _Name X-PLOR _Version 3.851 loop_ _Task 'structure solution, refinement' stop_ _Details 'Brunger, A.T' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label . save_ save_NMR_applied_experiment _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _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 pH 6.0 0.1 n/a temperature 283 1 K 'ionic strength' 110 10 mM pressure 1 . atm stop_ save_ save_sample_cond_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 0.1 n/a temperature 298 1 K 'ionic strength' 100 10 mM pressure 1 . atm stop_ save_ save_sample_cond_3 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.8 0.1 n/a temperature 283 1 K 'ionic strength' 100 10 mM pressure 1 . atm 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 H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation 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 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'P1-P2 frameshifting 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 . 2 A H2 H 8.00 . . 2 . 2 A H8 H 8.16 . . 3 . 2 A H1' H 5.97 . . 4 . 2 A N1 N 225.90 . . 5 . 2 A N3 N 216.20 . . 6 . 3 A H2 H 7.98 . . 7 . 3 A H8 H 8.24 . . 8 . 3 A H1' H 5.66 . . 9 . 3 A N1 N 225.40 . . 10 . 3 A N7 N 232.50 . . 11 . 3 A N9 N 168.10 . . 12 . 4 U H5 H 5.86 . . 13 . 4 U H6 H 8.13 . . 14 . 4 U H1' H 5.79 . . 15 . 4 U H2' H 4.90 . . 16 . 4 U H3' H 4.52 . . 17 . 4 U C5 C 104.50 . . 18 . 4 U C1' C 91.22 . . 19 . 5 U H5 H 5.72 . . 20 . 5 U H6 H 7.80 . . 21 . 5 U H1' H 5.88 . . 22 . 5 U H2' H 4.55 . . 23 . 5 U C5 C 105.90 . . 24 . 5 U C1' C 91.70 . . 25 . 6 C H5 H 5.83 . . 26 . 6 C H6 H 7.99 . . 27 . 6 C H41 H 7.98 . . 28 . 6 C H42 H 7.16 . . 29 . 6 C H1' H 5.68 . . 30 . 6 C H2' H 4.11 . . 31 . 6 C H3' H 4.47 . . 32 . 6 C C5 C 98.00 . . 33 . 6 C C1' C 95.80 . . 34 . 6 C N3 N 195.70 . . 35 . 6 C N4 N 95.76 . . 36 . 7 C H5 H 5.32 . . 37 . 7 C H6 H 7.53 . . 38 . 7 C H41 H 8.36 . . 39 . 7 C H42 H 6.25 . . 40 . 7 C H1' H 3.60 . . 41 . 7 C H2' H 4.27 . . 42 . 7 C H3' H 4.24 . . 43 . 7 C C5 C 98.40 . . 44 . 7 C C1' C 94.12 . . 45 . 7 C N3 N 198.70 . . 46 . 7 C N4 N 96.23 . . 47 . 8 G H8 H 7.32 . . 48 . 8 G H1 H 12.81 . . 49 . 8 G H21 H 8.03 . . 50 . 8 G H22 H 6.31 . . 51 . 8 G H1' H 5.71 . . 52 . 8 G H2' H 4.51 . . 53 . 8 G H3' H 4.42 . . 54 . 8 G C1' C 93.20 . . 55 . 8 G N1 N 146.60 . . 56 . 8 G N2 N 75.21 . . 57 . 8 G N7 N 232.90 . . 58 . 8 G N9 N 170.40 . . 59 . 9 G H8 H 7.44 . . 60 . 9 G H1 H 13.26 . . 61 . 9 G H21 H 7.57 . . 62 . 9 G H22 H 7.36 . . 63 . 9 G H1' H 5.90 . . 64 . 9 G H2' H 3.79 . . 65 . 9 G H3' H 4.51 . . 66 . 9 G H5' H 4.18 . . 67 . 9 G H5'' H 5.11 . . 68 . 9 G C1' C 92.70 . . 69 . 9 G N1 N 148.70 . . 70 . 9 G N2 N 78.40 . . 71 . 9 G N7 N 232.40 . . 72 . 9 G N9 N 171.70 . . 73 . 10 U H5 H 5.47 . . 74 . 10 U H6 H 7.72 . . 75 . 10 U H3 H 12.62 . . 76 . 10 U H1' H 5.44 . . 77 . 10 U H2' H 4.00 . . 78 . 10 U H3' H 4.26 . . 79 . 10 U C5 C 105.10 . . 80 . 10 U C6 C 142.80 . . 81 . 10 U C1' C 93.10 . . 82 . 10 U N3 N 161.40 . . 83 . 11 CH H5 H 6.01 . . 84 . 11 CH H6 H 8.42 . . 85 . 11 CH HN3 H 12.56 . . 86 . 11 CH H41 H 11.15 . . 87 . 11 CH H42 H 9.85 . . 88 . 11 CH H1' H 6.15 . . 89 . 11 CH H2' H 3.97 . . 90 . 11 CH H3' H 4.82 . . 91 . 11 CH C5 C 98.20 . . 92 . 11 CH C1' C 90.20 . . 93 . 11 CH N3 N 142.70 . . 94 . 11 CH N4 N 115.80 . . 95 . 12 G H8 H 8.12 . . 96 . 12 G H1 H 11.81 . . 97 . 12 G H1' H 5.64 . . 98 . 12 G H2' H 4.60 . . 99 . 12 G C8 C 140.10 . . 100 . 12 G C1' C 94.06 . . 101 . 12 G N1 N 146.20 . . 102 . 12 G N7 N 234.60 . . 103 . 12 G N9 N 169.20 . . 104 . 13 A H2 H 7.69 . . 105 . 13 A H8 H 7.92 . . 106 . 13 A H61 H 8.10 . . 107 . 13 A H62 H 6.86 . . 108 . 13 A H1' H 6.01 . . 109 . 13 A H2' H 4.72 . . 110 . 13 A C8 C 139.90 . . 111 . 13 A C1' C 93.04 . . 112 . 13 A N1 N 219.90 . . 113 . 13 A N3 N 210.30 . . 114 . 13 A N6 N 88.14 . . 115 . 14 C H5 H 5.43 . . 116 . 14 C H6 H 6.91 . . 117 . 14 C H41 H 7.52 . . 118 . 14 C H42 H 7.30 . . 119 . 14 C H1' H 5.19 . . 120 . 14 C H2' H 3.67 . . 121 . 14 C H3' H 4.40 . . 122 . 14 C H4' H 4.30 . . 123 . 14 C C5 C 100.40 . . 124 . 14 C C1' C 95.21 . . 125 . 14 C C2' C 77.20 . . 126 . 14 C N3 N 196.90 . . 127 . 14 C N4 N 99.83 . . 128 . 15 U H5 H 5.93 . . 129 . 15 U H6 H 7.96 . . 130 . 15 U H1' H 6.20 . . 131 . 15 U H2' H 4.72 . . 132 . 15 U H3' H 4.48 . . 133 . 15 U C5 C 106.30 . . 134 . 15 U C1' C 89.53 . . 135 . 16 C H5 H 6.18 . . 136 . 16 C H6 H 8.21 . . 137 . 16 C H41 H 8.44 . . 138 . 16 C H42 H 7.20 . . 139 . 16 C H1' H 5.68 . . 140 . 16 C H2' H 4.72 . . 141 . 16 C H3' H 4.82 . . 142 . 16 C HO2' H 9.70 . . 143 . 16 C C5 C 98.14 . . 144 . 16 C C1' C 94.87 . . 145 . 16 C N3 N 199.80 . . 146 . 16 C N4 N 96.00 . . 147 . 17 C H5 H 5.68 . . 148 . 17 C H6 H 8.12 . . 149 . 17 C H41 H 8.51 . . 150 . 17 C H42 H 6.55 . . 151 . 17 C H1' H 5.94 . . 152 . 17 C H2' H 4.70 . . 153 . 17 C H3' H 4.33 . . 154 . 17 C H5' H 4.53 . . 155 . 17 C H5'' H 4.20 . . 156 . 17 C HO2' H 8.95 . . 157 . 17 C C5 C 98.54 . . 158 . 17 C C1' C 91.61 . . 159 . 17 C N3 N 196.00 . . 160 . 17 C N4 N 97.47 . . 161 . 18 G H8 H 7.50 . . 162 . 18 G H1 H 12.97 . . 163 . 18 G H21 H 8.10 . . 164 . 18 G H22 H 7.32 . . 165 . 18 G H1' H 5.49 . . 166 . 18 G H2' H 4.91 . . 167 . 18 G H3' H 4.58 . . 168 . 18 G C1' C 92.80 . . 169 . 18 G N1 N 148.80 . . 170 . 18 G N2 N 78.42 . . 171 . 18 G N7 N 233.00 . . 172 . 18 G N9 N 170.70 . . 173 . 19 G H8 H 7.06 . . 174 . 19 G H1 H 12.27 . . 175 . 19 G H21 H 8.55 . . 176 . 19 G H22 H 6.55 . . 177 . 19 G H1' H 5.84 . . 178 . 19 G H2' H 4.60 . . 179 . 19 G H3' H 4.54 . . 180 . 19 G H5' H 4.04 . . 181 . 19 G C1' C 93.90 . . 182 . 19 G N1 N 145.90 . . 183 . 19 G N7 N 232.60 . . 184 . 19 G N9 N 169.30 . . 185 . 20 A H2 H 8.55 . . 186 . 20 A H8 H 8.46 . . 187 . 20 A H1' H 6.09 . . 188 . 20 A H2' H 5.28 . . 189 . 20 A H3' H 4.56 . . 190 . 20 A N7 N 233.10 . . 191 . 20 A N9 N 171.00 . . 192 . 21 G H8 H 8.09 . . 193 . 21 G H1' H 6.50 . . 194 . 22 A H2 H 7.98 . . 195 . 22 A H8 H 8.40 . . 196 . 22 A H1' H 6.70 . . 197 . 22 A N7 N 234.20 . . 198 . 22 A N9 N 171.00 . . 199 . 23 A H2 H 8.04 . . 200 . 23 A H2' H 5.28 . . 201 . 23 A H3' H 5.13 . . 202 . 23 A N1 N 226.40 . . 203 . 23 A N3 N 216.10 . . 204 . 24 A H2 H 7.81 . . 205 . 24 A H8 H 8.10 . . 206 . 24 A H1' H 5.85 . . 207 . 24 A N1 N 225.00 . . 208 . 24 A N3 N 215.50 . . 209 . 25 C H5 H 4.93 . . 210 . 25 C H6 H 7.36 . . 211 . 25 C H1' H 5.51 . . 212 . 25 C C5 C 97.47 . . 213 . 26 A H2 H 7.52 . . 214 . 26 A H8 H 7.81 . . 215 . 26 A H1' H 5.54 . . 216 . 26 A N1 N 220.10 . . 217 . 26 A N3 N 216.20 . . 218 . 27 A H2 H 7.09 . . 219 . 27 A H8 H 7.80 . . 220 . 27 A H1' H 5.72 . . 221 . 27 A H2' H 4.67 . . 222 . 27 A N1 N 229.10 . . 223 . 27 A N3 N 213.30 . . 224 . 28 A H2 H 8.16 . . 225 . 28 A H8 H 7.81 . . 226 . 28 A H61 H 8.40 . . 227 . 28 A H62 H 7.99 . . 228 . 28 A H1' H 6.31 . . 229 . 28 A H2' H 4.89 . . 230 . 28 A N1 N 220.30 . . 231 . 28 A N3 N 214.90 . . 232 . 28 A N6 N 86.57 . . 233 . 28 A N7 N 233.40 . . 234 . 29 G H8 H 7.16 . . 235 . 29 G H1 H 13.77 . . 236 . 29 G H21 H 8.84 . . 237 . 29 G H22 H 6.64 . . 238 . 29 G H1' H 5.45 . . 239 . 29 G H2' H 4.46 . . 240 . 29 G H3' H 4.73 . . 241 . 29 G H4' H 4.57 . . 242 . 29 G H5' H 4.24 . . 243 . 29 G H5'' H 4.54 . . 244 . 29 G C1' C 94.06 . . 245 . 29 G N1 N 148.40 . . 246 . 29 G N2 N 77.00 . . 247 . 29 G N3 N 234.10 . . 248 . 30 U H5 H 4.81 . . 249 . 30 U H6 H 8.04 . . 250 . 30 U H3 H 14.25 . . 251 . 30 U H1' H 5.61 . . 252 . 30 U H2' H 4.49 . . 253 . 30 U H3' H 4.39 . . 254 . 30 U C5 C 102.90 . . 255 . 30 U C1' C 94.26 . . 256 . 30 U N3 N 162.40 . . 257 . 31 C H5 H 5.61 . . 258 . 31 C H6 H 7.85 . . 259 . 31 C H41 H 8.08 . . 260 . 31 C H42 H 6.79 . . 261 . 31 C H1' H 5.58 . . 262 . 31 C C5 C 98.76 . . 263 . 31 C C1' C 94.06 . . 264 . 31 C N3 N 195.30 . . 265 . 31 C N4 N 100.70 . . 266 . 32 A H2 H 6.91 . . 267 . 32 A H1' H 5.64 . . 268 . 32 A N1 N 224.90 . . 269 . 32 A N3 N 215.00 . . 270 . 33 A H2 H 7.98 . . 271 . 33 A H8 H 7.92 . . 272 . 33 A H1' H 5.72 . . 273 . 33 A N3 N 217.40 . . 274 . 33 A N7 N 235.50 . . 275 . 33 A N9 N 168.20 . . stop_ save_