data_54037 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 54037 _Entry.Title ; mir377 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2026-09-28 _Entry.Accession_date 2026-09-28 _Entry.Last_release_date 2026-09-28 _Entry.Original_release_date 2026-09-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jacopo Manigrasso . . . . 54037 2 Emeline Mestdach . . . . 54037 3 Riccardo Quaia . . . . 54037 4 Daniela Dankova . . . . 54037 5 Mattias Bood . . . . 54037 6 Malin Lamurell . . . . 54037 7 Andrey Frolov . . . . 54037 8 Mathew 'D. Disney' . . . . 54037 9 Anders Hogner . . . . 54037 10 Stefan Geschwindner . . . . 54037 11 Celestine Chi . . . . 54037 12 Giuseppina 'La Sala' . . . . 54037 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 54037 heteronucl_NOEs 1 54037 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 62 54037 '15N chemical shifts' 11 54037 '1H chemical shifts' 162 54037 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2026-10-27 . original BMRB . 54037 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 54037 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Conformational dynamics at the pre-miR-377 Dicer site governs selective small-molecule recognition ; _Citation.Status submitted _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Jacopo Manigrasso . . . . 54037 1 2 Emeline Mestdach . . . . 54037 1 3 Riccardo Quaia . . . . 54037 1 4 Daniela Dankova . . . . 54037 1 5 Mattias Bood . . . . 54037 1 6 Malin Lamurell . . . . 54037 1 7 Andrey Frolov . . . . 54037 1 8 Mathew 'D. Disney' . . . . 54037 1 9 Anders Hogner . . . . 54037 1 10 Stefan Geschwindner . . . . 54037 1 11 Celestine Chi . . . . 54037 1 12 Giuseppina 'La Sala' . . . . 54037 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 54037 _Assembly.ID 1 _Assembly.Name mir377 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 mir377 1 $entity_1 . . yes native no no . . . 54037 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 54037 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGAAUUCGCUUUAUUUAUGU UGAAUCC ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites yes _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 27 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . G . 54037 1 2 . G . 54037 1 3 . A . 54037 1 4 . A . 54037 1 5 . U . 54037 1 6 . U . 54037 1 7 . C . 54037 1 8 . G . 54037 1 9 . C . 54037 1 10 . U . 54037 1 11 . U . 54037 1 12 . U . 54037 1 13 . A . 54037 1 14 . U . 54037 1 15 . U . 54037 1 16 . U . 54037 1 17 . A . 54037 1 18 . U . 54037 1 19 . G . 54037 1 20 . U . 54037 1 21 . U . 54037 1 22 . G . 54037 1 23 . A . 54037 1 24 . A . 54037 1 25 . U . 54037 1 26 . C . 54037 1 27 . C . 54037 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . G 1 1 54037 1 . G 2 2 54037 1 . A 3 3 54037 1 . A 4 4 54037 1 . U 5 5 54037 1 . U 6 6 54037 1 . C 7 7 54037 1 . G 8 8 54037 1 . C 9 9 54037 1 . U 10 10 54037 1 . U 11 11 54037 1 . U 12 12 54037 1 . A 13 13 54037 1 . U 14 14 54037 1 . U 15 15 54037 1 . U 16 16 54037 1 . A 17 17 54037 1 . U 18 18 54037 1 . G 19 19 54037 1 . U 20 20 54037 1 . U 21 21 54037 1 . G 22 22 54037 1 . A 23 23 54037 1 . A 24 24 54037 1 . U 25 25 54037 1 . C 26 26 54037 1 . C 27 27 54037 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 54037 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 54037 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 54037 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'obtained from a vendor' . . . . . . . . . . . . . . . . 54037 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 54037 _Sample.ID 1 _Sample.Name mir377 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 mir377 '[U-100% 15N]' . . 1 $entity_1 . . 1100 200 2000 uM . . . . 54037 1 2 mir377 '[U-100% 13C]' . . 1 $entity_1 . . 1100 200 2000 uM . . . . 54037 1 3 DSS 'natural abundance' . . . . . . 10 . . uM . . . . 54037 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 54037 _Sample_condition_list.ID 1 _Sample_condition_list.Name mir377 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 54037 1 pH 7.4 . pH 54037 1 pressure 1 . atm 54037 1 temperature 290 . K 54037 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 54037 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 54037 1 'data analysis' . 54037 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 54037 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '600/800 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 54037 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 54037 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 54037 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 54037 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 54037 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 54037 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_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 54037 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name mir.prot _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY' . . . 54037 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 54037 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 G H1 H 1 12.446 0.002 . . . . . . . 1 G H1 . 54037 1 2 . 1 . 1 1 1 G H1' H 1 5.992 0.014 . . . . . . . 1 G H1' . 54037 1 3 . 1 . 1 1 1 G H8 H 1 8.138 0.021 . . . . . . . 1 G H8 . 54037 1 4 . 1 . 1 1 1 G C1' C 13 91.957 . . . . . . . . 1 G C1' . 54037 1 5 . 1 . 1 1 1 G C8 C 13 139.615 . . . . . . . . 1 G C8 . 54037 1 6 . 1 . 1 1 1 G N1 N 15 147.530 . . . . . . . . 1 G N1 . 54037 1 7 . 1 . 1 2 2 G H1 H 1 12.559 0.024 . . . . . . . 2 G H1 . 54037 1 8 . 1 . 1 2 2 G H8 H 1 7.663 . . . . . . . . 2 G H8 . 54037 1 9 . 1 . 1 2 2 G C8 C 13 137.690 . . . . . . . . 2 G C8 . 54037 1 10 . 1 . 1 2 2 G N1 N 15 147.490 . . . . . . . . 2 G N1 . 54037 1 11 . 1 . 1 3 3 A H8 H 1 7.977 . . . . . . . . 3 A H8 . 54037 1 12 . 1 . 1 3 3 A C8 C 13 140.767 . . . . . . . . 3 A C8 . 54037 1 13 . 1 . 1 4 4 A H1' H 1 5.830 0.007 . . . . . . . 4 A H1' . 54037 1 14 . 1 . 1 4 4 A H2 H 1 7.902 0.007 . . . . . . . 4 A H2 . 54037 1 15 . 1 . 1 4 4 A H2' H 1 4.488 0.003 . . . . . . . 4 A H2' . 54037 1 16 . 1 . 1 4 4 A H3' H 1 4.596 0.003 . . . . . . . 4 A H3' . 54037 1 17 . 1 . 1 4 4 A H4' H 1 4.414 0.002 . . . . . . . 4 A H4' . 54037 1 18 . 1 . 1 4 4 A H5' H 1 4.132 0.010 . . . . . . . 4 A H5' . 54037 1 19 . 1 . 1 4 4 A H8 H 1 7.995 0.008 . . . . . . . 4 A H8 . 54037 1 20 . 1 . 1 4 4 A H61 H 1 6.674 0.003 . . . . . . . 4 A H61 . 54037 1 21 . 1 . 1 4 4 A C1' C 13 91.302 0.065 . . . . . . . 4 A C1' . 54037 1 22 . 1 . 1 4 4 A C2 C 13 154.476 0.063 . . . . . . . 4 A C2 . 54037 1 23 . 1 . 1 4 4 A C8 C 13 140.326 0.098 . . . . . . . 4 A C8 . 54037 1 24 . 1 . 1 5 5 U H1' H 1 5.479 0.009 . . . . . . . 5 U H1' . 54037 1 25 . 1 . 1 5 5 U H2' H 1 4.542 0.014 . . . . . . . 5 U H2' . 54037 1 26 . 1 . 1 5 5 U H3' H 1 4.380 0.002 . . . . . . . 5 U H3' . 54037 1 27 . 1 . 1 5 5 U H5 H 1 5.001 0.009 . . . . . . . 5 U H5 . 54037 1 28 . 1 . 1 5 5 U H5' H 1 4.109 0.007 . . . . . . . 5 U H5' . 54037 1 29 . 1 . 1 5 5 U H6 H 1 7.564 0.008 . . . . . . . 5 U H6 . 54037 1 30 . 1 . 1 5 5 U C5 C 13 103.244 0.139 . . . . . . . 5 U C5 . 54037 1 31 . 1 . 1 5 5 U C6 C 13 142.147 0.045 . . . . . . . 5 U C6 . 54037 1 32 . 1 . 1 6 6 U H1' H 1 5.785 0.008 . . . . . . . 6 U H1' . 54037 1 33 . 1 . 1 6 6 U H2' H 1 4.792 0.006 . . . . . . . 6 U H2' . 54037 1 34 . 1 . 1 6 6 U H3 H 1 13.744 0.022 . . . . . . . 6 U H3 . 54037 1 35 . 1 . 1 6 6 U H3' H 1 4.670 0.005 . . . . . . . 6 U H3' . 54037 1 36 . 1 . 1 6 6 U H4' H 1 4.378 0.005 . . . . . . . 6 U H4' . 54037 1 37 . 1 . 1 6 6 U H5 H 1 5.486 0.007 . . . . . . . 6 U H5 . 54037 1 38 . 1 . 1 6 6 U H5' H 1 4.197 0.006 . . . . . . . 6 U H5' . 54037 1 39 . 1 . 1 6 6 U H6 H 1 7.971 0.010 . . . . . . . 6 U H6 . 54037 1 40 . 1 . 1 6 6 U C1' C 13 92.342 0.083 . . . . . . . 6 U C1' . 54037 1 41 . 1 . 1 6 6 U C5 C 13 103.566 0.117 . . . . . . . 6 U C5 . 54037 1 42 . 1 . 1 6 6 U C6 C 13 142.687 0.037 . . . . . . . 6 U C6 . 54037 1 43 . 1 . 1 6 6 U N3 N 15 162.596 . . . . . . . . 6 U N3 . 54037 1 44 . 1 . 1 7 7 C H1' H 1 5.575 0.011 . . . . . . . 7 C H1' . 54037 1 45 . 1 . 1 7 7 C H2' H 1 4.475 0.005 . . . . . . . 7 C H2' . 54037 1 46 . 1 . 1 7 7 C H3' H 1 4.214 . . . . . . . . 7 C H3' . 54037 1 47 . 1 . 1 7 7 C H4' H 1 4.077 0.003 . . . . . . . 7 C H4' . 54037 1 48 . 1 . 1 7 7 C H5 H 1 5.639 0.013 . . . . . . . 7 C H5 . 54037 1 49 . 1 . 1 7 7 C H6 H 1 7.805 0.011 . . . . . . . 7 C H6 . 54037 1 50 . 1 . 1 7 7 C H41 H 1 6.878 0.019 . . . . . . . 7 C H41 . 54037 1 51 . 1 . 1 7 7 C H42 H 1 8.209 0.011 . . . . . . . 7 C H42 . 54037 1 52 . 1 . 1 7 7 C C1' C 13 93.602 0.071 . . . . . . . 7 C C1' . 54037 1 53 . 1 . 1 7 7 C C5 C 13 98.165 0.017 . . . . . . . 7 C C5 . 54037 1 54 . 1 . 1 7 7 C C6 C 13 140.983 0.036 . . . . . . . 7 C C6 . 54037 1 55 . 1 . 1 7 7 C N3 N 15 195.173 . . . . . . . . 7 C N3 . 54037 1 56 . 1 . 1 8 8 G H1 H 1 10.485 0.008 . . . . . . . 8 G H1 . 54037 1 57 . 1 . 1 8 8 G H1' H 1 5.583 0.005 . . . . . . . 8 G H1' . 54037 1 58 . 1 . 1 8 8 G H2' H 1 4.588 0.005 . . . . . . . 8 G H2' . 54037 1 59 . 1 . 1 8 8 G H3' H 1 4.425 0.008 . . . . . . . 8 G H3' . 54037 1 60 . 1 . 1 8 8 G H4' H 1 4.307 0.002 . . . . . . . 8 G H4' . 54037 1 61 . 1 . 1 8 8 G H5' H 1 4.036 0.003 . . . . . . . 8 G H5' . 54037 1 62 . 1 . 1 8 8 G H8 H 1 7.460 0.010 . . . . . . . 8 G H8 . 54037 1 63 . 1 . 1 8 8 G H21 H 1 6.611 0.020 . . . . . . . 8 G H21 . 54037 1 64 . 1 . 1 8 8 G H22 H 1 6.890 0.003 . . . . . . . 8 G H22 . 54037 1 65 . 1 . 1 8 8 G C1' C 13 93.624 0.083 . . . . . . . 8 G C1' . 54037 1 66 . 1 . 1 8 8 G C8 C 13 136.361 0.083 . . . . . . . 8 G C8 . 54037 1 67 . 1 . 1 8 8 G N1 N 15 144.512 0.074 . . . . . . . 8 G N1 . 54037 1 68 . 1 . 1 9 9 C H1' H 1 5.584 0.007 . . . . . . . 9 C H1' . 54037 1 69 . 1 . 1 9 9 C H2' H 1 4.477 0.006 . . . . . . . 9 C H2' . 54037 1 70 . 1 . 1 9 9 C H3' H 1 4.324 0.006 . . . . . . . 9 C H3' . 54037 1 71 . 1 . 1 9 9 C H5 H 1 5.252 0.008 . . . . . . . 9 C H5 . 54037 1 72 . 1 . 1 9 9 C H6 H 1 7.503 0.007 . . . . . . . 9 C H6 . 54037 1 73 . 1 . 1 9 9 C H41 H 1 6.974 0.018 . . . . . . . 9 C H41 . 54037 1 74 . 1 . 1 9 9 C H42 H 1 8.299 0.016 . . . . . . . 9 C H42 . 54037 1 75 . 1 . 1 9 9 C C5 C 13 97.136 0.028 . . . . . . . 9 C C5 . 54037 1 76 . 1 . 1 9 9 C C6 C 13 140.749 0.093 . . . . . . . 9 C C6 . 54037 1 77 . 1 . 1 9 9 C N3 N 15 195.925 . . . . . . . . 9 C N3 . 54037 1 78 . 1 . 1 10 10 U H2' H 1 4.415 0.003 . . . . . . . 10 U H2' . 54037 1 79 . 1 . 1 10 10 U H3' H 1 4.225 0.006 . . . . . . . 10 U H3' . 54037 1 80 . 1 . 1 10 10 U H5 H 1 5.510 0.007 . . . . . . . 10 U H5 . 54037 1 81 . 1 . 1 10 10 U H5' H 1 4.022 0.012 . . . . . . . 10 U H5' . 54037 1 82 . 1 . 1 10 10 U H6 H 1 7.687 0.006 . . . . . . . 10 U H6 . 54037 1 83 . 1 . 1 10 10 U C5 C 13 104.324 0.090 . . . . . . . 10 U C5 . 54037 1 84 . 1 . 1 10 10 U C6 C 13 141.421 0.032 . . . . . . . 10 U C6 . 54037 1 85 . 1 . 1 11 11 U H5 H 1 5.678 0.014 . . . . . . . 11 U H5 . 54037 1 86 . 1 . 1 11 11 U H6 H 1 7.817 0.012 . . . . . . . 11 U H6 . 54037 1 87 . 1 . 1 11 11 U C5 C 13 104.509 0.082 . . . . . . . 11 U C5 . 54037 1 88 . 1 . 1 11 11 U C6 C 13 142.413 0.123 . . . . . . . 11 U C6 . 54037 1 89 . 1 . 1 12 12 U H1' H 1 5.422 0.157 . . . . . . . 12 U H1' . 54037 1 90 . 1 . 1 12 12 U H2' H 1 4.554 0.003 . . . . . . . 12 U H2' . 54037 1 91 . 1 . 1 12 12 U H3' H 1 4.397 0.009 . . . . . . . 12 U H3' . 54037 1 92 . 1 . 1 12 12 U H5 H 1 5.840 0.005 . . . . . . . 12 U H5 . 54037 1 93 . 1 . 1 12 12 U H6 H 1 7.774 0.006 . . . . . . . 12 U H6 . 54037 1 94 . 1 . 1 12 12 U C1' C 13 93.636 . . . . . . . . 12 U C1' . 54037 1 95 . 1 . 1 12 12 U C5 C 13 105.316 0.051 . . . . . . . 12 U C5 . 54037 1 96 . 1 . 1 12 12 U C6 C 13 143.708 0.073 . . . . . . . 12 U C6 . 54037 1 97 . 1 . 1 13 13 A H1' H 1 5.896 0.007 . . . . . . . 13 A H1' . 54037 1 98 . 1 . 1 13 13 A H2 H 1 7.989 0.015 . . . . . . . 13 A H2 . 54037 1 99 . 1 . 1 13 13 A H2' H 1 4.482 0.007 . . . . . . . 13 A H2' . 54037 1 100 . 1 . 1 13 13 A H3' H 1 4.708 0.005 . . . . . . . 13 A H3' . 54037 1 101 . 1 . 1 13 13 A H4' H 1 4.167 . . . . . . . . 13 A H4' . 54037 1 102 . 1 . 1 13 13 A H5' H 1 4.042 0.005 . . . . . . . 13 A H5' . 54037 1 103 . 1 . 1 13 13 A H5'' H 1 4.004 0.002 . . . . . . . 13 A H5'' . 54037 1 104 . 1 . 1 13 13 A H8 H 1 8.278 0.009 . . . . . . . 13 A H8 . 54037 1 105 . 1 . 1 13 13 A H61 H 1 6.563 0.002 . . . . . . . 13 A H61 . 54037 1 106 . 1 . 1 13 13 A H62 H 1 6.718 0.010 . . . . . . . 13 A H62 . 54037 1 107 . 1 . 1 13 13 A C1' C 13 90.111 0.069 . . . . . . . 13 A C1' . 54037 1 108 . 1 . 1 13 13 A C2 C 13 155.149 0.140 . . . . . . . 13 A C2 . 54037 1 109 . 1 . 1 13 13 A C8 C 13 141.762 0.155 . . . . . . . 13 A C8 . 54037 1 110 . 1 . 1 14 14 U H1' H 1 5.622 0.006 . . . . . . . 14 U H1' . 54037 1 111 . 1 . 1 14 14 U H2' H 1 4.299 0.008 . . . . . . . 14 U H2' . 54037 1 112 . 1 . 1 14 14 U H3' H 1 4.496 0.004 . . . . . . . 14 U H3' . 54037 1 113 . 1 . 1 14 14 U H4' H 1 4.163 0.006 . . . . . . . 14 U H4' . 54037 1 114 . 1 . 1 14 14 U H5 H 1 5.725 0.006 . . . . . . . 14 U H5 . 54037 1 115 . 1 . 1 14 14 U H5' H 1 4.008 0.016 . . . . . . . 14 U H5' . 54037 1 116 . 1 . 1 14 14 U H6 H 1 7.731 0.010 . . . . . . . 14 U H6 . 54037 1 117 . 1 . 1 14 14 U C1' C 13 92.505 0.154 . . . . . . . 14 U C1' . 54037 1 118 . 1 . 1 14 14 U C5 C 13 105.193 0.019 . . . . . . . 14 U C5 . 54037 1 119 . 1 . 1 14 14 U C6 C 13 142.776 0.135 . . . . . . . 14 U C6 . 54037 1 120 . 1 . 1 15 15 U H1' H 1 5.780 0.005 . . . . . . . 15 U H1' . 54037 1 121 . 1 . 1 15 15 U H2' H 1 4.328 0.007 . . . . . . . 15 U H2' . 54037 1 122 . 1 . 1 15 15 U H3' H 1 4.572 0.003 . . . . . . . 15 U H3' . 54037 1 123 . 1 . 1 15 15 U H4' H 1 4.139 0.012 . . . . . . . 15 U H4' . 54037 1 124 . 1 . 1 15 15 U H5 H 1 5.718 0.005 . . . . . . . 15 U H5 . 54037 1 125 . 1 . 1 15 15 U H5' H 1 4.049 0.008 . . . . . . . 15 U H5' . 54037 1 126 . 1 . 1 15 15 U H6 H 1 7.612 0.009 . . . . . . . 15 U H6 . 54037 1 127 . 1 . 1 15 15 U C1' C 13 90.576 0.051 . . . . . . . 15 U C1' . 54037 1 128 . 1 . 1 15 15 U C5 C 13 105.230 0.070 . . . . . . . 15 U C5 . 54037 1 129 . 1 . 1 15 15 U C6 C 13 143.737 0.048 . . . . . . . 15 U C6 . 54037 1 130 . 1 . 1 16 16 U H1' H 1 5.776 0.007 . . . . . . . 16 U H1' . 54037 1 131 . 1 . 1 16 16 U H2' H 1 4.565 0.007 . . . . . . . 16 U H2' . 54037 1 132 . 1 . 1 16 16 U H3' H 1 4.298 0.006 . . . . . . . 16 U H3' . 54037 1 133 . 1 . 1 16 16 U H5 H 1 5.660 0.004 . . . . . . . 16 U H5 . 54037 1 134 . 1 . 1 16 16 U H5' H 1 4.035 0.002 . . . . . . . 16 U H5' . 54037 1 135 . 1 . 1 16 16 U H6 H 1 7.654 0.009 . . . . . . . 16 U H6 . 54037 1 136 . 1 . 1 16 16 U C1' C 13 90.562 0.075 . . . . . . . 16 U C1' . 54037 1 137 . 1 . 1 16 16 U C5 C 13 105.026 0.157 . . . . . . . 16 U C5 . 54037 1 138 . 1 . 1 16 16 U C6 C 13 143.570 0.030 . . . . . . . 16 U C6 . 54037 1 139 . 1 . 1 17 17 A H1' H 1 5.954 0.004 . . . . . . . 17 A H1' . 54037 1 140 . 1 . 1 17 17 A H2 H 1 7.867 0.008 . . . . . . . 17 A H2 . 54037 1 141 . 1 . 1 17 17 A H2' H 1 4.761 0.010 . . . . . . . 17 A H2' . 54037 1 142 . 1 . 1 17 17 A H3' H 1 4.531 0.013 . . . . . . . 17 A H3' . 54037 1 143 . 1 . 1 17 17 A H4' H 1 4.343 0.004 . . . . . . . 17 A H4' . 54037 1 144 . 1 . 1 17 17 A H5' H 1 4.140 0.008 . . . . . . . 17 A H5' . 54037 1 145 . 1 . 1 17 17 A H5'' H 1 4.059 0.006 . . . . . . . 17 A H5'' . 54037 1 146 . 1 . 1 17 17 A H8 H 1 8.257 0.005 . . . . . . . 17 A H8 . 54037 1 147 . 1 . 1 17 17 A C1' C 13 92.255 0.174 . . . . . . . 17 A C1' . 54037 1 148 . 1 . 1 17 17 A C2 C 13 154.216 0.096 . . . . . . . 17 A C2 . 54037 1 149 . 1 . 1 17 17 A C8 C 13 141.483 0.079 . . . . . . . 17 A C8 . 54037 1 150 . 1 . 1 18 18 U H1' H 1 5.398 0.006 . . . . . . . 18 U H1' . 54037 1 151 . 1 . 1 18 18 U H2' H 1 4.333 0.005 . . . . . . . 18 U H2' . 54037 1 152 . 1 . 1 18 18 U H3' H 1 4.486 0.005 . . . . . . . 18 U H3' . 54037 1 153 . 1 . 1 18 18 U H4' H 1 4.228 0.005 . . . . . . . 18 U H4' . 54037 1 154 . 1 . 1 18 18 U H5 H 1 5.403 0.008 . . . . . . . 18 U H5 . 54037 1 155 . 1 . 1 18 18 U H5' H 1 4.060 . . . . . . . . 18 U H5' . 54037 1 156 . 1 . 1 18 18 U H5'' H 1 4.001 0.002 . . . . . . . 18 U H5'' . 54037 1 157 . 1 . 1 18 18 U H6 H 1 7.510 0.011 . . . . . . . 18 U H6 . 54037 1 158 . 1 . 1 18 18 U C1' C 13 93.907 0.035 . . . . . . . 18 U C1' . 54037 1 159 . 1 . 1 18 18 U C5 C 13 104.064 0.046 . . . . . . . 18 U C5 . 54037 1 160 . 1 . 1 18 18 U C6 C 13 141.853 0.174 . . . . . . . 18 U C6 . 54037 1 161 . 1 . 1 19 19 G H1 H 1 13.376 0.026 . . . . . . . 19 G H1 . 54037 1 162 . 1 . 1 19 19 G H2' H 1 4.650 . . . . . . . . 19 G H2' . 54037 1 163 . 1 . 1 19 19 G H3' H 1 4.492 . . . . . . . . 19 G H3' . 54037 1 164 . 1 . 1 19 19 G H4' H 1 4.322 . . . . . . . . 19 G H4' . 54037 1 165 . 1 . 1 19 19 G H5' H 1 4.056 . . . . . . . . 19 G H5' . 54037 1 166 . 1 . 1 19 19 G H5'' H 1 3.984 . . . . . . . . 19 G H5'' . 54037 1 167 . 1 . 1 19 19 G H8 H 1 7.787 0.023 . . . . . . . 19 G H8 . 54037 1 168 . 1 . 1 19 19 G C8 C 13 137.707 0.043 . . . . . . . 19 G C8 . 54037 1 169 . 1 . 1 19 19 G N1 N 15 148.433 . . . . . . . . 19 G N1 . 54037 1 170 . 1 . 1 20 20 U H1' H 1 5.793 0.005 . . . . . . . 20 U H1' . 54037 1 171 . 1 . 1 20 20 U H3' H 1 4.353 0.001 . . . . . . . 20 U H3' . 54037 1 172 . 1 . 1 20 20 U H5 H 1 5.471 0.007 . . . . . . . 20 U H5 . 54037 1 173 . 1 . 1 20 20 U H6 H 1 7.820 0.014 . . . . . . . 20 U H6 . 54037 1 174 . 1 . 1 20 20 U C6 C 13 143.127 0.005 . . . . . . . 20 U C6 . 54037 1 175 . 1 . 1 21 21 U H5 H 1 5.468 0.007 . . . . . . . 21 U H5 . 54037 1 176 . 1 . 1 21 21 U H6 H 1 7.821 0.013 . . . . . . . 21 U H6 . 54037 1 177 . 1 . 1 21 21 U C6 C 13 143.127 0.005 . . . . . . . 21 U C6 . 54037 1 178 . 1 . 1 22 22 G H1 H 1 12.001 0.011 . . . . . . . 22 G H1 . 54037 1 179 . 1 . 1 22 22 G H1' H 1 5.918 0.008 . . . . . . . 22 G H1' . 54037 1 180 . 1 . 1 22 22 G H2' H 1 4.489 0.002 . . . . . . . 22 G H2' . 54037 1 181 . 1 . 1 22 22 G H8 H 1 7.961 0.009 . . . . . . . 22 G H8 . 54037 1 182 . 1 . 1 22 22 G H21 H 1 6.855 0.004 . . . . . . . 22 G H21 . 54037 1 183 . 1 . 1 22 22 G C8 C 13 138.076 0.064 . . . . . . . 22 G C8 . 54037 1 184 . 1 . 1 22 22 G N1 N 15 146.164 0.063 . . . . . . . 22 G N1 . 54037 1 185 . 1 . 1 23 23 A H1' H 1 5.674 0.007 . . . . . . . 23 A H1' . 54037 1 186 . 1 . 1 23 23 A H2 H 1 7.199 0.007 . . . . . . . 23 A H2 . 54037 1 187 . 1 . 1 23 23 A H2' H 1 4.677 0.003 . . . . . . . 23 A H2' . 54037 1 188 . 1 . 1 23 23 A H8 H 1 7.881 0.012 . . . . . . . 23 A H8 . 54037 1 189 . 1 . 1 23 23 A C1' C 13 93.652 0.052 . . . . . . . 23 A C1' . 54037 1 190 . 1 . 1 23 23 A C2 C 13 153.032 0.075 . . . . . . . 23 A C2 . 54037 1 191 . 1 . 1 23 23 A C8 C 13 139.876 0.067 . . . . . . . 23 A C8 . 54037 1 192 . 1 . 1 24 24 A H1' H 1 5.924 0.006 . . . . . . . 24 A H1' . 54037 1 193 . 1 . 1 24 24 A H2 H 1 7.812 0.017 . . . . . . . 24 A H2 . 54037 1 194 . 1 . 1 24 24 A H2' H 1 4.396 . . . . . . . . 24 A H2' . 54037 1 195 . 1 . 1 24 24 A H5' H 1 3.764 0.007 . . . . . . . 24 A H5' . 54037 1 196 . 1 . 1 24 24 A H5'' H 1 3.861 0.004 . . . . . . . 24 A H5'' . 54037 1 197 . 1 . 1 24 24 A H8 H 1 7.828 0.015 . . . . . . . 24 A H8 . 54037 1 198 . 1 . 1 24 24 A H61 H 1 7.041 0.008 . . . . . . . 24 A H61 . 54037 1 199 . 1 . 1 24 24 A C1' C 13 92.887 0.008 . . . . . . . 24 A C1' . 54037 1 200 . 1 . 1 24 24 A C2 C 13 154.083 0.073 . . . . . . . 24 A C2 . 54037 1 201 . 1 . 1 24 24 A C8 C 13 139.265 0.119 . . . . . . . 24 A C8 . 54037 1 202 . 1 . 1 25 25 U H1' H 1 5.466 0.008 . . . . . . . 25 U H1' . 54037 1 203 . 1 . 1 25 25 U H2' H 1 4.586 0.003 . . . . . . . 25 U H2' . 54037 1 204 . 1 . 1 25 25 U H3 H 1 13.742 0.023 . . . . . . . 25 U H3 . 54037 1 205 . 1 . 1 25 25 U H3' H 1 4.370 0.005 . . . . . . . 25 U H3' . 54037 1 206 . 1 . 1 25 25 U H4' H 1 4.233 0.001 . . . . . . . 25 U H4' . 54037 1 207 . 1 . 1 25 25 U H5 H 1 5.167 0.020 . . . . . . . 25 U H5 . 54037 1 208 . 1 . 1 25 25 U H5' H 1 4.084 . . . . . . . . 25 U H5' . 54037 1 209 . 1 . 1 25 25 U H6 H 1 7.475 0.009 . . . . . . . 25 U H6 . 54037 1 210 . 1 . 1 25 25 U C1' C 13 93.791 0.043 . . . . . . . 25 U C1' . 54037 1 211 . 1 . 1 25 25 U C5 C 13 103.134 0.086 . . . . . . . 25 U C5 . 54037 1 212 . 1 . 1 25 25 U C6 C 13 141.264 0.049 . . . . . . . 25 U C6 . 54037 1 213 . 1 . 1 25 25 U N3 N 15 162.597 . . . . . . . . 25 U N3 . 54037 1 214 . 1 . 1 26 26 C H1' H 1 5.598 0.008 . . . . . . . 26 C H1' . 54037 1 215 . 1 . 1 26 26 C H2' H 1 4.473 0.007 . . . . . . . 26 C H2' . 54037 1 216 . 1 . 1 26 26 C H3' H 1 4.101 0.004 . . . . . . . 26 C H3' . 54037 1 217 . 1 . 1 26 26 C H5 H 1 5.573 0.012 . . . . . . . 26 C H5 . 54037 1 218 . 1 . 1 26 26 C H5' H 1 3.965 0.006 . . . . . . . 26 C H5' . 54037 1 219 . 1 . 1 26 26 C H6 H 1 7.638 0.006 . . . . . . . 26 C H6 . 54037 1 220 . 1 . 1 26 26 C H41 H 1 7.110 0.012 . . . . . . . 26 C H41 . 54037 1 221 . 1 . 1 26 26 C H42 H 1 6.693 0.001 . . . . . . . 26 C H42 . 54037 1 222 . 1 . 1 26 26 C C1' C 13 92.994 0.013 . . . . . . . 26 C C1' . 54037 1 223 . 1 . 1 26 26 C C5 C 13 98.341 0.051 . . . . . . . 26 C C5 . 54037 1 224 . 1 . 1 26 26 C C6 C 13 141.710 0.149 . . . . . . . 26 C C6 . 54037 1 225 . 1 . 1 26 26 C N3 N 15 197.589 . . . . . . . . 26 C N3 . 54037 1 226 . 1 . 1 27 27 C H2' H 1 4.464 . . . . . . . . 27 C H2' . 54037 1 227 . 1 . 1 27 27 C H3' H 1 4.226 0.008 . . . . . . . 27 C H3' . 54037 1 228 . 1 . 1 27 27 C H4' H 1 4.361 0.003 . . . . . . . 27 C H4' . 54037 1 229 . 1 . 1 27 27 C H5 H 1 5.703 0.008 . . . . . . . 27 C H5 . 54037 1 230 . 1 . 1 27 27 C H5' H 1 4.013 0.001 . . . . . . . 27 C H5' . 54037 1 231 . 1 . 1 27 27 C H6 H 1 7.891 0.007 . . . . . . . 27 C H6 . 54037 1 232 . 1 . 1 27 27 C H41 H 1 7.143 0.017 . . . . . . . 27 C H41 . 54037 1 233 . 1 . 1 27 27 C C5 C 13 97.750 0.061 . . . . . . . 27 C C5 . 54037 1 234 . 1 . 1 27 27 C C6 C 13 141.782 0.074 . . . . . . . 27 C C6 . 54037 1 235 . 1 . 1 27 27 C N3 N 15 197.263 . . . . . . . . 27 C N3 . 54037 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronucl_NOEs_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronucl_NOEs_1 _Heteronucl_NOE_list.Entry_ID 54037 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name mir.peaks3 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak integral' _Heteronucl_NOE_list.NOE_ref_val 4.7 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format text _Heteronucl_NOE_list.Text_data ; # Number of dimensions 2 #INAME 1 H #INAME 2 h 1 5.952 8.255 1 T 2.123e+08 0.00e+00 a 0 529 545 0 2 5.923 7.199 1 T 2.746e+08 0.00e+00 a 0 757 729 0 3 5.919 7.829 1 T 1.575e+08 0.00e+00 a 0 0 0 0 4 5.894 8.279 1 T 2.396e+08 0.00e+00 a 0 405 421 0 5 5.840 7.773 1 T 5.543e+08 0.00e+00 a 0 385 387 0 6 5.784 7.973 1 T 1.550e+08 0.00e+00 a 0 0 0 0 7 5.725 7.732 1 T 3.015e+08 0.00e+00 a 0 449 451 0 8 5.663 7.660 1 T 4.120e+08 0.00e+00 a 0 509 511 0 9 5.628 7.864 1 T 2.769e+08 0.00e+00 a 0 439 535 0 10 5.578 7.459 1 T 1.674e+08 0.00e+00 a 0 248 265 0 11 5.574 7.199 1 T 1.750e+08 0.00e+00 a 0 216 729 0 12 5.569 7.641 1 T 2.247e+08 0.00e+00 a 0 833 835 0 13 5.513 7.687 1 T 1.464e+08 0.00e+00 a 0 325 327 0 14 5.487 7.978 1 T 1.982e+08 0.00e+00 a 0 0 0 0 15 5.473 7.898 1 T 4.291e+08 0.00e+00 a 0 0 0 0 16 5.466 7.819 1 T 2.964e+08 0.00e+00 a 0 0 0 0 17 5.400 7.511 1 T 1.856e+08 0.00e+00 a 0 0 0 0 18 5.361 7.864 1 T 1.954e+08 0.00e+00 a 0 375 535 0 19 5.253 7.509 1 T 1.306e+08 0.00e+00 a 0 295 297 0 20 5.162 7.477 1 T 1.403e+08 0.00e+00 a 0 801 803 0 21 5.395 7.686 1 T 5.096e+07 0.00e+00 a 0 0 0 0 22 5.465 7.639 1 T 5.571e+07 0.00e+00 a 0 791 835 0 23 5.481 7.562 1 T 6.858e+07 0.00e+00 a 0 0 0 0 24 5.584 7.509 1 T 4.463e+07 0.00e+00 a 0 0 0 0 25 5.623 7.730 1 T 8.236e+07 0.00e+00 a 0 439 451 0 26 5.696 7.889 1 T 1.083e+08 0.00e+00 a 0 865 867 0 27 5.787 7.827 1 T 7.670e+07 0.00e+00 a 0 0 670 0 28 5.823 7.563 1 T 4.994e+07 0.00e+00 a 0 122 168 0 29 5.924 7.476 1 T 4.725e+07 0.00e+00 a 0 757 803 0 30 5.920 7.991 1 T 7.211e+07 0.00e+00 a 0 0 0 0 31 5.842 8.254 1 T 7.208e+07 0.00e+00 a 0 385 545 0 32 5.402 8.255 1 T 5.247e+07 0.00e+00 a 0 0 0 0 33 5.162 7.830 1 T 3.141e+07 0.00e+00 a 0 801 773 0 34 5.698 7.476 1 T 3.409e+07 0.00e+00 a 0 865 803 0 35 5.952 7.509 1 T 2.759e+07 0.00e+00 a 0 529 575 0 36 5.460 7.476 1 T 4.749e+07 0.00e+00 a 0 791 803 0 37 5.254 7.458 1 T 3.886e+07 0.00e+00 a 0 295 265 0 38 5.776 8.255 1 T 4.402e+07 0.00e+00 a 0 499 545 0 39 5.161 5.698 1 T 4.681e+07 0.00e+00 a 0 801 865 0 40 5.626 8.276 1 T 5.561e+07 0.00e+00 a 0 439 421 0 41 5.924 7.892 1 T 5.716e+07 0.00e+00 a 0 0 0 0 42 5.632 7.801 1 T 1.618e+08 0.00e+00 a 0 228 230 0 43 5.895 7.862 1 T 5.328e+07 0.00e+00 a 0 405 535 0 44 5.658 8.279 1 T 4.205e+07 0.00e+00 a 0 509 421 0 45 5.952 7.861 1 T 2.341e+07 0.00e+00 a 0 529 535 0 46 5.578 7.757 1 T 9.151e+06 0.00e+00 a 0 248 610 0 47 5.785 7.609 1 T 7.759e+07 0.00e+00 a 0 469 481 0 48 5.693 7.687 1 T 4.461e+07 0.00e+00 a 0 0 327 0 49 5.545 7.688 1 T 4.221e+07 0.00e+00 a 0 0 327 0 50 5.783 7.884 1 T 1.006e+08 0.00e+00 a 0 186 739 0 51 5.919 7.960 1 T 4.170e+07 0.00e+00 a 0 688 705 0 52 5.457 7.959 1 T 3.134e+07 0.00e+00 a 0 668 705 0 53 5.358 7.785 1 T 2.689e+07 0.00e+00 a 0 375 387 0 54 4.999 7.563 1 T 1.709e+08 0.00e+00 a 0 166 168 0 55 5.952 7.610 1 T 1.689e+07 0.00e+00 a 0 529 481 0 56 5.892 7.657 1 T 1.739e+07 0.00e+00 a 0 405 511 0 57 5.827 7.992 1 T 9.550e+07 0.00e+00 a 0 0 0 0 58 5.824 7.902 1 T 2.308e+07 0.00e+00 a 0 122 128 0 59 5.780 7.659 1 T 1.357e+08 0.00e+00 a 0 0 0 0 60 5.713 7.611 1 T 3.249e+08 0.00e+00 a 0 479 481 0 61 5.689 7.828 1 T 1.505e+08 0.00e+00 a 0 355 357 0 62 5.664 7.982 1 T 5.674e+07 0.00e+00 a 0 0 0 0 63 5.677 7.800 1 T 2.232e+08 0.00e+00 a 0 723 230 0 64 5.908 7.881 1 T 6.620e+07 0.00e+00 a 0 688 739 0 66 7.573 8.002 1 T 2.730e+07 0.00e+00 a 0 168 138 0 67 7.535 8.247 1 T 1.330e+07 0.00e+00 a 0 575 545 0 68 5.584 7.826 1 T 5.140e+07 0.00e+00 a 0 0 0 0 69 7.737 8.277 1 T 3.093e+07 0.00e+00 a 0 451 421 0 70 6.009 8.154 1 T 3.818e+06 0.00e+00 a 0 18 35 0 72 5.594 7.638 1 T 1.099e+08 0.00e+00 a 0 0 0 0 73 5.602 7.471 1 T 5.476e+07 0.00e+00 a 0 821 803 0 74 4.787 5.786 1 T 3.620e+08 0.00e+00 a 0 182 186 0 75 4.754 5.952 1 T 3.422e+08 0.00e+00 a 0 525 529 0 76 4.709 5.896 1 T 2.709e+08 0.00e+00 a 0 399 405 0 77 4.754 7.512 1 T 7.397e+07 0.00e+00 a 0 525 575 0 78 4.786 7.886 1 T 1.683e+08 0.00e+00 a 0 182 739 0 79 4.787 7.961 1 T 9.734e+07 0.00e+00 a 0 0 0 0 80 4.756 8.255 1 T 2.144e+08 0.00e+00 a 0 525 545 0 81 4.706 8.278 1 T 4.816e+08 0.00e+00 a 0 399 421 0 82 4.642 8.278 1 T 1.214e+08 0.00e+00 a 0 0 421 0 83 7.194 7.813 1 T 5.306e+07 0.00e+00 a 0 0 0 0 84 4.585 7.461 1 T 2.724e+08 0.00e+00 a 0 244 265 0 85 4.033 7.462 1 T 8.118e+07 0.00e+00 a 0 236 265 0 86 4.429 5.580 1 T 2.904e+08 0.00e+00 a 0 242 248 0 87 4.586 5.576 1 T 1.898e+08 0.00e+00 a 0 244 248 0 88 4.421 7.461 1 T 2.655e+08 0.00e+00 a 0 242 265 0 89 4.469 7.642 1 T 1.089e+08 0.00e+00 a 0 817 835 0 90 4.101 7.642 1 T 1.686e+08 0.00e+00 a 0 815 835 0 91 3.963 7.641 1 T 9.456e+07 0.00e+00 a 0 809 835 0 92 4.472 5.579 1 T 2.611e+08 0.00e+00 a 0 0 0 0 93 3.962 5.603 1 T 2.407e+08 0.00e+00 a 0 0 0 0 94 3.761 7.838 1 T 5.067e+07 0.00e+00 a 0 745 773 0 95 3.855 7.838 1 T 4.114e+07 0.00e+00 a 0 746 773 0 96 4.484 7.510 1 T 2.205e+08 0.00e+00 a 0 557 575 0 97 4.327 7.509 1 T 1.619e+08 0.00e+00 a 0 559 575 0 98 4.334 5.396 1 T 9.390e+07 0.00e+00 a 0 559 563 0 99 4.490 5.399 1 T 3.853e+07 0.00e+00 a 0 557 563 0 100 4.220 5.396 1 T 9.373e+07 0.00e+00 a 0 555 563 0 101 4.305 7.457 1 T 7.255e+07 0.00e+00 a 0 240 265 0 102 4.675 5.780 1 T 2.542e+08 0.00e+00 a 0 0 0 0 103 4.706 7.658 1 T 4.928e+07 0.00e+00 a 0 399 511 0 104 4.653 7.658 1 T 4.524e+07 0.00e+00 a 0 0 511 0 105 4.709 5.661 1 T 2.622e+07 0.00e+00 a 0 0 509 0 106 4.650 5.661 1 T 4.487e+07 0.00e+00 a 0 0 509 0 107 4.388 5.842 1 T 2.801e+08 0.00e+00 a 0 369 385 0 108 4.394 7.777 1 T 3.381e+08 0.00e+00 a 0 369 387 0 109 4.670 7.961 1 T 2.612e+08 0.00e+00 a 0 180 198 0 110 4.590 7.834 1 T 1.436e+08 0.00e+00 a 0 0 0 0 111 4.493 7.731 1 T 2.349e+08 0.00e+00 a 0 433 451 0 112 4.294 7.731 1 T 1.442e+08 0.00e+00 a 0 435 451 0 113 4.158 7.730 1 T 1.847e+08 0.00e+00 a 0 431 451 0 114 4.008 7.731 1 T 4.930e+07 0.00e+00 a 0 427 451 0 115 4.488 8.276 1 T 1.862e+08 0.00e+00 a 0 401 421 0 116 4.643 5.897 1 T 9.917e+07 0.00e+00 a 0 0 405 0 117 4.479 5.893 1 T 2.022e+08 0.00e+00 a 0 401 405 0 118 4.041 8.279 1 T 7.600e+07 0.00e+00 a 0 393 421 0 119 4.038 5.896 1 T 8.533e+07 0.00e+00 a 0 393 405 0 120 4.220 7.688 1 T 1.540e+08 0.00e+00 a 0 309 327 0 121 4.040 7.666 1 T 4.815e+07 0.00e+00 a 0 303 327 0 122 4.109 7.563 1 T 4.257e+07 0.00e+00 a 0 144 168 0 123 4.558 5.842 1 T 1.331e+08 0.00e+00 a 0 371 385 0 124 4.553 7.771 1 T 1.576e+08 0.00e+00 a 0 371 387 0 125 4.376 5.790 1 T 2.820e+08 0.00e+00 a 0 178 186 0 126 4.372 7.966 1 T 2.624e+08 0.00e+00 a 0 178 198 0 127 4.200 7.961 1 T 7.893e+07 0.00e+00 a 0 174 198 0 128 4.571 5.778 1 T 2.099e+08 0.00e+00 a 0 463 469 0 129 4.285 7.659 1 T 3.343e+08 0.00e+00 a 0 493 511 0 130 4.562 7.659 1 T 1.652e+08 0.00e+00 a 0 495 511 0 131 4.322 7.611 1 T 3.138e+08 0.00e+00 a 0 465 481 0 132 4.571 7.610 1 T 1.697e+08 0.00e+00 a 0 463 481 0 133 4.048 7.610 1 T 4.176e+07 0.00e+00 a 0 457 481 0 134 4.043 5.778 1 T 1.102e+08 0.00e+00 a 0 457 469 0 135 4.323 5.779 1 T 3.094e+08 0.00e+00 a 0 465 469 0 136 4.133 5.778 1 T 1.269e+08 0.00e+00 a 0 461 469 0 137 4.543 8.253 1 T 1.982e+08 0.00e+00 a 0 523 545 0 138 4.511 5.952 1 T 2.612e+08 0.00e+00 a 0 523 529 0 139 4.140 8.255 1 T 1.320e+08 0.00e+00 a 0 517 545 0 140 4.137 5.952 1 T 1.141e+08 0.00e+00 a 0 517 529 0 141 4.222 7.890 1 T 1.458e+08 0.00e+00 a 0 847 867 0 142 4.230 5.695 1 T 1.065e+08 0.00e+00 a 0 847 865 0 143 4.332 7.829 1 T 7.002e+07 0.00e+00 a 0 559 610 0 144 4.595 5.827 1 T 1.216e+08 0.00e+00 a 0 116 122 0 145 4.590 7.995 1 T 1.338e+08 0.00e+00 a 0 116 138 0 146 4.490 7.997 1 T 2.147e+08 0.00e+00 a 0 118 138 0 147 4.483 5.825 1 T 1.457e+08 0.00e+00 a 0 118 122 0 148 4.379 7.563 1 T 9.594e+07 0.00e+00 a 0 150 168 0 149 4.426 7.565 1 T 7.309e+07 0.00e+00 a 0 0 0 0 150 4.377 5.481 1 T 2.254e+08 0.00e+00 a 0 0 0 0 151 4.538 7.561 1 T 5.703e+07 0.00e+00 a 0 152 168 0 152 4.401 8.252 1 T 8.611e+07 0.00e+00 a 0 369 545 0 153 4.155 5.631 1 T 2.008e+08 0.00e+00 a 0 431 439 0 154 4.292 5.616 1 T 2.192e+08 0.00e+00 a 0 435 439 0 155 4.464 7.892 1 T 8.213e+07 0.00e+00 a 0 0 0 0 156 4.344 8.254 1 T 1.363e+08 0.00e+00 a 0 521 545 0 157 4.344 5.954 1 T 1.196e+08 0.00e+00 a 0 521 529 0 158 4.052 5.952 1 T 5.990e+07 0.00e+00 a 0 518 529 0 159 4.004 5.898 1 T 2.621e+07 0.00e+00 a 0 394 405 0 160 4.010 8.280 1 T 5.140e+07 0.00e+00 a 0 394 421 0 162 5.775 7.868 1 T 3.786e+07 0.00e+00 a 0 499 535 0 163 5.906 7.739 1 T 1.783e+07 0.00e+00 a 0 405 451 0 164 4.167 8.279 1 T 1.554e+08 0.00e+00 a 0 0 0 0 165 4.680 7.886 1 T 1.700e+08 0.00e+00 a 0 719 739 0 166 4.302 5.779 1 T 2.804e+08 0.00e+00 a 0 0 0 0 167 4.098 5.604 1 T 1.350e+08 0.00e+00 a 0 815 821 0 168 4.216 5.467 1 T 1.311e+08 0.00e+00 a 0 0 0 0 169 4.215 5.585 1 T 2.612e+08 0.00e+00 a 0 0 248 0 170 4.350 5.469 1 T 1.275e+08 0.00e+00 a 0 0 0 0 171 4.353 5.791 1 T 2.910e+08 0.00e+00 a 0 622 628 0 172 4.354 7.823 1 T 2.074e+08 0.00e+00 a 0 0 0 0 173 4.477 5.629 1 T 1.917e+08 0.00e+00 a 0 401 439 0 174 4.487 5.722 1 T 1.008e+08 0.00e+00 a 0 0 0 0 175 4.303 5.722 1 T 1.112e+08 0.00e+00 a 0 0 0 0 176 4.489 5.920 1 T 4.017e+08 0.00e+00 a 0 684 688 0 177 4.396 5.925 1 T 4.833e+08 0.00e+00 a 0 753 757 0 178 4.488 7.954 1 T 1.286e+08 0.00e+00 a 0 684 705 0 179 4.481 7.817 1 T 2.656e+08 0.00e+00 a 0 212 230 0 180 4.213 7.817 1 T 1.269e+08 0.00e+00 a 0 210 230 0 181 4.479 5.674 1 T 3.391e+08 0.00e+00 a 0 212 723 0 182 4.214 5.678 1 T 9.267e+07 0.00e+00 a 0 210 723 0 183 4.079 7.810 1 T 2.227e+07 0.00e+00 a 0 208 230 0 184 4.079 5.676 1 T 3.165e+07 0.00e+00 a 0 208 723 0 185 5.674 7.198 1 T 2.452e+07 0.00e+00 a 0 723 729 0 186 3.856 5.561 1 T 1.654e+07 0.00e+00 a 0 0 833 0 187 3.767 5.562 1 T 1.636e+07 0.00e+00 a 0 0 833 0 188 4.757 5.401 1 T 1.999e+07 0.00e+00 a 0 0 0 0 189 4.486 7.199 1 T 3.296e+07 0.00e+00 a 0 684 729 0 190 4.106 7.200 1 T 1.169e+07 0.00e+00 a 0 144 729 0 191 5.000 7.994 1 T 3.731e+07 0.00e+00 a 0 166 138 0 192 4.699 7.990 1 T 1.215e+08 0.00e+00 a 0 399 411 0 193 5.000 7.899 1 T 1.572e+07 0.00e+00 a 0 166 128 0 194 4.338 7.689 1 T 1.260e+08 0.00e+00 a 0 0 0 0 195 4.373 7.477 1 T 1.439e+08 0.00e+00 a 0 785 803 0 196 4.232 7.481 1 T 2.621e+07 0.00e+00 a 0 783 803 0 197 4.374 5.456 1 T 3.866e+07 0.00e+00 a 0 785 791 0 198 4.235 5.460 1 T 9.505e+07 0.00e+00 a 0 783 791 0 199 4.596 7.561 1 T 2.875e+07 0.00e+00 a 0 116 168 0 200 4.571 5.709 1 T 5.824e+07 0.00e+00 a 0 463 479 0 201 4.290 5.663 1 T 1.048e+08 0.00e+00 a 0 435 509 0 202 4.154 5.723 1 T 8.491e+07 0.00e+00 a 0 431 479 0 203 4.100 5.566 1 T 1.087e+08 0.00e+00 a 0 815 833 0 204 3.963 5.561 1 T 5.798e+07 0.00e+00 a 0 809 833 0 205 4.220 5.513 1 T 5.294e+07 0.00e+00 a 0 309 325 0 206 4.330 5.513 1 T 4.903e+07 0.00e+00 a 0 0 0 0 207 4.414 5.511 1 T 3.572e+07 0.00e+00 a 0 311 325 0 208 4.416 7.688 1 T 9.756e+07 0.00e+00 a 0 311 327 0 209 4.011 5.397 1 T 1.204e+07 0.00e+00 a 0 303 563 0 210 4.556 5.656 1 T 3.696e+07 0.00e+00 a 0 371 509 0 211 4.158 5.895 1 T 3.711e+07 0.00e+00 a 0 517 405 0 212 4.303 7.864 1 T 7.221e+07 0.00e+00 a 0 435 535 0 213 4.533 7.890 1 T 1.285e+08 0.00e+00 a 0 152 128 0 214 4.061 7.510 1 T 2.533e+07 0.00e+00 a 0 551 575 0 215 3.999 7.507 1 T 3.355e+07 0.00e+00 a 0 552 575 0 216 4.131 7.609 1 T 4.555e+07 0.00e+00 a 0 461 481 0 217 4.298 8.278 1 T 5.706e+07 0.00e+00 a 0 435 421 0 218 4.084 5.473 1 T 3.509e+07 0.00e+00 a 0 779 791 0 219 5.161 5.923 1 T 3.832e+07 0.00e+00 a 0 801 757 0 220 4.999 5.823 1 T 6.627e+07 0.00e+00 a 0 166 122 0 221 5.000 5.484 1 T 4.118e+07 0.00e+00 a 0 0 0 0 222 5.250 5.514 1 T 2.953e+07 0.00e+00 a 0 295 325 0 223 5.251 5.583 1 T 3.182e+07 0.00e+00 a 0 295 248 0 224 5.459 5.696 1 T 4.657e+07 0.00e+00 a 0 791 865 0 225 5.479 5.821 1 T 4.016e+07 0.00e+00 a 0 156 122 0 226 5.462 5.926 1 T 2.084e+07 0.00e+00 a 0 791 757 0 227 5.397 5.951 1 T 3.275e+07 0.00e+00 a 0 563 529 0 230 5.159 5.458 1 T 1.072e+07 0.00e+00 a 0 801 791 0 231 5.576 5.918 1 T 1.170e+07 0.00e+00 a 0 216 688 0 233 4.359 7.895 1 T 6.382e+07 0.00e+00 a 0 845 867 0 234 4.589 7.474 1 T 1.311e+08 0.00e+00 a 0 787 803 0 235 4.037 5.666 1 T 4.238e+07 0.00e+00 a 0 487 509 0 236 4.033 5.709 1 T 3.382e+07 0.00e+00 a 0 0 0 0 237 4.404 5.657 1 T 5.153e+07 0.00e+00 a 0 0 0 0 238 4.138 7.990 1 T 8.916e+07 0.00e+00 a 0 110 138 0 239 4.416 7.998 1 T 4.760e+07 0.00e+00 a 0 114 138 0 240 4.325 5.585 1 T 1.451e+08 0.00e+00 a 0 277 283 0 241 5.511 7.507 1 T 9.605e+06 0.00e+00 a 0 0 0 0 242 4.474 7.510 1 T 2.080e+08 0.00e+00 a 0 279 297 0 243 4.314 7.510 1 T 1.450e+08 0.00e+00 a 0 277 297 0 244 4.321 5.253 1 T 8.922e+06 0.00e+00 a 0 277 295 0 245 4.481 5.254 1 T 7.975e+06 0.00e+00 a 0 279 295 0 246 4.485 5.583 1 T 2.234e+08 0.00e+00 a 0 279 283 0 247 5.252 7.688 1 T 8.261e+06 0.00e+00 a 0 295 327 0 248 5.160 7.893 1 T 9.517e+06 0.00e+00 a 0 801 867 0 249 4.014 7.896 1 T 1.481e+07 0.00e+00 a 0 841 867 0 250 5.590 7.690 1 T 3.384e+07 0.00e+00 a 0 283 327 0 251 5.784 7.954 1 T 1.240e+08 0.00e+00 a 0 0 705 0 252 5.162 4.373 1 T 3.959e+07 0.00e+00 a 0 801 785 0 253 5.490 5.678 1 T 3.654e+07 0.00e+00 a 0 0 0 0 302 12.000 13.727 1 T 1.083e+08 0.00e+00 a 0 699 192 0 303 10.481 13.357 1 T 3.841e+07 0.00e+00 a 0 259 604 0 304 10.491 12.003 1 T 2.761e+07 0.00e+00 a 0 259 699 0 305 10.483 10.484 1 T 3.412e+08 0.00e+00 a 0 259 259 0 306 12.545 12.543 1 T 7.925e+07 0.00e+00 a 0 64 64 0 307 11.999 12.000 1 T 5.872e+09 0.00e+00 a 0 699 699 0 308 13.356 13.357 1 T 1.018e+09 0.00e+00 a 0 604 604 0 309 13.727 13.727 1 T 1.871e+09 0.00e+00 a 0 0 0 0 311 8.284 13.357 1 T 4.714e+08 0.00e+00 a 0 292 604 0 312 8.196 12.002 1 T 1.390e+09 0.00e+00 a 0 225 699 0 313 7.895 13.726 1 T 2.129e+08 0.00e+00 a 0 128 797 0 314 7.856 12.000 1 T 1.154e+09 0.00e+00 a 0 739 699 0 315 7.815 13.946 1 T 1.477e+08 0.00e+00 a 0 0 0 0 316 7.790 13.728 1 T 5.817e+08 0.00e+00 a 0 0 0 0 318 7.454 12.001 1 T 2.395e+08 0.00e+00 a 0 265 699 0 320 7.194 13.727 1 T 1.155e+09 0.00e+00 a 0 729 192 0 321 7.194 12.000 1 T 3.723e+08 0.00e+00 a 0 729 699 0 322 7.000 13.359 1 T 2.464e+08 0.00e+00 a 0 291 604 0 323 6.850 12.002 1 T 1.139e+09 0.00e+00 a 0 224 699 0 324 6.834 13.728 1 T 1.469e+08 0.00e+00 a 0 224 192 0 325 5.919 13.727 1 T 1.158e+08 0.00e+00 a 0 0 0 0 326 5.924 13.357 1 T 5.538e+07 0.00e+00 a 0 0 604 0 327 5.942 12.000 1 T 1.116e+09 0.00e+00 a 0 688 699 0 328 5.792 13.356 1 T 1.870e+08 0.00e+00 a 0 628 604 0 329 5.618 13.728 1 T 1.888e+08 0.00e+00 a 0 228 192 0 330 5.585 12.000 1 T 1.329e+09 0.00e+00 a 0 0 0 0 331 5.594 13.359 1 T 2.249e+08 0.00e+00 a 0 248 604 0 332 5.557 12.545 1 T 9.348e+07 0.00e+00 a 0 833 64 0 333 5.467 13.728 1 T 1.085e+08 0.00e+00 a 0 0 0 0 334 5.246 13.358 1 T 1.163e+08 0.00e+00 a 0 295 604 0 335 5.963 7.628 1 T 2.815e+07 0.00e+00 a 0 529 481 0 336 5.918 7.466 1 T 2.544e+08 0.00e+00 a 0 757 803 0 338 5.920 7.198 1 T 4.789e+08 0.00e+00 a 0 757 729 0 339 5.927 7.810 1 T 7.596e+08 0.00e+00 a 0 757 773 0 340 5.934 7.995 1 T 3.548e+08 0.00e+00 a 0 0 0 0 343 5.837 7.765 1 T 1.952e+09 0.00e+00 a 0 385 387 0 344 5.835 7.563 1 T 2.467e+08 0.00e+00 a 0 122 168 0 345 5.826 7.994 1 T 4.232e+08 0.00e+00 a 0 122 138 0 347 5.778 7.958 1 T 8.018e+08 0.00e+00 a 0 0 0 0 350 5.721 7.720 1 T 1.443e+09 0.00e+00 a 0 449 451 0 351 5.700 7.883 1 T 9.987e+08 0.00e+00 a 0 865 867 0 352 5.716 7.611 1 T 1.109e+09 0.00e+00 a 0 479 481 0 353 5.699 7.468 1 T 1.288e+08 0.00e+00 a 0 865 803 0 354 5.703 7.806 1 T 1.580e+09 0.00e+00 a 0 355 357 0 355 5.672 7.964 1 T 1.955e+08 0.00e+00 a 0 0 0 0 356 5.665 7.659 1 T 1.150e+09 0.00e+00 a 0 509 511 0 357 5.627 8.198 1 T 4.199e+08 0.00e+00 a 0 228 225 0 358 5.617 7.870 1 T 5.766e+08 0.00e+00 a 0 439 535 0 359 5.618 7.721 1 T 2.434e+08 0.00e+00 a 0 439 451 0 360 5.580 7.453 1 T 4.952e+08 0.00e+00 a 0 248 265 0 361 5.573 7.639 1 T 1.123e+09 0.00e+00 a 0 833 835 0 363 5.504 7.679 1 T 1.005e+09 0.00e+00 a 0 325 327 0 364 5.482 7.961 1 T 1.773e+09 0.00e+00 a 0 0 0 0 365 5.493 7.562 1 T 3.439e+08 0.00e+00 a 0 0 0 0 366 5.467 7.896 1 T 1.256e+09 0.00e+00 a 0 0 0 0 367 5.465 7.472 1 T 6.789e+07 0.00e+00 a 0 791 803 0 368 5.462 7.636 1 T 1.041e+08 0.00e+00 a 0 791 835 0 369 5.398 7.685 1 T 6.218e+07 0.00e+00 a 0 0 0 0 370 5.412 7.523 1 T 9.881e+08 0.00e+00 a 0 0 0 0 371 5.368 7.872 1 T 6.146e+08 0.00e+00 a 0 375 535 0 372 5.353 7.774 1 T 1.349e+08 0.00e+00 a 0 375 387 0 373 5.247 7.497 1 T 7.804e+08 0.00e+00 a 0 295 297 0 374 5.248 6.955 1 T 2.626e+08 0.00e+00 a 0 295 291 0 375 5.134 7.813 1 T 1.917e+08 0.00e+00 a 0 801 773 0 376 5.134 7.467 1 T 1.109e+09 0.00e+00 a 0 801 803 0 377 5.420 8.256 1 T 2.592e+08 0.00e+00 a 0 0 0 0 378 5.790 8.254 1 T 2.975e+08 0.00e+00 a 0 499 545 0 379 5.908 8.279 1 T 8.920e+08 0.00e+00 a 0 405 421 0 380 5.956 8.261 1 T 8.134e+08 0.00e+00 a 0 529 545 0 382 5.620 8.285 1 T 2.866e+08 0.00e+00 a 0 439 421 0 383 5.663 8.285 1 T 2.938e+08 0.00e+00 a 0 509 421 0 384 5.250 7.429 1 T 2.470e+07 0.00e+00 a 0 295 265 0 385 5.964 7.524 1 T 6.152e+07 0.00e+00 a 0 529 575 0 386 5.624 7.790 1 T 2.849e+09 0.00e+00 a 0 228 230 0 387 5.677 7.800 1 T 3.041e+09 0.00e+00 a 0 723 230 0 388 5.907 7.986 1 T 4.807e+08 0.00e+00 a 0 688 705 0 389 5.787 7.612 1 T 6.427e+08 0.00e+00 a 0 469 481 0 390 5.479 7.819 1 T 1.894e+09 0.00e+00 a 0 0 0 0 391 5.922 7.877 1 T 3.251e+08 0.00e+00 a 0 0 0 0 392 5.249 8.286 1 T 4.529e+08 0.00e+00 a 0 295 292 0 393 7.565 7.995 1 T 1.361e+08 0.00e+00 a 0 168 138 0 394 7.500 8.263 1 T 1.738e+08 0.00e+00 a 0 575 545 0 396 7.571 7.908 1 T 3.100e+07 0.00e+00 a 0 168 128 0 397 7.715 8.280 1 T 2.122e+08 0.00e+00 a 0 451 421 0 398 7.778 8.261 1 T 1.038e+08 0.00e+00 a 0 387 545 0 399 7.451 7.803 1 T 1.695e+08 0.00e+00 a 0 803 763 0 400 7.655 8.283 1 T 1.163e+08 0.00e+00 a 0 511 421 0 401 7.574 8.257 1 T 1.503e+08 0.00e+00 a 0 481 545 0 402 7.114 12.545 1 T 1.483e+08 0.00e+00 a 0 861 64 0 403 5.982 8.140 1 T 1.333e+08 0.00e+00 a 0 18 35 0 405 5.594 7.638 1 T 1.110e+09 0.00e+00 a 0 0 0 0 406 5.602 7.467 1 T 2.884e+08 0.00e+00 a 0 821 803 0 407 5.699 8.141 1 T 8.060e+07 0.00e+00 a 0 865 35 0 408 7.496 7.866 1 T 7.802e+07 0.00e+00 a 0 575 535 0 409 5.583 5.920 1 T -4.115e+06 0.00e+00 a 0 248 688 0 410 5.398 5.794 1 T 7.544e+06 0.00e+00 a 0 0 0 0 411 5.478 5.827 1 T -1.169e+07 0.00e+00 a 0 0 0 0 412 5.396 5.959 1 T -1.148e+06 0.00e+00 a 0 0 0 0 413 5.466 5.930 1 T -1.481e+07 0.00e+00 a 0 0 0 0 414 4.799 5.789 1 T 4.397e+07 0.00e+00 a 0 182 186 0 415 4.777 5.956 1 T 5.408e+07 0.00e+00 a 0 525 529 0 416 4.703 5.913 1 T 8.937e+07 0.00e+00 a 0 399 405 0 417 4.789 7.523 1 T 3.170e+08 0.00e+00 a 0 525 575 0 418 4.797 7.873 1 T 9.361e+08 0.00e+00 a 0 182 739 0 419 4.808 7.951 1 T 2.638e+08 0.00e+00 a 0 0 0 0 420 4.782 8.257 1 T 8.751e+08 0.00e+00 a 0 525 545 0 421 4.709 8.286 1 T 2.193e+09 0.00e+00 a 0 399 421 0 422 4.640 8.287 1 T 7.979e+08 0.00e+00 a 0 0 421 0 423 5.573 7.198 1 T 3.391e+08 0.00e+00 a 0 216 729 0 427 5.627 6.855 1 T 2.358e+08 0.00e+00 a 0 228 224 0 428 6.620 7.467 1 T 6.187e+06 0.00e+00 a 0 255 265 0 429 6.952 8.285 1 T 1.030e+09 0.00e+00 a 0 291 292 0 430 6.852 8.198 1 T 7.768e+08 0.00e+00 a 0 224 225 0 431 6.988 7.510 1 T 6.842e+07 0.00e+00 a 0 291 297 0 432 6.892 7.982 1 T 4.690e+07 0.00e+00 a 0 224 198 0 433 6.884 7.812 1 T 1.299e+08 0.00e+00 a 0 224 230 0 434 6.888 7.685 1 T 2.683e+07 0.00e+00 a 0 256 327 0 435 6.693 7.641 1 T 2.781e+07 0.00e+00 a 0 830 835 0 438 6.613 7.820 1 T 1.239e+08 0.00e+00 a 0 0 0 0 439 7.038 7.484 1 T 2.024e+07 0.00e+00 a 0 767 803 0 440 7.034 7.900 1 T 2.320e+07 0.00e+00 a 0 767 128 0 441 7.119 7.640 1 T 1.043e+08 0.00e+00 a 0 829 835 0 442 5.571 7.078 1 T 2.102e+08 0.00e+00 a 0 833 829 0 443 7.051 7.825 1 T 9.956e+07 0.00e+00 a 0 767 773 0 444 7.196 7.820 1 T 1.949e+08 0.00e+00 a 0 0 0 0 445 5.694 7.129 1 T 1.533e+08 0.00e+00 a 0 865 861 0 446 7.159 7.897 1 T 7.567e+07 0.00e+00 a 0 861 867 0 447 7.114 8.059 1 T 2.653e+07 0.00e+00 a 0 829 0 0 448 5.569 8.058 1 T 1.724e+07 0.00e+00 a 0 833 0 0 453 6.561 7.744 1 T 1.308e+07 0.00e+00 a 0 415 451 0 454 6.567 8.285 1 T 1.969e+07 0.00e+00 a 0 415 421 0 457 6.676 7.901 1 T 5.301e+07 0.00e+00 a 0 132 128 0 458 6.672 7.998 1 T 1.139e+08 0.00e+00 a 0 132 138 0 465 6.698 8.273 1 T 4.661e+07 0.00e+00 a 0 416 421 0 468 6.897 7.893 1 T 9.937e+07 0.00e+00 a 0 224 739 0 469 6.774 7.811 1 T 2.160e+08 0.00e+00 a 0 0 0 0 470 6.854 7.194 1 T -2.535e+06 0.00e+00 a 0 695 729 0 471 7.624 7.904 1 T 1.049e+08 0.00e+00 a 0 835 867 0 472 6.678 7.555 1 T 1.727e+07 0.00e+00 a 0 132 168 0 473 6.860 7.473 1 T 2.856e+07 0.00e+00 a 0 695 265 0 474 6.852 7.896 1 T 1.134e+08 0.00e+00 a 0 695 739 0 475 6.726 7.988 1 T 1.709e+08 0.00e+00 a 0 416 411 0 476 7.112 7.850 1 T 1.817e+07 0.00e+00 a 0 829 773 0 477 6.889 7.508 1 T 4.214e+07 0.00e+00 a 0 0 0 0 478 6.989 7.694 1 T 1.167e+07 0.00e+00 a 0 291 327 0 479 7.205 8.217 1 T 2.911e+07 0.00e+00 a 0 729 225 0 483 4.578 7.457 1 T 1.237e+09 0.00e+00 a 0 244 265 0 484 4.038 7.458 1 T 5.789e+08 0.00e+00 a 0 0 0 0 487 4.404 7.462 1 T 2.280e+09 0.00e+00 a 0 242 265 0 492 4.475 7.640 1 T 7.347e+08 0.00e+00 a 0 817 835 0 493 4.106 7.640 1 T 1.008e+09 0.00e+00 a 0 815 835 0 495 3.968 7.640 1 T 3.468e+08 0.00e+00 a 0 809 835 0 498 3.763 7.638 1 T 3.893e+07 0.00e+00 a 0 0 835 0 500 3.755 7.827 1 T 4.093e+08 0.00e+00 a 0 745 773 0 501 3.865 7.830 1 T 2.975e+08 0.00e+00 a 0 746 773 0 504 4.601 7.197 1 T 1.074e+08 0.00e+00 a 0 0 729 0 506 4.487 7.504 1 T 8.111e+08 0.00e+00 a 0 557 575 0 507 4.322 7.500 1 T 9.613e+08 0.00e+00 a 0 0 0 0 511 4.233 7.498 1 T 1.091e+08 0.00e+00 a 0 0 0 0 513 4.278 7.435 1 T 1.031e+08 0.00e+00 a 0 0 265 0 515 4.665 5.762 1 T 2.428e+07 0.00e+00 a 0 0 0 0 516 4.721 7.663 1 T 1.548e+08 0.00e+00 a 0 0 511 0 517 4.644 7.661 1 T 2.516e+08 0.00e+00 a 0 0 511 0 521 4.406 7.776 1 T 2.219e+09 0.00e+00 a 0 369 387 0 522 4.673 7.968 1 T 1.445e+09 0.00e+00 a 0 180 198 0 524 4.494 7.717 1 T 1.083e+09 0.00e+00 a 0 433 451 0 525 4.278 7.724 1 T 4.382e+08 0.00e+00 a 0 435 451 0 526 4.159 7.721 1 T 7.482e+08 0.00e+00 a 0 431 451 0 527 3.983 7.723 1 T 1.436e+08 0.00e+00 a 0 427 451 0 530 4.473 8.284 1 T 5.307e+08 0.00e+00 a 0 401 421 0 531 4.635 5.915 1 T 1.290e+08 0.00e+00 a 0 0 405 0 533 4.038 8.284 1 T 2.813e+08 0.00e+00 a 0 393 421 0 535 4.224 7.683 1 T 5.705e+08 0.00e+00 a 0 309 327 0 536 4.012 7.679 1 T 2.034e+08 0.00e+00 a 0 303 327 0 538 4.113 7.559 1 T 3.590e+08 0.00e+00 a 0 144 168 0 539 4.552 5.832 1 T 4.509e+07 0.00e+00 a 0 371 385 0 540 4.555 7.779 1 T 6.170e+08 0.00e+00 a 0 371 387 0 543 4.378 7.957 1 T 2.607e+09 0.00e+00 a 0 178 198 0 544 4.184 7.954 1 T 5.966e+08 0.00e+00 a 0 174 198 0 546 4.301 5.783 1 T 4.913e+07 0.00e+00 a 0 0 0 0 547 4.301 7.657 1 T 9.714e+08 0.00e+00 a 0 493 511 0 548 4.579 7.663 1 T 2.757e+08 0.00e+00 a 0 495 511 0 549 4.322 7.613 1 T 9.295e+08 0.00e+00 a 0 465 481 0 550 4.577 7.609 1 T 2.732e+08 0.00e+00 a 0 463 481 0 551 4.050 7.617 1 T 2.468e+08 0.00e+00 a 0 457 481 0 553 4.338 5.782 1 T 4.438e+07 0.00e+00 a 0 465 469 0 556 4.518 8.259 1 T 1.695e+09 0.00e+00 a 0 523 545 0 557 4.521 5.947 1 T 5.745e+07 0.00e+00 a 0 523 529 0 558 4.129 8.252 1 T 7.000e+08 0.00e+00 a 0 517 545 0 560 4.230 7.877 1 T 1.486e+09 0.00e+00 a 0 847 867 0 563 7.488 13.357 1 T 4.847e+07 0.00e+00 a 0 575 604 0 565 5.519 13.359 1 T 1.126e+08 0.00e+00 a 0 325 604 0 566 5.706 12.545 1 T 6.292e+07 0.00e+00 a 0 865 64 0 567 5.546 13.726 1 T 1.289e+08 0.00e+00 a 0 216 192 0 568 6.896 13.350 1 T 1.677e+08 0.00e+00 a 0 256 604 0 569 7.808 13.357 1 T 4.672e+07 0.00e+00 a 0 640 604 0 570 7.683 13.358 1 T 5.414e+07 0.00e+00 a 0 327 604 0 571 6.556 12.002 1 T 1.597e+08 0.00e+00 a 0 255 699 0 572 7.630 12.546 1 T 7.807e+07 0.00e+00 a 0 835 64 0 573 4.091 7.198 1 T 2.253e+07 0.00e+00 a 0 144 729 0 574 4.332 7.823 1 T 7.458e+08 0.00e+00 a 0 559 610 0 575 4.595 5.827 1 T 3.344e+07 0.00e+00 a 0 116 122 0 576 4.598 7.992 1 T 1.223e+09 0.00e+00 a 0 116 138 0 577 4.491 7.987 1 T 2.062e+09 0.00e+00 a 0 118 138 0 579 4.382 7.563 1 T 9.550e+08 0.00e+00 a 0 150 168 0 580 4.427 7.564 1 T 1.014e+09 0.00e+00 a 0 0 0 0 581 4.383 7.191 1 T 8.867e+07 0.00e+00 a 0 0 0 0 582 4.427 7.193 1 T 1.226e+08 0.00e+00 a 0 0 0 0 585 4.578 7.559 1 T 4.341e+08 0.00e+00 a 0 152 168 0 586 4.383 8.256 1 T 7.842e+08 0.00e+00 a 0 369 545 0 589 4.232 8.284 1 T 4.981e+08 0.00e+00 a 0 0 0 0 590 4.464 7.884 1 T 1.146e+09 0.00e+00 a 0 817 867 0 591 4.333 8.255 1 T 9.535e+08 0.00e+00 a 0 521 545 0 595 4.002 8.283 1 T 2.634e+08 0.00e+00 a 0 394 421 0 599 5.787 7.871 1 T 2.875e+08 0.00e+00 a 0 499 535 0 602 8.270 10.484 1 T 4.001e+07 0.00e+00 a 0 292 259 0 603 7.489 10.490 1 T 2.342e+07 0.00e+00 a 0 297 259 0 604 3.969 12.543 1 T 1.629e+07 0.00e+00 a 0 809 64 0 605 4.162 12.539 1 T 2.397e+07 0.00e+00 a 0 0 0 0 606 4.472 12.544 1 T 4.691e+07 0.00e+00 a 0 817 64 0 607 4.705 12.544 1 T 1.190e+07 0.00e+00 a 0 0 0 0 608 4.666 13.357 1 T 2.079e+07 0.00e+00 a 0 0 0 0 609 4.376 13.356 1 T 8.990e+07 0.00e+00 a 0 0 0 0 610 4.214 13.356 1 T 6.024e+07 0.00e+00 a 0 309 604 0 611 4.004 13.359 1 T 1.399e+07 0.00e+00 a 0 303 604 0 612 4.087 13.729 1 T 2.005e+07 0.00e+00 a 0 0 0 0 613 4.385 10.486 1 T 8.002e+07 0.00e+00 a 0 0 0 0 614 5.394 10.485 1 T 1.327e+08 0.00e+00 a 0 0 0 0 615 5.786 10.485 1 T 7.039e+08 0.00e+00 a 0 628 259 0 616 6.941 10.482 1 T 2.990e+07 0.00e+00 a 0 291 259 0 617 7.946 10.484 1 T 5.218e+07 0.00e+00 a 0 705 259 0 618 5.566 8.137 1 T 8.872e+07 0.00e+00 a 0 833 35 0 619 4.982 7.562 1 T 9.817e+08 0.00e+00 a 0 166 168 0 620 4.973 7.991 1 T 1.746e+08 0.00e+00 a 0 166 138 0 621 5.369 8.255 1 T 1.216e+08 0.00e+00 a 0 375 545 0 622 5.582 7.493 1 T 5.049e+07 0.00e+00 a 0 248 297 0 623 5.587 6.961 1 T 2.799e+07 0.00e+00 a 0 248 291 0 624 5.759 6.707 1 T 2.918e+07 0.00e+00 a 0 0 0 0 627 4.487 6.951 1 T 6.442e+07 0.00e+00 a 0 557 291 0 628 4.019 6.951 1 T 4.507e+07 0.00e+00 a 0 303 291 0 629 3.978 7.505 1 T 1.741e+08 0.00e+00 a 0 0 0 0 630 4.674 7.875 1 T 9.855e+08 0.00e+00 a 0 180 739 0 631 5.848 8.286 1 T 3.942e+08 0.00e+00 a 0 385 421 0 632 5.121 7.893 1 T 3.550e+07 0.00e+00 a 0 801 128 0 633 4.719 7.775 1 T 2.330e+08 0.00e+00 a 0 399 387 0 634 7.709 14.063 1 T 5.206e+07 0.00e+00 a 0 0 0 0 635 6.766 14.057 1 T 1.615e+07 0.00e+00 a 0 0 0 0 ; loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 1 '2D 1H-1H NOESY' . . . 54037 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $software_1 . . 54037 1 stop_ save_