data_30597 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30597 _Entry.Title ; Wasabi Receptor Toxin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-03-28 _Entry.Accession_date 2019-03-28 _Entry.Last_release_date 2019-07-10 _Entry.Original_release_date 2019-07-10 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _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 . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 30597 stop_ 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 J. 'Lin King' J. V. . . 30597 2 M. Kelly M. J.S. . . 30597 3 D. Julius D. . . . 30597 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Cysteine-stabilized helical hairpin' . 30597 Scorpion . 30597 TOXIN . 30597 TRPA1 . 30597 Venom . 30597 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30597 spectral_peak_list 4 30597 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 107 30597 '1H chemical shifts' 224 30597 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 . . 2019-08-23 . original BMRB . 30597 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6OFA . 30597 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30597 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; A cell-penetrating scorpion toxin targets TRPA1 to elicit mode-specific activation and pain ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 J. 'Lin King' J. V. . . 30597 1 2 J. Emrick J. J. . . 30597 1 3 M. Kelly M. J.S. . . 30597 1 4 V. Herzig V. . . . 30597 1 5 G. King G. F. . . 30597 1 6 K. Medzihradszky K. F. . . 30597 1 7 D. Julius D. . . . 30597 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30597 _Assembly.ID 1 _Assembly.Name 'Wasabi Receptor Toxin' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _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 entity_1 1 $entity_1 A A yes . . . . . . 30597 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 9 9 SG . 1 . 1 CYS 27 27 SG . . . . . . . . . . . . 30597 1 2 disulfide single . 1 . 1 CYS 13 13 SG . 1 . 1 CYS 23 23 SG . . . . . . . . . . . . 30597 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30597 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ASPQQAKYCYEQCNVNKVPF DQCYQMCSPLERS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 33 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3862.348 _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 . ALA . 30597 1 2 . SER . 30597 1 3 . PRO . 30597 1 4 . GLN . 30597 1 5 . GLN . 30597 1 6 . ALA . 30597 1 7 . LYS . 30597 1 8 . TYR . 30597 1 9 . CYS . 30597 1 10 . TYR . 30597 1 11 . GLU . 30597 1 12 . GLN . 30597 1 13 . CYS . 30597 1 14 . ASN . 30597 1 15 . VAL . 30597 1 16 . ASN . 30597 1 17 . LYS . 30597 1 18 . VAL . 30597 1 19 . PRO . 30597 1 20 . PHE . 30597 1 21 . ASP . 30597 1 22 . GLN . 30597 1 23 . CYS . 30597 1 24 . TYR . 30597 1 25 . GLN . 30597 1 26 . MET . 30597 1 27 . CYS . 30597 1 28 . SER . 30597 1 29 . PRO . 30597 1 30 . LEU . 30597 1 31 . GLU . 30597 1 32 . ARG . 30597 1 33 . SER . 30597 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 . ALA 1 1 30597 1 . SER 2 2 30597 1 . PRO 3 3 30597 1 . GLN 4 4 30597 1 . GLN 5 5 30597 1 . ALA 6 6 30597 1 . LYS 7 7 30597 1 . TYR 8 8 30597 1 . CYS 9 9 30597 1 . TYR 10 10 30597 1 . GLU 11 11 30597 1 . GLN 12 12 30597 1 . CYS 13 13 30597 1 . ASN 14 14 30597 1 . VAL 15 15 30597 1 . ASN 16 16 30597 1 . LYS 17 17 30597 1 . VAL 18 18 30597 1 . PRO 19 19 30597 1 . PHE 20 20 30597 1 . ASP 21 21 30597 1 . GLN 22 22 30597 1 . CYS 23 23 30597 1 . TYR 24 24 30597 1 . GLN 25 25 30597 1 . MET 26 26 30597 1 . CYS 27 27 30597 1 . SER 28 28 30597 1 . PRO 29 29 30597 1 . LEU 30 30 30597 1 . GLU 31 31 30597 1 . ARG 32 32 30597 1 . SER 33 33 30597 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 30597 _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 . 1330407 organism . 'Urodacus manicatus' 'Urodacus manicatus' . . Eukaryota Metazoa Urodacus manicatus . . . . . . . . . . . . . 30597 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 30597 _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 . 'chemical synthesis' . . . . . . . . . . . . . . . . 30597 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30597 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '300 uM Wasabi Receptor Toxin, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _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 'Wasabi Receptor Toxin' 'natural abundance' 1 $assembly 1 $entity_1 . . 300 . . uM . . . . 30597 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30597 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '300 uM Wasabi Receptor Toxin, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'Wasabi Receptor Toxin' 'natural abundance' 1 $assembly 1 $entity_1 . . 300 . . uM . . . . 30597 2 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 30597 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 0 0 M 30597 1 pH 4 0 pH 30597 1 pressure 1 . atm 30597 1 temperature 298 . K 30597 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30597 _Software.ID 1 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "LINGE, O'DONOGHUE AND NILGES" . . 30597 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 30597 1 . 'structure calculation' 30597 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30597 _Software.ID 2 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 30597 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 30597 2 . 'peak picking' 30597 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30597 _Software.ID 3 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30597 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 30597 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30597 _Software.ID 4 _Software.Type . _Software.Name PSVS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 30597 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 30597 4 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 30597 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30597 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker Avance . 800 . . . 30597 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 30597 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 4 '2D 1H-1H COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 6 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 7 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 1 8 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30597 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 30597 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 0.000 external indirect 0.25144953 . . . . . 30597 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 external direct 1.0 . . . . . 30597 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 30597 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 COSY' . . . 30597 1 2 '2D 1H-1H TOCSY' . . . 30597 1 3 '2D 1H-1H NOESY' . . . 30597 1 4 '2D 1H-1H COSY' . . . 30597 1 5 '2D 1H-1H TOCSY' . . . 30597 1 6 '2D 1H-1H NOESY' . . . 30597 1 7 '2D 1H-13C HSQC aliphatic' . . . 30597 1 8 '2D 1H-13C HSQC aromatic' . . . 30597 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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 ALA HA H 1 3.590 . . . . . . . A 1 ALA HA . 30597 1 2 . 1 1 1 1 ALA HB1 H 1 1.286 . . . . . . . A 1 ALA HB1 . 30597 1 3 . 1 1 1 1 ALA HB2 H 1 1.286 . . . . . . . A 1 ALA HB2 . 30597 1 4 . 1 1 1 1 ALA HB3 H 1 1.286 . . . . . . . A 1 ALA HB3 . 30597 1 5 . 1 1 1 1 ALA CA C 13 55.213 . . . . . . . A 1 ALA CA . 30597 1 6 . 1 1 1 1 ALA CB C 13 24.994 . . . . . . . A 1 ALA CB . 30597 1 7 . 1 1 2 2 SER H H 1 8.704 . . . . . . . A 2 SER H . 30597 1 8 . 1 1 2 2 SER HA H 1 4.883 . . . . . . . A 2 SER HA . 30597 1 9 . 1 1 2 2 SER HB2 H 1 3.985 . . . . . . . A 2 SER HB2 . 30597 1 10 . 1 1 2 2 SER HB3 H 1 3.983 . . . . . . . A 2 SER HB3 . 30597 1 11 . 1 1 2 2 SER CA C 13 58.971 . . . . . . . A 2 SER CA . 30597 1 12 . 1 1 2 2 SER CB C 13 66.013 . . . . . . . A 2 SER CB . 30597 1 13 . 1 1 3 3 PRO HA H 1 4.464 . . . . . . . A 3 PRO HA . 30597 1 14 . 1 1 3 3 PRO HB2 H 1 2.427 . . . . . . . A 3 PRO HB2 . 30597 1 15 . 1 1 3 3 PRO HB3 H 1 2.002 . . . . . . . A 3 PRO HB3 . 30597 1 16 . 1 1 3 3 PRO HG2 H 1 2.116 . . . . . . . A 3 PRO HG2 . 30597 1 17 . 1 1 3 3 PRO HG3 H 1 2.169 . . . . . . . A 3 PRO HG3 . 30597 1 18 . 1 1 3 3 PRO HD2 H 1 3.848 . . . . . . . A 3 PRO HD2 . 30597 1 19 . 1 1 3 3 PRO HD3 H 1 3.871 . . . . . . . A 3 PRO HD3 . 30597 1 20 . 1 1 3 3 PRO CA C 13 66.995 . . . . . . . A 3 PRO CA . 30597 1 21 . 1 1 3 3 PRO CB C 13 34.746 . . . . . . . A 3 PRO CB . 30597 1 22 . 1 1 3 3 PRO CG C 13 30.366 . . . . . . . A 3 PRO CG . 30597 1 23 . 1 1 3 3 PRO CD C 13 53.503 . . . . . . . A 3 PRO CD . 30597 1 24 . 1 1 4 4 GLN H H 1 8.579 . . . . . . . A 4 GLN H . 30597 1 25 . 1 1 4 4 GLN HA H 1 4.186 . . . . . . . A 4 GLN HA . 30597 1 26 . 1 1 4 4 GLN HB2 H 1 2.083 . . . . . . . A 4 GLN HB2 . 30597 1 27 . 1 1 4 4 GLN HB3 H 1 2.083 . . . . . . . A 4 GLN HB3 . 30597 1 28 . 1 1 4 4 GLN HG2 H 1 2.424 . . . . . . . A 4 GLN HG2 . 30597 1 29 . 1 1 4 4 GLN HG3 H 1 2.424 . . . . . . . A 4 GLN HG3 . 30597 1 30 . 1 1 4 4 GLN HE21 H 1 7.610 . . . . . . . A 4 GLN HE21 . 30597 1 31 . 1 1 4 4 GLN HE22 H 1 6.869 . . . . . . . A 4 GLN HE22 . 30597 1 32 . 1 1 4 4 GLN CA C 13 60.433 . . . . . . . A 4 GLN CA . 30597 1 33 . 1 1 4 4 GLN CB C 13 34.723 . . . . . . . A 4 GLN CB . 30597 1 34 . 1 1 4 4 GLN CG C 13 34.737 . . . . . . . A 4 GLN CG . 30597 1 35 . 1 1 5 5 GLN H H 1 8.230 . . . . . . . A 5 GLN H . 30597 1 36 . 1 1 5 5 GLN HA H 1 4.226 . . . . . . . A 5 GLN HA . 30597 1 37 . 1 1 5 5 GLN HB2 H 1 2.196 . . . . . . . A 5 GLN HB2 . 30597 1 38 . 1 1 5 5 GLN HB3 H 1 2.194 . . . . . . . A 5 GLN HB3 . 30597 1 39 . 1 1 5 5 GLN HG2 H 1 2.485 . . . . . . . A 5 GLN HG2 . 30597 1 40 . 1 1 5 5 GLN HG3 H 1 2.485 . . . . . . . A 5 GLN HG3 . 30597 1 41 . 1 1 5 5 GLN HE21 H 1 6.924 . . . . . . . A 5 GLN HE21 . 30597 1 42 . 1 1 5 5 GLN HE22 H 1 7.603 . . . . . . . A 5 GLN HE22 . 30597 1 43 . 1 1 5 5 GLN CA C 13 60.665 . . . . . . . A 5 GLN CA . 30597 1 44 . 1 1 5 5 GLN CB C 13 31.718 . . . . . . . A 5 GLN CB . 30597 1 45 . 1 1 5 5 GLN CG C 13 36.969 . . . . . . . A 5 GLN CG . 30597 1 46 . 1 1 6 6 ALA H H 1 8.360 . . . . . . . A 6 ALA H . 30597 1 47 . 1 1 6 6 ALA HA H 1 4.041 . . . . . . . A 6 ALA HA . 30597 1 48 . 1 1 6 6 ALA HB1 H 1 1.451 . . . . . . . A 6 ALA HB1 . 30597 1 49 . 1 1 6 6 ALA HB2 H 1 1.451 . . . . . . . A 6 ALA HB2 . 30597 1 50 . 1 1 6 6 ALA HB3 H 1 1.451 . . . . . . . A 6 ALA HB3 . 30597 1 51 . 1 1 6 6 ALA CA C 13 57.938 . . . . . . . A 6 ALA CA . 30597 1 52 . 1 1 6 6 ALA CB C 13 20.893 . . . . . . . A 6 ALA CB . 30597 1 53 . 1 1 7 7 LYS H H 1 8.046 . . . . . . . A 7 LYS H . 30597 1 54 . 1 1 7 7 LYS HA H 1 4.158 . . . . . . . A 7 LYS HA . 30597 1 55 . 1 1 7 7 LYS HB2 H 1 1.918 . . . . . . . A 7 LYS HB2 . 30597 1 56 . 1 1 7 7 LYS HB3 H 1 1.894 . . . . . . . A 7 LYS HB3 . 30597 1 57 . 1 1 7 7 LYS HG2 H 1 1.395 . . . . . . . A 7 LYS HG2 . 30597 1 58 . 1 1 7 7 LYS HG3 H 1 1.499 . . . . . . . A 7 LYS HG3 . 30597 1 59 . 1 1 7 7 LYS HD2 H 1 1.690 . . . . . . . A 7 LYS HD2 . 30597 1 60 . 1 1 7 7 LYS HD3 H 1 1.690 . . . . . . . A 7 LYS HD3 . 30597 1 61 . 1 1 7 7 LYS HE2 H 1 2.993 . . . . . . . A 7 LYS HE2 . 30597 1 62 . 1 1 7 7 LYS CA C 13 62.413 . . . . . . . A 7 LYS CA . 30597 1 63 . 1 1 7 7 LYS CB C 13 35.114 . . . . . . . A 7 LYS CB . 30597 1 64 . 1 1 7 7 LYS CG C 13 27.500 . . . . . . . A 7 LYS CG . 30597 1 65 . 1 1 7 7 LYS CD C 13 29.601 . . . . . . . A 7 LYS CD . 30597 1 66 . 1 1 7 7 LYS CE C 13 44.596 . . . . . . . A 7 LYS CE . 30597 1 67 . 1 1 8 8 TYR H H 1 7.862 . . . . . . . A 8 TYR H . 30597 1 68 . 1 1 8 8 TYR HA H 1 4.366 . . . . . . . A 8 TYR HA . 30597 1 69 . 1 1 8 8 TYR HB2 H 1 3.104 . . . . . . . A 8 TYR HB2 . 30597 1 70 . 1 1 8 8 TYR HB3 H 1 3.131 . . . . . . . A 8 TYR HB3 . 30597 1 71 . 1 1 8 8 TYR HD1 H 1 7.161 . . . . . . . A 8 TYR HD1 . 30597 1 72 . 1 1 8 8 TYR HD2 H 1 7.161 . . . . . . . A 8 TYR HD2 . 30597 1 73 . 1 1 8 8 TYR HE1 H 1 6.797 . . . . . . . A 8 TYR HE1 . 30597 1 74 . 1 1 8 8 TYR HE2 H 1 6.797 . . . . . . . A 8 TYR HE2 . 30597 1 75 . 1 1 8 8 TYR CB C 13 40.646 . . . . . . . A 8 TYR CB . 30597 1 76 . 1 1 8 8 TYR CD1 C 13 135.920 . . . . . . . A 8 TYR CD1 . 30597 1 77 . 1 1 8 8 TYR CD2 C 13 135.920 . . . . . . . A 8 TYR CD2 . 30597 1 78 . 1 1 8 8 TYR CE1 C 13 120.994 . . . . . . . A 8 TYR CE1 . 30597 1 79 . 1 1 8 8 TYR CE2 C 13 120.994 . . . . . . . A 8 TYR CE2 . 30597 1 80 . 1 1 9 9 CYS H H 1 7.921 . . . . . . . A 9 CYS H . 30597 1 81 . 1 1 9 9 CYS HA H 1 4.069 . . . . . . . A 9 CYS HA . 30597 1 82 . 1 1 9 9 CYS HB2 H 1 2.825 . . . . . . . A 9 CYS HB2 . 30597 1 83 . 1 1 9 9 CYS HB3 H 1 3.242 . . . . . . . A 9 CYS HB3 . 30597 1 84 . 1 1 9 9 CYS CB C 13 38.800 . . . . . . . A 9 CYS CB . 30597 1 85 . 1 1 10 10 TYR H H 1 8.420 . . . . . . . A 10 TYR H . 30597 1 86 . 1 1 10 10 TYR HA H 1 4.204 . . . . . . . A 10 TYR HA . 30597 1 87 . 1 1 10 10 TYR HB2 H 1 3.111 . . . . . . . A 10 TYR HB2 . 30597 1 88 . 1 1 10 10 TYR HB3 H 1 2.961 . . . . . . . A 10 TYR HB3 . 30597 1 89 . 1 1 10 10 TYR HD1 H 1 7.254 . . . . . . . A 10 TYR HD1 . 30597 1 90 . 1 1 10 10 TYR HD2 H 1 7.254 . . . . . . . A 10 TYR HD2 . 30597 1 91 . 1 1 10 10 TYR HE1 H 1 6.538 . . . . . . . A 10 TYR HE1 . 30597 1 92 . 1 1 10 10 TYR HE2 H 1 6.538 . . . . . . . A 10 TYR HE2 . 30597 1 93 . 1 1 10 10 TYR CA C 13 65.873 . . . . . . . A 10 TYR CA . 30597 1 94 . 1 1 10 10 TYR CB C 13 40.620 . . . . . . . A 10 TYR CB . 30597 1 95 . 1 1 10 10 TYR CD1 C 13 136.776 . . . . . . . A 10 TYR CD1 . 30597 1 96 . 1 1 10 10 TYR CD2 C 13 136.776 . . . . . . . A 10 TYR CD2 . 30597 1 97 . 1 1 10 10 TYR CE1 C 13 120.264 . . . . . . . A 10 TYR CE1 . 30597 1 98 . 1 1 10 10 TYR CE2 C 13 120.264 . . . . . . . A 10 TYR CE2 . 30597 1 99 . 1 1 11 11 GLU H H 1 8.323 . . . . . . . A 11 GLU H . 30597 1 100 . 1 1 11 11 GLU HA H 1 4.180 . . . . . . . A 11 GLU HA . 30597 1 101 . 1 1 11 11 GLU HB2 H 1 2.096 . . . . . . . A 11 GLU HB2 . 30597 1 102 . 1 1 11 11 GLU HB3 H 1 2.266 . . . . . . . A 11 GLU HB3 . 30597 1 103 . 1 1 11 11 GLU HG2 H 1 2.521 . . . . . . . A 11 GLU HG2 . 30597 1 104 . 1 1 11 11 GLU HG3 H 1 2.279 . . . . . . . A 11 GLU HG3 . 30597 1 105 . 1 1 11 11 GLU CA C 13 62.269 . . . . . . . A 11 GLU CA . 30597 1 106 . 1 1 11 11 GLU CB C 13 31.927 . . . . . . . A 11 GLU CB . 30597 1 107 . 1 1 11 11 GLU CG C 13 39.116 . . . . . . . A 11 GLU CG . 30597 1 108 . 1 1 12 12 GLN H H 1 8.280 . . . . . . . A 12 GLN H . 30597 1 109 . 1 1 12 12 GLN HA H 1 3.952 . . . . . . . A 12 GLN HA . 30597 1 110 . 1 1 12 12 GLN HB2 H 1 1.949 . . . . . . . A 12 GLN HB2 . 30597 1 111 . 1 1 12 12 GLN HB3 H 1 1.954 . . . . . . . A 12 GLN HB3 . 30597 1 112 . 1 1 12 12 GLN HG2 H 1 2.054 . . . . . . . A 12 GLN HG2 . 30597 1 113 . 1 1 12 12 GLN HG3 H 1 2.095 . . . . . . . A 12 GLN HG3 . 30597 1 114 . 1 1 12 12 GLN HE21 H 1 6.853 . . . . . . . A 12 GLN HE21 . 30597 1 115 . 1 1 12 12 GLN HE22 H 1 6.946 . . . . . . . A 12 GLN HE22 . 30597 1 116 . 1 1 12 12 GLN CA C 13 60.522 . . . . . . . A 12 GLN CA . 30597 1 117 . 1 1 12 12 GLN CB C 13 34.755 . . . . . . . A 12 GLN CB . 30597 1 118 . 1 1 12 12 GLN CG C 13 30.744 . . . . . . . A 12 GLN CG . 30597 1 119 . 1 1 13 13 CYS H H 1 8.122 . . . . . . . A 13 CYS H . 30597 1 120 . 1 1 13 13 CYS HA H 1 4.072 . . . . . . . A 13 CYS HA . 30597 1 121 . 1 1 13 13 CYS HB2 H 1 3.452 . . . . . . . A 13 CYS HB2 . 30597 1 122 . 1 1 13 13 CYS HB3 H 1 3.695 . . . . . . . A 13 CYS HB3 . 30597 1 123 . 1 1 13 13 CYS CB C 13 44.901 . . . . . . . A 13 CYS CB . 30597 1 124 . 1 1 14 14 ASN H H 1 7.609 . . . . . . . A 14 ASN H . 30597 1 125 . 1 1 14 14 ASN HA H 1 4.639 . . . . . . . A 14 ASN HA . 30597 1 126 . 1 1 14 14 ASN HB2 H 1 3.002 . . . . . . . A 14 ASN HB2 . 30597 1 127 . 1 1 14 14 ASN HB3 H 1 3.000 . . . . . . . A 14 ASN HB3 . 30597 1 128 . 1 1 14 14 ASN HD21 H 1 7.717 . . . . . . . A 14 ASN HD21 . 30597 1 129 . 1 1 14 14 ASN HD22 H 1 6.994 . . . . . . . A 14 ASN HD22 . 30597 1 130 . 1 1 14 14 ASN CA C 13 58.779 . . . . . . . A 14 ASN CA . 30597 1 131 . 1 1 14 14 ASN CB C 13 41.021 . . . . . . . A 14 ASN CB . 30597 1 132 . 1 1 15 15 VAL H H 1 7.863 . . . . . . . A 15 VAL H . 30597 1 133 . 1 1 15 15 VAL HA H 1 3.749 . . . . . . . A 15 VAL HA . 30597 1 134 . 1 1 15 15 VAL HB H 1 2.091 . . . . . . . A 15 VAL HB . 30597 1 135 . 1 1 15 15 VAL HG11 H 1 0.954 . . . . . . . A 15 VAL HG11 . 30597 1 136 . 1 1 15 15 VAL HG12 H 1 0.954 . . . . . . . A 15 VAL HG12 . 30597 1 137 . 1 1 15 15 VAL HG13 H 1 0.954 . . . . . . . A 15 VAL HG13 . 30597 1 138 . 1 1 15 15 VAL HG21 H 1 1.063 . . . . . . . A 15 VAL HG21 . 30597 1 139 . 1 1 15 15 VAL HG22 H 1 1.063 . . . . . . . A 15 VAL HG22 . 30597 1 140 . 1 1 15 15 VAL HG23 H 1 1.063 . . . . . . . A 15 VAL HG23 . 30597 1 141 . 1 1 15 15 VAL CA C 13 68.517 . . . . . . . A 15 VAL CA . 30597 1 142 . 1 1 15 15 VAL CB C 13 31.177 . . . . . . . A 15 VAL CB . 30597 1 143 . 1 1 15 15 VAL CG1 C 13 23.578 . . . . . . . A 15 VAL CG1 . 30597 1 144 . 1 1 15 15 VAL CG2 C 13 24.846 . . . . . . . A 15 VAL CG2 . 30597 1 145 . 1 1 16 16 ASN H H 1 7.864 . . . . . . . A 16 ASN H . 30597 1 146 . 1 1 16 16 ASN HA H 1 4.775 . . . . . . . A 16 ASN HA . 30597 1 147 . 1 1 16 16 ASN HB2 H 1 2.952 . . . . . . . A 16 ASN HB2 . 30597 1 148 . 1 1 16 16 ASN HB3 H 1 2.659 . . . . . . . A 16 ASN HB3 . 30597 1 149 . 1 1 16 16 ASN HD21 H 1 7.589 . . . . . . . A 16 ASN HD21 . 30597 1 150 . 1 1 16 16 ASN HD22 H 1 6.888 . . . . . . . A 16 ASN HD22 . 30597 1 151 . 1 1 16 16 ASN CA C 13 58.970 . . . . . . . A 16 ASN CA . 30597 1 152 . 1 1 16 16 ASN CB C 13 41.482 . . . . . . . A 16 ASN CB . 30597 1 153 . 1 1 17 17 LYS H H 1 7.764 . . . . . . . A 17 LYS H . 30597 1 154 . 1 1 17 17 LYS HA H 1 4.019 . . . . . . . A 17 LYS HA . 30597 1 155 . 1 1 17 17 LYS HB2 H 1 1.905 . . . . . . . A 17 LYS HB2 . 30597 1 156 . 1 1 17 17 LYS HB3 H 1 2.094 . . . . . . . A 17 LYS HB3 . 30597 1 157 . 1 1 17 17 LYS HG2 H 1 1.398 . . . . . . . A 17 LYS HG2 . 30597 1 158 . 1 1 17 17 LYS HG3 H 1 1.398 . . . . . . . A 17 LYS HG3 . 30597 1 159 . 1 1 17 17 LYS HD2 H 1 1.766 . . . . . . . A 17 LYS HD2 . 30597 1 160 . 1 1 17 17 LYS HD3 H 1 1.688 . . . . . . . A 17 LYS HD3 . 30597 1 161 . 1 1 17 17 LYS HE2 H 1 3.041 . . . . . . . A 17 LYS HE2 . 30597 1 162 . 1 1 17 17 LYS HE3 H 1 3.041 . . . . . . . A 17 LYS HE3 . 30597 1 163 . 1 1 17 17 LYS CA C 13 59.558 . . . . . . . A 17 LYS CA . 30597 1 164 . 1 1 17 17 LYS CB C 13 31.372 . . . . . . . A 17 LYS CB . 30597 1 165 . 1 1 17 17 LYS CG C 13 27.533 . . . . . . . A 17 LYS CG . 30597 1 166 . 1 1 17 17 LYS CD C 13 31.630 . . . . . . . A 17 LYS CD . 30597 1 167 . 1 1 17 17 LYS CE C 13 44.844 . . . . . . . A 17 LYS CE . 30597 1 168 . 1 1 18 18 VAL H H 1 8.361 . . . . . . . A 18 VAL H . 30597 1 169 . 1 1 18 18 VAL HA H 1 4.278 . . . . . . . A 18 VAL HA . 30597 1 170 . 1 1 18 18 VAL HB H 1 1.927 . . . . . . . A 18 VAL HB . 30597 1 171 . 1 1 18 18 VAL HG11 H 1 0.963 . . . . . . . A 18 VAL HG11 . 30597 1 172 . 1 1 18 18 VAL HG12 H 1 0.963 . . . . . . . A 18 VAL HG12 . 30597 1 173 . 1 1 18 18 VAL HG13 H 1 0.963 . . . . . . . A 18 VAL HG13 . 30597 1 174 . 1 1 18 18 VAL HG21 H 1 1.054 . . . . . . . A 18 VAL HG21 . 30597 1 175 . 1 1 18 18 VAL HG22 H 1 1.054 . . . . . . . A 18 VAL HG22 . 30597 1 176 . 1 1 18 18 VAL HG23 H 1 1.054 . . . . . . . A 18 VAL HG23 . 30597 1 177 . 1 1 18 18 VAL CA C 13 62.948 . . . . . . . A 18 VAL CA . 30597 1 178 . 1 1 18 18 VAL CB C 13 36.010 . . . . . . . A 18 VAL CB . 30597 1 179 . 1 1 18 18 VAL CG1 C 13 24.737 . . . . . . . A 18 VAL CG1 . 30597 1 180 . 1 1 18 18 VAL CG2 C 13 23.713 . . . . . . . A 18 VAL CG2 . 30597 1 181 . 1 1 19 19 PRO HA H 1 4.500 . . . . . . . A 19 PRO HA . 30597 1 182 . 1 1 19 19 PRO HB2 H 1 2.502 . . . . . . . A 19 PRO HB2 . 30597 1 183 . 1 1 19 19 PRO HB3 H 1 2.135 . . . . . . . A 19 PRO HB3 . 30597 1 184 . 1 1 19 19 PRO HG2 H 1 2.092 . . . . . . . A 19 PRO HG2 . 30597 1 185 . 1 1 19 19 PRO HG3 H 1 2.092 . . . . . . . A 19 PRO HG3 . 30597 1 186 . 1 1 19 19 PRO HD2 H 1 3.672 . . . . . . . A 19 PRO HD2 . 30597 1 187 . 1 1 19 19 PRO HD3 H 1 4.113 . . . . . . . A 19 PRO HD3 . 30597 1 188 . 1 1 19 19 PRO CA C 13 65.671 . . . . . . . A 19 PRO CA . 30597 1 189 . 1 1 19 19 PRO CB C 13 35.559 . . . . . . . A 19 PRO CB . 30597 1 190 . 1 1 19 19 PRO CG C 13 30.749 . . . . . . . A 19 PRO CG . 30597 1 191 . 1 1 19 19 PRO CD C 13 53.997 . . . . . . . A 19 PRO CD . 30597 1 192 . 1 1 20 20 PHE H H 1 8.874 . . . . . . . A 20 PHE H . 30597 1 193 . 1 1 20 20 PHE HA H 1 4.182 . . . . . . . A 20 PHE HA . 30597 1 194 . 1 1 20 20 PHE HB2 H 1 3.356 . . . . . . . A 20 PHE HB2 . 30597 1 195 . 1 1 20 20 PHE HB3 H 1 3.034 . . . . . . . A 20 PHE HB3 . 30597 1 196 . 1 1 20 20 PHE HD1 H 1 7.310 . . . . . . . A 20 PHE HD1 . 30597 1 197 . 1 1 20 20 PHE HD2 H 1 7.310 . . . . . . . A 20 PHE HD2 . 30597 1 198 . 1 1 20 20 PHE HE1 H 1 7.313 . . . . . . . A 20 PHE HE1 . 30597 1 199 . 1 1 20 20 PHE HE2 H 1 7.313 . . . . . . . A 20 PHE HE2 . 30597 1 200 . 1 1 20 20 PHE HZ H 1 7.272 . . . . . . . A 20 PHE HZ . 30597 1 201 . 1 1 20 20 PHE CA C 13 65.568 . . . . . . . A 20 PHE CA . 30597 1 202 . 1 1 20 20 PHE CB C 13 42.043 . . . . . . . A 20 PHE CB . 30597 1 203 . 1 1 20 20 PHE CD1 C 13 134.801 . . . . . . . A 20 PHE CD1 . 30597 1 204 . 1 1 20 20 PHE CD2 C 13 134.801 . . . . . . . A 20 PHE CD2 . 30597 1 205 . 1 1 20 20 PHE CE1 C 13 134.065 . . . . . . . A 20 PHE CE1 . 30597 1 206 . 1 1 20 20 PHE CE2 C 13 134.065 . . . . . . . A 20 PHE CE2 . 30597 1 207 . 1 1 20 20 PHE CZ C 13 132.645 . . . . . . . A 20 PHE CZ . 30597 1 208 . 1 1 21 21 ASP H H 1 8.997 . . . . . . . A 21 ASP H . 30597 1 209 . 1 1 21 21 ASP HA H 1 4.269 . . . . . . . A 21 ASP HA . 30597 1 210 . 1 1 21 21 ASP HB2 H 1 2.732 . . . . . . . A 21 ASP HB2 . 30597 1 211 . 1 1 21 21 ASP HB3 H 1 2.688 . . . . . . . A 21 ASP HB3 . 30597 1 212 . 1 1 21 21 ASP CA C 13 59.942 . . . . . . . A 21 ASP CA . 30597 1 213 . 1 1 21 21 ASP CB C 13 41.990 . . . . . . . A 21 ASP CB . 30597 1 214 . 1 1 22 22 GLN H H 1 7.440 . . . . . . . A 22 GLN H . 30597 1 215 . 1 1 22 22 GLN HA H 1 4.084 . . . . . . . A 22 GLN HA . 30597 1 216 . 1 1 22 22 GLN HB2 H 1 2.009 . . . . . . . A 22 GLN HB2 . 30597 1 217 . 1 1 22 22 GLN HB3 H 1 2.009 . . . . . . . A 22 GLN HB3 . 30597 1 218 . 1 1 22 22 GLN HG2 H 1 2.357 . . . . . . . A 22 GLN HG2 . 30597 1 219 . 1 1 22 22 GLN HG3 H 1 2.425 . . . . . . . A 22 GLN HG3 . 30597 1 220 . 1 1 22 22 GLN HE21 H 1 7.466 . . . . . . . A 22 GLN HE21 . 30597 1 221 . 1 1 22 22 GLN HE22 H 1 6.917 . . . . . . . A 22 GLN HE22 . 30597 1 222 . 1 1 22 22 GLN CA C 13 60.974 . . . . . . . A 22 GLN CA . 30597 1 223 . 1 1 22 22 GLN CB C 13 31.333 . . . . . . . A 22 GLN CB . 30597 1 224 . 1 1 22 22 GLN CG C 13 36.536 . . . . . . . A 22 GLN CG . 30597 1 225 . 1 1 23 23 CYS H H 1 8.571 . . . . . . . A 23 CYS H . 30597 1 226 . 1 1 23 23 CYS HA H 1 4.038 . . . . . . . A 23 CYS HA . 30597 1 227 . 1 1 23 23 CYS HB2 H 1 3.176 . . . . . . . A 23 CYS HB2 . 30597 1 228 . 1 1 23 23 CYS HB3 H 1 2.799 . . . . . . . A 23 CYS HB3 . 30597 1 229 . 1 1 23 23 CYS CB C 13 43.126 . . . . . . . A 23 CYS CB . 30597 1 230 . 1 1 24 24 TYR H H 1 8.833 . . . . . . . A 24 TYR H . 30597 1 231 . 1 1 24 24 TYR HA H 1 4.044 . . . . . . . A 24 TYR HA . 30597 1 232 . 1 1 24 24 TYR HB2 H 1 2.694 . . . . . . . A 24 TYR HB2 . 30597 1 233 . 1 1 24 24 TYR HB3 H 1 2.897 . . . . . . . A 24 TYR HB3 . 30597 1 234 . 1 1 24 24 TYR HD1 H 1 7.139 . . . . . . . A 24 TYR HD1 . 30597 1 235 . 1 1 24 24 TYR HD2 H 1 7.139 . . . . . . . A 24 TYR HD2 . 30597 1 236 . 1 1 24 24 TYR HE1 H 1 6.872 . . . . . . . A 24 TYR HE1 . 30597 1 237 . 1 1 24 24 TYR HE2 H 1 6.872 . . . . . . . A 24 TYR HE2 . 30597 1 238 . 1 1 24 24 TYR CB C 13 40.693 . . . . . . . A 24 TYR CB . 30597 1 239 . 1 1 24 24 TYR CD1 C 13 135.920 . . . . . . . A 24 TYR CD1 . 30597 1 240 . 1 1 24 24 TYR CD2 C 13 135.920 . . . . . . . A 24 TYR CD2 . 30597 1 241 . 1 1 24 24 TYR CE1 C 13 121.136 . . . . . . . A 24 TYR CE1 . 30597 1 242 . 1 1 24 24 TYR CE2 C 13 121.136 . . . . . . . A 24 TYR CE2 . 30597 1 243 . 1 1 25 25 GLN H H 1 7.604 . . . . . . . A 25 GLN H . 30597 1 244 . 1 1 25 25 GLN HA H 1 3.868 . . . . . . . A 25 GLN HA . 30597 1 245 . 1 1 25 25 GLN HB2 H 1 2.162 . . . . . . . A 25 GLN HB2 . 30597 1 246 . 1 1 25 25 GLN HB3 H 1 2.162 . . . . . . . A 25 GLN HB3 . 30597 1 247 . 1 1 25 25 GLN HG2 H 1 2.574 . . . . . . . A 25 GLN HG2 . 30597 1 248 . 1 1 25 25 GLN HG3 H 1 2.579 . . . . . . . A 25 GLN HG3 . 30597 1 249 . 1 1 25 25 GLN HE21 H 1 6.896 . . . . . . . A 25 GLN HE21 . 30597 1 250 . 1 1 25 25 GLN HE22 H 1 7.534 . . . . . . . A 25 GLN HE22 . 30597 1 251 . 1 1 25 25 GLN CA C 13 61.302 . . . . . . . A 25 GLN CA . 30597 1 252 . 1 1 25 25 GLN CB C 13 31.080 . . . . . . . A 25 GLN CB . 30597 1 253 . 1 1 25 25 GLN CG C 13 36.415 . . . . . . . A 25 GLN CG . 30597 1 254 . 1 1 26 26 MET H H 1 7.582 . . . . . . . A 26 MET H . 30597 1 255 . 1 1 26 26 MET HA H 1 4.152 . . . . . . . A 26 MET HA . 30597 1 256 . 1 1 26 26 MET HB2 H 1 2.161 . . . . . . . A 26 MET HB2 . 30597 1 257 . 1 1 26 26 MET HB3 H 1 2.072 . . . . . . . A 26 MET HB3 . 30597 1 258 . 1 1 26 26 MET HG2 H 1 2.571 . . . . . . . A 26 MET HG2 . 30597 1 259 . 1 1 26 26 MET HG3 H 1 2.484 . . . . . . . A 26 MET HG3 . 30597 1 260 . 1 1 26 26 MET HE1 H 1 2.060 . . . . . . . A 26 MET HE1 . 30597 1 261 . 1 1 26 26 MET HE2 H 1 2.060 . . . . . . . A 26 MET HE2 . 30597 1 262 . 1 1 26 26 MET HE3 H 1 2.060 . . . . . . . A 26 MET HE3 . 30597 1 263 . 1 1 26 26 MET CA C 13 60.727 . . . . . . . A 26 MET CA . 30597 1 264 . 1 1 26 26 MET CB C 13 36.631 . . . . . . . A 26 MET CB . 30597 1 265 . 1 1 26 26 MET CG C 13 33.969 . . . . . . . A 26 MET CG . 30597 1 266 . 1 1 26 26 MET CE C 13 19.429 . . . . . . . A 26 MET CE . 30597 1 267 . 1 1 27 27 CYS H H 1 8.441 . . . . . . . A 27 CYS H . 30597 1 268 . 1 1 27 27 CYS HA H 1 4.745 . . . . . . . A 27 CYS HA . 30597 1 269 . 1 1 27 27 CYS HB2 H 1 1.787 . . . . . . . A 27 CYS HB2 . 30597 1 270 . 1 1 27 27 CYS HB3 H 1 2.253 . . . . . . . A 27 CYS HB3 . 30597 1 271 . 1 1 27 27 CYS CA C 13 56.098 . . . . . . . A 27 CYS CA . 30597 1 272 . 1 1 27 27 CYS CB C 13 40.274 . . . . . . . A 27 CYS CB . 30597 1 273 . 1 1 28 28 SER H H 1 8.253 . . . . . . . A 28 SER H . 30597 1 274 . 1 1 28 28 SER HA H 1 4.364 . . . . . . . A 28 SER HA . 30597 1 275 . 1 1 28 28 SER HB2 H 1 3.568 . . . . . . . A 28 SER HB2 . 30597 1 276 . 1 1 28 28 SER HB3 H 1 3.275 . . . . . . . A 28 SER HB3 . 30597 1 277 . 1 1 28 28 SER CB C 13 65.541 . . . . . . . A 28 SER CB . 30597 1 278 . 1 1 29 29 PRO HA H 1 4.353 . . . . . . . A 29 PRO HA . 30597 1 279 . 1 1 29 29 PRO HB2 H 1 2.373 . . . . . . . A 29 PRO HB2 . 30597 1 280 . 1 1 29 29 PRO HB3 H 1 1.681 . . . . . . . A 29 PRO HB3 . 30597 1 281 . 1 1 29 29 PRO HG2 H 1 1.974 . . . . . . . A 29 PRO HG2 . 30597 1 282 . 1 1 29 29 PRO HG3 H 1 1.819 . . . . . . . A 29 PRO HG3 . 30597 1 283 . 1 1 29 29 PRO HD2 H 1 3.134 . . . . . . . A 29 PRO HD2 . 30597 1 284 . 1 1 29 29 PRO HD3 H 1 3.769 . . . . . . . A 29 PRO HD3 . 30597 1 285 . 1 1 29 29 PRO CA C 13 68.084 . . . . . . . A 29 PRO CA . 30597 1 286 . 1 1 29 29 PRO CB C 13 34.197 . . . . . . . A 29 PRO CB . 30597 1 287 . 1 1 29 29 PRO CG C 13 31.081 . . . . . . . A 29 PRO CG . 30597 1 288 . 1 1 29 29 PRO CD C 13 54.399 . . . . . . . A 29 PRO CD . 30597 1 289 . 1 1 30 30 LEU H H 1 7.599 . . . . . . . A 30 LEU H . 30597 1 290 . 1 1 30 30 LEU HA H 1 4.235 . . . . . . . A 30 LEU HA . 30597 1 291 . 1 1 30 30 LEU HB2 H 1 1.487 . . . . . . . A 30 LEU HB2 . 30597 1 292 . 1 1 30 30 LEU HB3 H 1 1.916 . . . . . . . A 30 LEU HB3 . 30597 1 293 . 1 1 30 30 LEU HG H 1 1.690 . . . . . . . A 30 LEU HG . 30597 1 294 . 1 1 30 30 LEU HD11 H 1 0.934 . . . . . . . A 30 LEU HD11 . 30597 1 295 . 1 1 30 30 LEU HD12 H 1 0.934 . . . . . . . A 30 LEU HD12 . 30597 1 296 . 1 1 30 30 LEU HD13 H 1 0.934 . . . . . . . A 30 LEU HD13 . 30597 1 297 . 1 1 30 30 LEU HD21 H 1 0.865 . . . . . . . A 30 LEU HD21 . 30597 1 298 . 1 1 30 30 LEU HD22 H 1 0.865 . . . . . . . A 30 LEU HD22 . 30597 1 299 . 1 1 30 30 LEU HD23 H 1 0.865 . . . . . . . A 30 LEU HD23 . 30597 1 300 . 1 1 30 30 LEU CA C 13 58.023 . . . . . . . A 30 LEU CA . 30597 1 301 . 1 1 30 30 LEU CB C 13 44.399 . . . . . . . A 30 LEU CB . 30597 1 302 . 1 1 30 30 LEU CG C 13 29.938 . . . . . . . A 30 LEU CG . 30597 1 303 . 1 1 30 30 LEU CD1 C 13 28.890 . . . . . . . A 30 LEU CD1 . 30597 1 304 . 1 1 30 30 LEU CD2 C 13 25.222 . . . . . . . A 30 LEU CD2 . 30597 1 305 . 1 1 31 31 GLU H H 1 7.895 . . . . . . . A 31 GLU H . 30597 1 306 . 1 1 31 31 GLU HA H 1 4.294 . . . . . . . A 31 GLU HA . 30597 1 307 . 1 1 31 31 GLU HB2 H 1 2.190 . . . . . . . A 31 GLU HB2 . 30597 1 308 . 1 1 31 31 GLU HB3 H 1 2.113 . . . . . . . A 31 GLU HB3 . 30597 1 309 . 1 1 31 31 GLU HG2 H 1 2.387 . . . . . . . A 31 GLU HG2 . 30597 1 310 . 1 1 31 31 GLU HG3 H 1 2.262 . . . . . . . A 31 GLU HG3 . 30597 1 311 . 1 1 31 31 GLU CA C 13 59.362 . . . . . . . A 31 GLU CA . 30597 1 312 . 1 1 31 31 GLU CB C 13 33.102 . . . . . . . A 31 GLU CB . 30597 1 313 . 1 1 31 31 GLU CG C 13 39.906 . . . . . . . A 31 GLU CG . 30597 1 314 . 1 1 32 32 ARG H H 1 7.664 . . . . . . . A 32 ARG H . 30597 1 315 . 1 1 32 32 ARG HA H 1 4.487 . . . . . . . A 32 ARG HA . 30597 1 316 . 1 1 32 32 ARG HB2 H 1 1.809 . . . . . . . A 32 ARG HB2 . 30597 1 317 . 1 1 32 32 ARG HB3 H 1 1.964 . . . . . . . A 32 ARG HB3 . 30597 1 318 . 1 1 32 32 ARG HG2 H 1 1.683 . . . . . . . A 32 ARG HG2 . 30597 1 319 . 1 1 32 32 ARG HG3 H 1 1.683 . . . . . . . A 32 ARG HG3 . 30597 1 320 . 1 1 32 32 ARG HD2 H 1 3.235 . . . . . . . A 32 ARG HD2 . 30597 1 321 . 1 1 32 32 ARG HD3 H 1 3.235 . . . . . . . A 32 ARG HD3 . 30597 1 322 . 1 1 32 32 ARG CA C 13 58.435 . . . . . . . A 32 ARG CA . 30597 1 323 . 1 1 32 32 ARG CB C 13 33.904 . . . . . . . A 32 ARG CB . 30597 1 324 . 1 1 32 32 ARG CG C 13 31.632 . . . . . . . A 32 ARG CG . 30597 1 325 . 1 1 32 32 ARG CD C 13 45.999 . . . . . . . A 32 ARG CD . 30597 1 326 . 1 1 33 33 SER H H 1 8.005 . . . . . . . A 33 SER H . 30597 1 327 . 1 1 33 33 SER HA H 1 4.304 . . . . . . . A 33 SER HA . 30597 1 328 . 1 1 33 33 SER HB2 H 1 3.876 . . . . . . . A 33 SER HB2 . 30597 1 329 . 1 1 33 33 SER HB3 H 1 3.876 . . . . . . . A 33 SER HB3 . 30597 1 330 . 1 1 33 33 SER CA C 13 62.666 . . . . . . . A 33 SER CA . 30597 1 331 . 1 1 33 33 SER CB C 13 67.466 . . . . . . . A 33 SER CB . 30597 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_1 _Spectral_peak_list.Entry_ID 30597 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 Height Volume P3HA-P3CA 4.470 66.995 1.60E+05 1.29E+06 bx P29HA-P29CA 4.366 68.084 1.03E+05 8.35E+05 bx P19HA-P19CA 4.511 65.671 1.05E+05 8.33E+05 bx S33QB-S33CB 3.870 67.466 4.98E+05 3.97E+06 bx A6QB-A6CB 1.458 20.893 3.65E+05 2.92E+06 bx M26QE-M26CE 2.068 19.429 3.53E+05 2.80E+06 bx Q4HA-Q4CA 4.211 60.433 1.59E+05 1.28E+06 bx Q5HB3-Q5CB 2.211 31.718 2.06E+05 1.67E+06 bx A6HA-A6CA 4.038 57.938 1.18E+05 9.60E+05 bx K7HA-K7CA 4.187 62.413 1.30E+05 1.12E+06 bx E11HA-E11CA 4.199 62.269 1.35E+05 1.12E+06 bx K7HB2-K7CB 1.952 35.111 1.30E+05 1.06E+06 bx K7HB3-K7CB 1.897 35.116 1.18E+05 9.47E+05 bx K7HG3-K7CG 1.524 27.500 9.74E+04 7.71E+05 bx K17QG-K17CG 1.405 27.533 3.62E+05 2.97E+06 bx K7HD3-K7CD 1.706 29.593 2.22E+05 1.85E+06 bx K7HD2-K7CD 1.670 29.609 2.42E+05 2.02E+06 bx K7HE2-K7CE 2.998 44.596 6.28E+05 5.05E+06 bx C9HB3-C9CB 3.262 38.800 6.40E+04 5.19E+05 bx Q4HB3-Q4CB 2.104 34.723 1.56E+05 1.26E+06 bx Q4HG3-Q4CG 2.431 34.737 1.28E+05 1.02E+06 bx C13HB3-C13CB 3.718 44.911 6.79E+04 5.54E+05 bx C13HB2-C13CB 3.469 44.891 7.67E+04 6.26E+05 bx Y8QB-Y8CB 3.136 40.646 1.60E+05 1.33E+06 bx Y10HA-Y10CA 4.219 65.873 7.21E+04 5.96E+05 bx Y10HB3-Y10CB 2.976 40.598 7.88E+04 6.36E+05 bx Y10HB2-Y10CB 3.127 40.641 1.55E+05 1.29E+06 bx E11HB2-E11CB 2.093 31.930 1.89E+05 1.57E+06 bx Q12HA-Q12CA 3.966 60.522 1.09E+05 8.81E+05 bx P3HB3-Q12CB 1.995 34.755 1.33E+05 1.08E+06 bx F20HB2-F20CB 3.369 42.039 1.03E+05 8.36E+05 bx F20HB3-F20CB 3.048 42.046 9.35E+04 7.58E+05 bx D21HB3-D21CB 2.730 41.990 1.99E+05 1.63E+06 bx D21HA-D21CA 4.277 59.942 1.38E+05 1.11E+06 bx Q22HG2-Q22CG 2.365 36.538 1.99E+05 1.75E+06 bx Q22HG3-Q22CG 2.429 36.534 4.38E+05 3.61E+06 bx Q22QB-Q22CB 2.021 31.333 2.40E+05 1.94E+06 bx Q22HA-Q22CA 4.095 60.974 1.41E+05 1.12E+06 bx C23HB3-C23CB 2.819 43.124 7.29E+04 6.03E+05 bx C23HB2-C23CB 3.192 43.128 5.56E+04 4.54E+05 bx Y24HB2-Y24CB 2.706 40.697 6.15E+04 4.84E+05 bx Y24HB3-Y24CB 2.911 40.688 5.97E+04 4.79E+05 bx Q25HA-Q25CA 3.878 61.302 1.38E+05 1.10E+06 bx Q25HG3-Q25CG 2.589 36.415 1.78E+05 1.42E+06 bx M26HG2-M26CG 2.580 33.969 1.58E+05 1.26E+06 bx M26HA-M26CA 4.159 60.727 1.56E+05 1.26E+06 bx C27HB2-C27CB 1.785 40.274 4.59E+04 3.66E+05 bx C27HA-C27CA 4.763 56.098 1.98E+05 1.63E+06 bx S28HB3-S28CB 3.276 65.534 6.93E+04 5.49E+05 bx S28HB2-S28CB 3.574 65.548 1.01E+05 8.04E+05 bx P29HB2-P29CB 2.380 34.195 1.09E+05 8.74E+05 bx P29HB3-P29CB 1.678 34.198 8.54E+04 6.99E+05 bx P29HG3-P29CG 1.822 31.081 7.62E+04 6.04E+05 bx P29HG2-P29CG 1.981 31.081 8.71E+04 7.16E+05 bx P29HD3-P29CD 3.780 54.398 1.15E+05 9.34E+05 bx P29HD2-P29CD 3.131 54.400 7.80E+04 6.25E+05 bx L30HA-L30CA 4.250 58.023 1.37E+05 1.11E+06 bx L30HB2-L30CB 1.501 44.396 1.13E+05 9.08E+05 bx L30HB3-L30CB 1.931 44.402 9.52E+04 7.74E+05 bx L30HG-L30CG 1.703 29.938 1.44E+05 1.20E+06 bx L30QD2-L30CD2 0.875 25.222 4.42E+05 3.53E+06 bx L30QD1-L30CD1 0.942 28.890 4.55E+05 3.65E+06 bx E31HB2-E31CB 2.173 33.100 1.25E+05 1.02E+06 bx E31HB3-E31CB 2.126 33.105 1.17E+05 9.62E+05 bx E31HA-E31CA 4.280 59.362 1.60E+05 1.31E+06 bx E31HG2-E31CG 2.390 39.900 1.31E+05 1.06E+06 bx E31HG3-E31CG 2.253 39.912 1.14E+05 9.29E+05 bx R32HA-R32CA 4.499 58.435 1.95E+05 1.56E+06 bx R32HB3-R32CB 1.966 33.904 1.35E+05 1.10E+06 bx R32HB2-R32CB 1.810 33.903 1.43E+05 1.17E+06 bx R32QG-R32CG 1.689 31.632 2.29E+05 1.86E+06 bx R32QD-R32CD 3.239 45.999 3.91E+05 3.17E+06 bx S33HA-S33CA 4.306 62.666 2.96E+05 2.40E+06 bx N14HB3-N14CB 3.017 41.021 1.57E+05 1.28E+06 bx N14HA-N14CA 4.654 58.779 1.24E+05 1.01E+06 bx V15HA-V15CA 3.752 68.517 1.24E+05 1.00E+06 bx V15QG2-V15CG2 1.080 24.846 4.23E+05 3.38E+06 bx V15QG1-V15CG1 0.965 23.578 5.78E+05 4.68E+06 bx N16HB3-N16CB 2.673 41.489 8.55E+04 6.76E+05 bx N16HB2-N16CB 2.962 41.475 1.14E+05 9.34E+05 bx N16HA-N16CA 4.796 58.970 7.09E+04 5.78E+05 bx K17HA-K17CA 4.030 59.558 1.70E+05 1.36E+06 bx K17HB2-K17CB 1.902 31.379 9.02E+04 7.32E+05 bx K17HB3-K17CB 2.106 31.366 1.26E+05 1.16E+06 bx K17QE-K17CE 3.053 44.844 5.31E+05 4.23E+06 bx K17HD2-K17CD 1.776 31.627 1.78E+05 1.43E+06 bx V18QG2-V18CG2 1.064 23.713 4.05E+05 3.26E+06 bx V18QG1-V18CG1 0.976 24.737 3.48E+05 2.77E+06 bx V18HB-V18CB 1.939 36.010 1.09E+05 8.80E+05 bx V18HA-V18CA 4.288 62.948 1.39E+05 1.13E+06 bx P19HB2-P19CB 2.512 35.562 1.38E+05 1.12E+06 bx P19HB3-P19CB 2.148 35.555 1.06E+05 8.53E+05 bx P19HD2-P19CD 3.680 53.995 1.11E+05 8.90E+05 bx P3HD2-P3CD 3.882 53.502 1.90E+05 1.54E+06 bx P3HD3-P3CD 3.843 53.503 1.93E+05 1.57E+06 bx S2HA-S2CA 4.860 58.971 1.71E+05 1.37E+06 bx S2QB-S2CB 3.980 66.013 2.43E+05 1.94E+06 bx Q5HA-Q5CA 4.252 60.665 1.66E+05 1.34E+06 bx P19HD3-P19CD 4.124 53.999 9.77E+04 7.88E+05 bx E11HG2-E11CG 2.502 39.139 1.45E+05 1.16E+06 bx E11HG3-E11CG 2.282 39.093 2.36E+05 1.97E+06 bx E11HB3-E11CB 2.276 31.924 1.13E+05 9.14E+05 bx M26HB2-M26CB 2.177 36.605 1.26E+05 1.03E+06 bx M26HB3-M26CB 2.073 36.656 1.74E+05 1.43E+06 bx Q25QB-Q25CB 2.176 31.080 2.92E+05 2.34E+06 bx A1QB-A1CB 1.286 24.994 5.74E+05 4.63E+06 bx A1HA-A1CA 3.590 55.213 2.05E+05 1.66E+06 bx P3HG2-P3CG 2.122 30.366 1.72E+05 1.42E+06 bx Q5QG-Q5CG 2.495 36.969 3.31E+05 2.66E+06 bx Q12HG3-Q12CG 2.134 30.744 2.09E+05 1.72E+06 bx V15HB-V15CB 2.098 31.177 2.61E+05 2.15E+06 bx P19QG-P19CG 2.101 30.749 1.39E+05 1.16E+06 bx F20HA-F20CA 4.195 65.568 9.24E+04 7.53E+05 bx ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 H . . 12.599 ppm . . . 0 . . 30597 1 2 . . H 1 H . . 12.599 ppm . . . 0 . . 30597 1 stop_ save_ save_spectral_peak_list_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_2 _Spectral_peak_list.Entry_ID 30597 _Spectral_peak_list.ID 2 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 6 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 Height Volume Y24QD-Y8CD1 7.161 135.920 1.98E+05 1.66E+06 bx Y8QE-Y8CE1 6.799 120.994 2.84E+05 2.31E+06 bx F20QD-F20CD1 7.323 134.801 1.53E+05 1.23E+06 bx Y24QE-Y24CE1 6.873 121.136 1.37E+05 1.10E+06 bx Y10QE-Y10CE1 6.547 120.264 1.34E+05 1.08E+06 bx Y10QD-Y10CD2 7.268 136.776 8.70E+04 7.00E+05 bx F20HZ-F20CZ 7.272 132.645 6.06E+04 4.84E+05 bx F20QE-F20CE1 7.313 134.065 1.34E+05 1.08E+06 bx ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 H . . 10.014 ppm . . . 0 . . 30597 2 2 . . H 1 H . . 10.014 ppm . . . 0 . . 30597 2 stop_ save_ save_spectral_peak_list_3 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_3 _Spectral_peak_list.Entry_ID 30597 _Spectral_peak_list.ID 3 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 7 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC aliphatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 Volume P3HA-P3HD2 4.470 3.839 7.57E+05 bx P3HA-P3HD3 4.469 3.894 5.51E+05 bx P3HA-P3HB2 4.469 2.426 5.63E+06 bx P3HD3-P3HB2 3.887 2.424 7.07E+05 bx P3HD2-P3HB2 3.837 2.428 4.78E+05 bx P3HA-P3HB3 4.469 2.001 3.17E+06 bx P3HD3-P3HB3 3.884 2.007 5.04E+05 bx P3HD2-P3HB3 3.834 2.000 1.21E+06 bx P3HB2-P3HB3 2.427 2.004 1.20E+07 bx P3HD3-P3HD2 3.893 3.829 1.23E+07 bx P19HA-P19HB2 4.508 2.510 8.15E+06 bx P19HA-P19HD2 4.506 3.679 9.26E+05 bx P19HA-P19HB3 4.507 2.147 3.40E+06 bx P19HD2-P19HB2 3.679 2.509 7.67E+05 bx P19HD2-P19HB3 3.678 2.142 3.70E+06 bx P29HD3-P29HB3 3.778 1.679 1.22E+06 bx P29HD3-P29HB2 3.781 2.381 1.09E+06 bx P29HA-P29HB2 4.371 2.382 6.21E+06 bx P29HA-P29HD3 4.366 3.776 1.17E+06 bx P29HB2-P29HB3 2.382 1.676 1.55E+07 bx Q4QG-Q4HA 2.429 4.211 2.16E+06 bx Q4QB-Q4HA 2.097 4.207 7.18E+06 bx Q4HA-Q4QG 4.211 2.428 2.95E+06 bx Q4HA-Q4QB 4.209 2.102 9.72E+06 bx Q4QG-Q4QB 2.427 2.095 6.64E+06 bx Q4QB-Q4QG 2.096 2.428 5.94E+06 bx Q5HA-Q5QB 4.252 2.216 6.33E+06 bx Q5HA-Q5QG 4.251 2.492 4.90E+06 bx Q5QG-Q5HA 2.493 4.249 3.95E+06 bx Q5QB-Q5HA 2.216 4.249 3.49E+06 bx Q5QG-Q5QB 2.492 2.216 6.30E+06 bx Q5QB-Q5QG 2.217 2.490 3.75E+06 bx A6HA-A6QB 4.042 1.459 7.07E+06 bx A6QB-A6HA 1.457 4.041 8.25E+06 bx Y10QE-A6QB 6.545 1.457 3.64E+06 bx Y10QD-A6QB 7.267 1.458 2.37E+06 bx K7HA-K7HB3 4.185 1.893 4.06E+06 bx K7HA-K7HB2 4.185 1.953 2.64E+06 bx K7HA-K7HD3 4.186 1.706 3.10E+05 bx K7HA-K7HD2 4.197 1.670 3.29E+05 bx K7HA-K7HG2 4.185 1.399 1.26E+06 bx K7HA-K7HG3 4.183 1.519 1.48E+06 bx K7HG3-K7HA 1.514 4.182 9.84E+05 bx K7HG2-K7HA 1.397 4.185 7.78E+05 bx K7HD2-K7HA 1.711 4.194 3.72E+05 bx K7HB2-K7HE2 1.946 2.998 2.66E+05 bx K7HB3-K7HE2 1.894 2.988 2.98E+05 bx K7HG3-K7HE2 1.515 2.999 6.34E+05 bx K7HG2-K7HE2 1.396 2.999 6.75E+05 bx K7HD2-K7HE2 1.717 2.994 1.59E+06 bx K7HD3-K7HE2 1.679 2.985 1.08E+06 bx K7HE2-K7HG2 2.996 1.401 9.39E+05 bx K7HE2-K7HG3 2.998 1.517 7.31E+05 bx K7HE2-K7HD3 2.997 1.720 2.75E+06 bx K7HE2-K7HB2 3.001 1.967 3.98E+05 bx K17QG-K17HB2 1.399 1.899 3.00E+06 bx K17QG-K17HD3 1.407 1.693 1.95E+06 bx L30HB2-L30HB3 1.499 1.926 1.52E+07 bx K7HE2-K7HB3 3.004 1.880 3.25E+05 bx K7HE2-K7HD2 2.984 1.681 1.88E+06 bx K7HG3-K7QD 1.513 1.701 1.93E+06 bx K7QD-K7HG3 1.703 1.508 1.35E+06 bx K17HD3-K17QG 1.693 1.405 2.07E+06 bx K7HA-K7HE2 4.188 2.994 1.10E+06 bx K7HB2-K7HB3 1.954 1.885 3.27E+06 bx K7HB3-K7HB2 1.889 1.959 2.59E+06 bx K7HB3-K7HD2 1.893 1.669 4.69E+05 bx K7HB3-K7HD3 1.892 1.706 3.08E+05 bx K7HB2-K7QD 1.948 1.683 1.72E+06 bx K7QD-K7HB2 1.683 1.947 1.69E+06 bx C9HA-C9HB2 4.083 2.829 4.84E+06 bx C9HA-C9HB3 4.084 3.257 2.54E+06 bx C9HB3-C9HB2 3.256 2.828 1.42E+07 bx C9HB2-C9HB3 2.833 3.256 1.33E+07 bx C9HB3-C9HA 3.255 4.081 1.86E+06 bx C9HB2-C9HA 2.829 4.083 3.87E+06 bx C13HA-C13HB2 4.080 3.468 3.36E+06 bx C13HA-C13HB3 4.080 3.720 3.02E+06 bx C13HB3-C13HB2 3.719 3.467 1.21E+07 bx C13HB2-C13HB3 3.468 3.718 1.22E+07 bx C13HB3-C13HA 3.722 4.079 2.38E+06 bx C13HB2-C13HA 3.469 4.078 2.85E+06 bx Y8QD-? 7.169 4.382 5.56E+06 bx ?-Y8HB2 4.383 3.099 4.89E+06 bx ?-Y8HB3 4.380 3.138 4.50E+06 bx Y8HB3-? 3.144 4.382 3.71E+06 bx Y8HB2-? 3.099 4.382 2.97E+06 bx Y8HB2-Y8HB3 3.097 3.151 1.01E+07 bx Y8HB3-Y8HB2 3.151 3.083 8.22E+06 bx Y8QD-Y8QE 7.168 6.799 1.98E+07 bx Y8QE-Y8QD 6.800 7.169 2.13E+07 bx Y8QE-? 6.800 4.382 6.37E+05 bx Y8QE-Y8HB3 6.801 3.100 6.93E+05 bx Y8QE-Y8HB2 6.797 3.152 6.04E+05 bx Y8QE-E11HB2 6.798 2.070 1.68E+06 bx Y8QE-Q12HB3 6.797 1.967 8.98E+05 bx Y10QD-Y10HA 7.267 4.215 6.25E+06 bx Y8QD-Y8HB3 7.169 3.097 6.49E+06 bx Y8QD-Y8HB2 7.169 3.147 6.02E+06 bx Y8QD-Q12HB3 7.170 1.959 5.30E+05 bx Y8QD-E11HB2 7.169 2.080 8.59E+05 bx ?-Y8QD 4.384 7.170 4.68E+06 bx Y8HB2-Y8QD 3.147 7.169 4.14E+06 bx Y8HB3-Y8QD 3.097 7.170 4.16E+06 bx Y8QD-Q5HA 7.169 4.247 1.24E+06 bx Y8QD-C9HA 7.167 4.082 9.16E+05 bx Y10HA-Y10HB3 4.218 2.974 2.25E+06 bx Y10HA-Y10HB2 4.219 3.127 3.72E+06 bx Y10HB3-Y10HB2 2.972 3.126 1.48E+07 bx Y10HB2-Y10HB3 3.121 2.971 1.48E+07 bx Y10HB2-Y10HA 3.121 4.217 2.95E+06 bx Y10HB3-Y10HA 2.974 4.219 1.58E+06 bx Y10QD-Y10HB2 7.267 3.126 6.54E+06 bx Y10QD-Y10HB3 7.268 2.973 6.87E+06 bx Y10QD-Y10QE 7.267 6.545 1.86E+07 bx Y10QE-Y10HB3 6.544 2.973 6.95E+05 bx Y10QE-Y10HB2 6.543 3.127 6.45E+05 bx Y10QD-A6HA 7.266 4.050 8.42E+05 bx Y10QD-C9HB3 7.267 3.197 9.85E+05 bx Y10QD-C9HB2 7.269 2.820 5.78E+05 bx Y10QD-C27HB3 7.268 2.251 9.25E+05 bx Y10QD-C27HB2 7.265 1.789 5.48E+05 bx Y10QE-C27HB2 6.545 1.786 1.20E+06 bx Y10QE-Y24HB2 6.545 2.707 6.49E+05 bx Y10QE-C27HB3 6.545 2.247 1.82E+06 bx E11HA-E11HG3 4.200 2.278 5.72E+06 bx E11HA-E11HB2 4.199 2.092 7.52E+06 bx E11HB2-E11HG3 2.094 2.275 1.55E+07 bx E11HG3-E11HB2 2.275 2.092 1.55E+07 bx E11HG2-E11HB2 2.498 2.091 4.44E+06 bx E11HG2-E11HG3 2.497 2.282 8.88E+06 bx E11HG3-E11HG2 2.283 2.499 8.53E+06 bx E11HG3-E11HA 2.275 4.199 4.39E+06 bx E11HG2-E11HA 2.499 4.200 1.09E+06 bx E11HB2-E11HA 2.091 4.199 5.99E+06 bx Q12HB3-Q12HA 1.961 3.964 1.15E+06 bx Q12HG3-Q12HA 2.106 3.966 4.32E+06 bx F20QD-F20HB3 7.322 3.043 6.67E+06 bx F20QD-F20HB2 7.322 3.367 6.14E+06 bx F20QD-F20HA 7.322 4.192 3.95E+06 bx F20QD-D21HA 7.322 4.276 1.69E+06 bx F20QD-Y24HB2 7.319 2.712 9.36E+05 bx D21HA-F20QD 4.276 7.320 1.87E+06 bx F20HA-F20QD 4.194 7.322 3.05E+06 bx F20HB2-F20QD 3.366 7.322 4.07E+06 bx F20HB3-F20QD 3.044 7.322 4.29E+06 bx F20HA-F20HB2 4.193 3.367 4.76E+06 bx F20HA-F20HB3 4.196 3.045 3.46E+06 bx F20HB2-F20HB3 3.366 3.043 1.62E+07 bx F20HB3-F20HB2 3.043 3.367 1.57E+07 bx D21HA-D21HB2 4.276 2.735 1.09E+07 bx D21HB2-D21HB3 2.728 2.665 1.58E+07 bx D21HB2-D21HA 2.729 4.274 5.44E+06 bx D21HB3-D21HA 2.676 4.274 3.69E+06 bx Q22HA-Q22QB 4.092 2.020 8.99E+06 bx Q22HA-Q22HG2 4.091 2.360 2.67E+06 bx Q22HA-Q22HG3 4.092 2.436 2.19E+06 bx Q22HG3-Q22HA 2.432 4.091 1.57E+06 bx Q22QB-Q22HA 2.021 4.091 7.13E+06 bx Q22QB-Q22HG2 2.023 2.359 3.65E+06 bx P3HB3-P3HB2 2.003 2.428 1.08E+07 bx Q22HG2-Q22HG3 2.364 2.440 3.72E+06 bx Q22HG3-Q22HG2 2.432 2.354 2.92E+06 bx Q22HG2-Q22QB 2.363 2.021 3.39E+06 bx C23HA-C23HB3 4.049 2.816 3.73E+06 bx C23HA-C23HB2 4.055 3.195 2.53E+06 bx C23HB3-C23HB2 2.813 3.194 1.30E+07 bx C23HB2-C23HB3 3.194 2.813 1.37E+07 bx C23HB2-C23HA 3.194 4.054 2.07E+06 bx C23HB3-C23HA 2.818 4.052 4.09E+06 bx Y24QD-Y24HB2 7.150 2.707 6.56E+06 bx Y24QD-Y24HB3 7.150 2.907 6.71E+06 bx Y24HA-Y24HB2 4.060 2.707 4.25E+06 bx Y24HA-Y24HB3 4.056 2.905 1.91E+06 bx Y24HB2-Y24HB3 2.710 2.907 1.36E+07 bx Y24HB3-Y24HA 2.907 4.058 1.72E+06 bx Y24HB2-Y24HA 2.708 4.058 3.20E+06 bx Y24QD-Y24HA 7.150 4.058 3.67E+06 bx Y24QD-Q25HA 7.151 3.874 1.65E+06 bx Y10QE-Y24HA 6.545 4.058 3.89E+06 bx Y24QD-Y24QE 7.149 6.874 2.09E+07 bx Y24QD-Y10QE 7.149 6.545 1.36E+06 bx Y24QE-Y24QD 6.875 7.149 2.27E+07 bx Y10QE-Y24QD 6.543 7.148 1.10E+06 bx Y10QE-Y10QD 6.545 7.267 1.94E+07 bx Y24QD-S28HB2 7.150 3.570 7.20E+05 bx Y24QD-S28HB3 7.151 3.277 1.08E+06 bx Y24QD-Q25HG3 7.150 2.586 5.75E+05 bx Y10QE-Y24HB3 6.545 2.908 3.42E+05 bx Y24QE-Y24HA 6.874 4.061 5.57E+05 bx Y24QE-Q25HA 6.878 3.875 3.31E+05 bx Y24QE-S28HB2 6.875 3.572 1.09E+06 bx Y24QE-S28HB3 6.873 3.274 1.22E+06 bx Y24QE-Y24HB3 6.877 2.908 7.03E+05 bx Y24QE-Y24HB2 6.875 2.707 5.65E+05 bx P29HD3-P29HD2 3.779 3.127 1.73E+07 bx S28HB2-S28HB3 3.567 3.276 1.53E+07 bx Q25HA-Q25HG3 3.876 2.590 1.47E+06 bx Q25HA-Q25QB 3.874 2.172 8.88E+06 bx M26HG2-M26HG3 2.578 2.497 1.37E+07 bx M26HG2-M26HB2 2.584 2.175 5.03E+06 bx M26HB2-Q25HG3 2.174 2.587 6.40E+06 bx Q25HG2-Q25HA 2.583 3.874 8.65E+05 bx Q25QB-Q25HA 2.173 3.873 7.46E+06 bx M26HA-M26QE 4.159 2.070 4.17E+06 bx M26HA-M26HB2 4.159 2.173 4.51E+06 bx M26HB2-M26HA 2.173 4.158 2.63E+06 bx M26QE-M26HA 2.072 4.159 3.03E+06 bx M26HB2-M26QE 2.174 2.070 3.07E+06 bx M26QE-M26HB2 2.079 2.181 2.10E+06 bx C27HB3-C27HB2 2.242 1.788 8.47E+06 bx C27HA-C27HB2 4.744 1.797 3.83E+05 bx C27HA-C27HB3 4.748 2.249 8.03E+05 bx C27HB2-C27HB3 1.789 2.246 8.32E+06 bx S28HA-S28HB3 4.380 3.276 7.01E+06 bx S28HA-S28HB2 4.380 3.571 8.57E+06 bx S28HB3-S28HB2 3.279 3.571 1.45E+07 bx S28HB2-S28HA 3.567 4.379 4.93E+06 bx S28HB3-S28HA 3.276 4.378 3.83E+06 bx P29HA-P29HG3 4.365 1.822 2.22E+06 bx P29HD3-P29HG3 3.780 1.823 3.96E+06 bx P29HA-P29HB3 4.365 1.679 3.35E+06 bx P29HA-P29HG2 4.365 1.979 1.31E+06 bx P29HD3-P29HG2 3.780 1.981 3.83E+06 bx P29HD2-P29HD3 3.127 3.778 1.49E+07 bx P29HB2-P29HD3 2.382 3.777 8.76E+05 bx P29HG2-P29HD3 1.981 3.778 3.38E+06 bx P29HG3-P29HD3 1.823 3.779 2.92E+06 bx P29HB3-P29HD3 1.683 3.777 9.05E+05 bx P29HD2-P29HG2 3.128 1.981 3.11E+06 bx P29HD2-P29HG3 3.127 1.822 1.81E+06 bx P29HD2-P29HB3 3.127 1.679 1.78E+06 bx P29HD2-P29HB2 3.127 2.382 7.12E+05 bx P29HB2-P29HD2 2.382 3.126 8.20E+05 bx P29HG2-P29HD2 1.981 3.127 3.00E+06 bx P29HG3-P29HD2 1.824 3.127 1.58E+06 bx P29HB3-P29HD2 1.677 3.128 1.29E+06 bx P29HB2-P29HG3 2.381 1.822 3.17E+06 bx P29HB2-P29HG2 2.379 1.978 3.55E+06 bx P29HG2-P29HB2 1.979 2.382 3.48E+06 bx P29HG3-P29HB2 1.821 2.381 2.70E+06 bx P29HB3-P29HB2 1.676 2.382 1.35E+07 bx P29HG2-P29HG3 1.977 1.820 1.96E+07 bx P29HG2-P29HB3 1.981 1.677 3.14E+06 bx R32QG-R32HB2 1.686 1.817 1.99E+06 bx R32HB2-R32QG 1.814 1.683 2.25E+06 bx L30HA-L30HB3 4.244 1.923 2.22E+06 bx L30HA-L30HG 4.247 1.696 2.05E+06 bx L30HA-L30HB2 4.247 1.499 4.77E+06 bx L30HA-L30QD1 4.248 0.940 1.00E+06 bx L30HA-L30QD2 4.247 0.871 6.80E+06 bx L30QD2-L30HA 0.871 4.244 8.33E+06 bx L30QD1-L30HA 0.939 4.245 1.37E+06 bx L30HB2-L30HA 1.499 4.245 4.06E+06 bx L30HG-L30HA 1.695 4.244 1.84E+06 bx L30HB3-L30HA 1.926 4.245 2.00E+06 bx L30HG-L30HB3 1.694 1.923 1.78E+06 bx L30QD1-L30HB3 0.939 1.926 4.32E+06 bx L30QD2-L30HB3 0.871 1.929 1.78E+06 bx L30QD1-L30HG 0.939 1.699 5.98E+06 bx L30QD2-L30HG 0.872 1.698 6.09E+06 bx L30QD1-L30HB2 0.939 1.501 3.91E+06 bx L30QD2-L30HB2 0.872 1.502 3.23E+06 bx L30HB3-L30HB2 1.927 1.499 1.46E+07 bx L30HB3-L30HG 1.924 1.697 1.36E+06 bx L30HB3-L30QD1 1.928 0.946 3.33E+06 bx L30HB3-L30QD2 1.926 0.871 1.16E+06 bx L30HG-L30QD1 1.698 0.940 4.04E+06 bx L30HG-L30QD2 1.697 0.871 4.58E+06 bx L30HB2-L30QD2 1.499 0.870 2.36E+06 bx L30HB2-L30QD1 1.499 0.938 2.99E+06 bx L30HG-L30HB2 1.696 1.499 1.21E+06 bx L30HB2-L30HG 1.500 1.696 1.27E+06 bx E31HA-E31HG3 4.280 2.252 2.64E+06 bx E31HA-E31HG2 4.278 2.381 1.52E+06 bx E31HA-E31HB2 4.281 2.169 3.91E+06 bx E31HA-E31HB3 4.280 2.117 3.97E+06 bx E31HG2-E31HA 2.383 4.277 1.20E+06 bx E31HG3-E31HA 2.250 4.279 2.06E+06 bx E31HB2-E31HA 2.172 4.278 2.65E+06 bx E31HB3-E31HA 2.122 4.278 2.28E+06 bx E31HG2-E31HG3 2.385 2.250 1.19E+07 bx E31HG3-E31HG2 2.251 2.385 1.13E+07 bx E31HB3-E31HG2 2.121 2.386 1.49E+06 bx E31HG2-E31HB3 2.375 2.123 1.57E+06 bx E31HG3-E31HB3 2.251 2.118 1.25E+06 bx R32HA-R32QG 4.496 1.682 2.09E+06 bx R32HA-R32HB2 4.495 1.807 2.25E+06 bx R32HA-R32HB3 4.499 1.972 1.86E+06 bx R32HB3-R32HA 1.966 4.495 1.40E+06 bx R32HB2-R32HA 1.819 4.495 1.01E+06 bx R32QG-R32HA 1.686 4.493 1.04E+06 bx R32QG-R32QD 1.688 3.244 1.90E+06 bx R32HB2-R32QD 1.806 3.242 7.66E+05 bx R32HB3-R32QD 1.966 3.239 6.93E+05 bx R32QD-R32HB3 3.257 1.967 5.68E+05 bx R32QD-R32HB3 3.237 1.961 6.29E+05 bx R32QD-R32HB2 3.231 1.808 4.80E+05 bx R32QD-R32HB2 3.257 1.802 6.90E+05 bx R32QD-R32QG 3.230 1.691 1.32E+06 bx R32QD-R32QG 3.248 1.684 1.48E+06 bx R32HB2-R32HB3 1.821 1.967 1.68E+07 bx R32HB3-R32HB2 1.966 1.821 1.55E+07 bx R32HB3-R32QG 1.966 1.687 2.53E+06 bx R32QG-R32HB3 1.685 1.966 2.47E+06 bx R32HA-R32QD 4.503 3.254 7.22E+05 bx R32QD-R32HA 3.252 4.499 4.67E+05 bx S33QB-S33HA 3.877 4.309 2.04E+06 bx S33HA-S33QB 4.308 3.883 4.59E+06 bx N14HA-N14HB2 4.649 3.016 3.83E+06 bx N14HB2-N14HA 3.019 4.644 1.35E+06 bx V15HA-V15HB 3.750 2.104 3.39E+06 bx V15HA-V15QG1 3.751 0.962 5.97E+06 bx V15HA-V15QG2 3.751 1.080 7.68E+06 bx V15HB-V15HA 2.104 3.749 2.32E+06 bx V15QG2-V15HA 1.080 3.750 7.78E+06 bx V15QG1-V15HA 0.962 3.750 5.76E+06 bx V15HB-V15QG2 2.103 1.080 5.39E+06 bx V15HB-V15QG1 2.104 0.962 5.70E+06 bx V15QG2-V15HB 1.080 2.103 8.23E+06 bx V15QG1-V15HB 0.963 2.105 8.25E+06 bx V15QG2-V15QG1 1.076 0.963 8.16E+06 bx V15QG1-V15QG2 0.964 1.076 1.10E+07 bx N16HA-N16HB3 4.776 2.653 4.87E+05 bx N16HA-N16HB2 4.774 2.958 7.78E+05 bx N16HB3-N16HB2 2.671 2.959 1.46E+07 bx N16HB2-N16HB3 2.961 2.673 1.28E+07 bx K17HA-K17QG 4.027 1.403 3.32E+06 bx K17HA-K17HD2 4.030 1.773 8.83E+05 bx K17HA-K17HD3 4.030 1.693 5.85E+05 bx K17HA-K17HB2 4.030 1.907 7.43E+06 bx K17HA-K17HB3 4.027 2.105 3.32E+06 bx K17HA-K17QE 4.029 3.052 3.96E+05 bx K17HB3-K17HA 2.102 4.028 2.32E+06 bx K17HB2-K17HA 1.907 4.027 5.88E+06 bx K17HD2-K17HA 1.774 4.032 7.87E+05 bx K17HD3-K17HA 1.697 4.031 7.26E+05 bx K17QG-K17HA 1.406 4.028 2.05E+06 bx K17HE3-K17HB3 3.049 2.104 3.51E+05 bx K17QE-K17HB2 3.054 1.910 3.70E+05 bx K17QE-K17HD3 3.051 1.691 2.52E+06 bx K17QE-K17HD2 3.036 1.774 1.41E+06 bx K17QE-K17QG 3.051 1.404 7.23E+05 bx K17HB3-K17QE 2.099 3.052 3.03E+05 bx K17HD2-K17QE 1.775 3.034 1.18E+06 bx K17HD3-K17QE 1.693 3.055 1.88E+06 bx K17QG-K17QE 1.402 3.052 5.39E+05 bx K17QG-K17HB3 1.418 2.102 1.98E+06 bx K17HB2-K17HB3 1.906 2.103 1.54E+07 bx K17HD3-K17HB3 1.694 2.102 5.22E+05 bx K17HB3-K17HB2 2.103 1.905 1.50E+07 bx K17HB3-K17HD3 2.102 1.692 4.90E+05 bx K17HB3-K17QG 2.103 1.416 2.39E+06 bx K17HD2-K17HB2 1.774 1.915 1.89E+06 bx K17HD3-K17HB2 1.693 1.908 1.43E+06 bx K17QG-K17HD2 1.390 1.772 8.59E+05 bx K17HD2-K17QG 1.763 1.400 1.15E+06 bx V18HA-V18QG1 4.285 0.973 6.01E+06 bx V18HA-V18QG2 4.285 1.063 5.97E+06 bx V18HA-V18HB 4.286 1.941 2.35E+06 bx V18HB-V18HA 1.943 4.284 1.66E+06 bx V18QG2-V18HA 1.063 4.284 5.92E+06 bx V18QG1-V18HA 0.973 4.284 6.61E+06 bx V18QG2-V18HB 1.063 1.940 6.74E+06 bx V18QG1-V18HB 0.973 1.941 7.65E+06 bx V18HB-V18QG1 1.940 0.972 5.19E+06 bx V18HB-V18QG2 1.941 1.063 5.14E+06 bx V18QG1-V18QG2 0.973 1.064 7.31E+06 bx V18QG2-V18QG1 1.063 0.973 5.82E+06 bx P19HD2-P19HA 3.680 4.506 3.05E+05 bx P19HB2-P19HA 2.510 4.505 5.01E+06 bx P19HB3-P19HA 2.148 4.504 1.75E+06 bx P19QG-P19HA 2.102 4.504 9.32E+05 bx P19HA-P19QG 4.509 2.105 1.88E+06 bx P19HD2-P19QG 3.679 2.102 1.97E+06 bx P19QG-P19HD2 2.099 3.676 1.48E+06 bx P19HB3-P19HD2 2.145 3.678 3.06E+06 bx P19HB2-P19HD2 2.507 3.678 6.09E+05 bx P19HB2-P19QG 2.507 2.103 4.16E+06 bx P19HB2-P19HB3 2.509 2.152 1.42E+07 bx P19HB3-P19HB2 2.151 2.509 1.16E+07 bx P19QG-P19HB2 2.098 2.505 4.41E+06 bx P3HA-P3HG2 4.469 2.090 1.47E+06 bx P3HD2-P3HD3 3.834 3.900 8.63E+06 bx P3HB2-P3HA 2.428 4.466 3.65E+06 bx P3HB3-P3HA 2.000 4.466 1.67E+06 bx P3HB3-P3HD2 2.007 3.833 8.43E+05 bx P3HB2-P3HD3 2.430 3.895 5.60E+05 bx P3HB2-P3HD2 2.431 3.835 4.65E+05 bx P3HG2-P3HD3 2.133 3.894 7.35E+05 bx P3HG2-P3HD2 2.134 3.833 1.84E+06 bx P3HD2-P3HG2 3.834 2.134 2.21E+06 bx S2HA-S2QB 4.860 3.973 2.97E+06 bx S2HA-P3HD3 4.860 3.890 3.11E+06 bx S2HA-P3HD2 4.860 3.834 2.19E+06 bx S2QB-S2HA 3.982 4.868 4.57E+05 bx P3HD3-S2HA 3.891 4.871 8.78E+05 bx P3HD2-S2HA 3.835 4.869 6.28E+05 bx P19HD3-V18QG1 4.125 0.972 6.47E+05 bx P19HD3-V18QG2 4.122 1.063 2.17E+06 bx P19HD2-V18QG1 3.677 0.975 8.73E+05 bx P19HD2-V18QG2 3.678 1.063 4.51E+06 bx P19HD3-P19HB3 4.122 2.136 2.95E+06 bx P19HD3-P19QG 4.121 2.104 2.82E+06 bx P19HD3-P19HD2 4.121 3.677 1.68E+07 bx P19HA-P19HD3 4.506 4.121 1.31E+06 bx P19HD3-P19HA 4.123 4.506 4.34E+05 bx P19HD2-P19HD3 3.678 4.120 1.60E+07 bx P19HD3-P19HB2 4.124 2.511 5.93E+05 bx P19HB2-P19HD3 2.508 4.119 8.15E+05 bx P19HB3-P19HD3 2.140 4.119 2.19E+06 bx P19QG-P19HD3 2.100 4.119 2.25E+06 bx V18HA-P19HD2 4.285 3.677 7.52E+06 bx Q12HA-V15QG2 3.967 1.080 4.44E+06 bx Q12HA-V15QG1 3.965 0.963 1.55E+06 bx ?-E11HB2 4.383 2.094 2.11E+06 bx ?-E11HB3 4.383 2.268 4.07E+06 bx Q5HA-Y8HB3 4.250 3.094 1.85E+06 bx Q5HA-Y8HB2 4.253 3.150 1.16E+06 bx E11HB3-? 2.274 4.383 2.33E+06 bx E11HB2-? 2.096 4.381 1.32E+06 bx P29HB2-P29HA 2.382 4.366 5.43E+06 bx P29HG3-P29HA 1.822 4.364 1.65E+06 bx P29HB3-P29HA 1.681 4.364 2.28E+06 bx P29HG2-P29HA 1.979 4.366 1.08E+06 bx P29HD3-S28HA 3.779 4.372 1.76E+06 bx F20HA-C23HB2 4.192 3.193 3.40E+06 bx F20HA-C23HB3 4.194 2.814 2.60E+06 bx Y10HA-C13HB2 4.218 3.468 1.24E+06 bx C23HB2-F20HA 3.194 4.192 2.59E+06 bx C23HB3-F20HA 2.812 4.192 1.91E+06 bx Y24HB3-D21HA 2.909 4.275 1.92E+06 bx D21HA-Y24HB3 4.276 2.908 2.85E+06 bx Y8HB2-Q5HA 3.149 4.251 1.22E+06 bx Y8HB3-Q5HA 3.097 4.251 1.73E+06 bx D21HA-D21HB3 4.275 2.671 3.52E+06 bx P19HD2-V18HA 3.678 4.284 6.05E+06 bx P19HD3-V18HA 4.121 4.284 9.09E+06 bx V18HA-P19HD3 4.285 4.120 1.19E+07 bx C13HB2-C23HB2 3.470 3.193 7.83E+05 bx C13HB2-C23HB3 3.468 2.812 1.27E+06 bx C13HB2-V18HB 3.468 1.940 2.92E+06 bx C13HB2-V18QG2 3.464 1.061 8.60E+05 bx C13HB2-V18QG1 3.468 0.973 8.91E+05 bx C23HB2-C13HB2 3.193 3.468 5.14E+05 bx C13HB3-C23HB3 3.720 2.815 5.47E+05 bx C13HB3-C23HB2 3.720 3.188 3.77E+05 bx C23HB2-C13HB3 3.195 3.715 3.43E+05 bx C23HB3-C13HB3 2.816 3.715 6.39E+05 bx C23HB3-C13HB2 2.818 3.466 1.03E+06 bx C13HB3-V18HB 3.719 1.941 1.16E+06 bx C13HA-V18HB 4.081 1.942 3.81E+06 bx C23HB2-V18HB 3.197 1.937 4.02E+05 bx V18HB-C13HB3 1.941 3.719 9.87E+05 bx V18HB-C13HB2 1.941 3.466 2.50E+06 bx V18HB-C13HA 1.941 4.079 2.88E+06 bx C23HB3-V18HB 2.821 1.938 9.00E+05 bx V18HB-C23HB3 1.944 2.813 8.84E+05 bx C9HB3-C27HB3 3.256 2.248 1.31E+06 bx C9HB2-C27HB3 2.834 2.250 6.40E+05 bx C27HB3-C9HB2 2.255 2.829 6.32E+05 bx C27HB3-C9HB3 2.255 3.254 1.29E+06 bx C9HB3-L30QD1 3.255 0.939 1.84E+06 bx C9HB2-L30QD1 2.830 0.939 3.18E+06 bx C9HB3-A6QB 3.257 1.456 7.68E+05 bx A6HA-L30QD1 4.041 0.939 3.65E+06 bx A6HA-C9HB3 4.041 3.256 3.12E+06 bx A6QB-C9HB3 1.457 3.256 7.26E+05 bx L30QD1-C9HB2 0.938 2.827 3.79E+06 bx L30QD1-C9HB3 0.938 3.256 2.07E+06 bx L30QD1-A6HA 0.939 4.040 3.56E+06 bx A6HA-E31HG3 4.044 2.247 7.99E+05 bx E31HA-A6QB 4.278 1.457 2.34E+06 bx P3HA-A6QB 4.469 1.458 1.87E+06 bx L30HB2-A6HA 1.501 4.042 8.72E+05 bx E31HG3-A6HA 2.240 4.044 7.45E+05 bx C9HB3-A6HA 3.256 4.041 2.55E+06 bx E31HG3-A6QB 2.252 1.457 1.99E+06 bx A6QB-E31HG3 1.457 2.249 2.84E+06 bx E11HA-E11HG2 4.202 2.500 1.65E+06 bx Y24HA-M26HB3 4.057 2.069 2.05E+06 bx C23HA-Q25QB 4.052 2.173 1.44E+06 bx A1HA-A1QB 3.596 1.292 1.70E+06 bx A1QB-A1HA 1.295 3.595 1.35E+06 bx P3HG2-P3HB3 2.134 2.004 1.43E+07 bx P3HB3-P3HG2 2.007 2.134 1.40E+07 bx A6QB-P3HA 1.458 4.467 1.64E+06 bx Q4HA-K7HB3 4.214 1.890 1.00E+06 bx Y8QD-Q5QB 7.168 2.204 4.16E+05 bx Y8QD-Q5QG 7.169 2.492 4.29E+05 bx A6QB-E31HA 1.457 4.278 2.43E+06 bx E31HG2-A6QB 2.382 1.457 1.18E+06 bx A6QB-E31HG2 1.456 2.385 1.52E+06 bx K7HA-A6QB 4.187 1.457 3.89E+05 bx K7HA-Y10HB3 4.185 2.975 1.54E+06 bx A6QB-K7HA 1.455 4.185 4.49E+05 bx ?-A6QB 4.380 1.458 5.63E+05 bx Y8QD-E11HB3 7.170 2.274 5.60E+05 bx ?-Y8QE 4.384 6.799 5.13E+05 bx Q12QG-Y8QE 2.070 6.799 8.50E+05 bx Q12QG-Y8QD 2.062 7.161 4.33E+05 bx N16HB3-C13HA 2.671 4.085 1.14E+06 bx C13HA-N16HB3 4.084 2.672 1.03E+06 bx C13HA-N16HB2 4.087 2.962 5.42E+05 bx N16HB2-C13HA 2.969 4.084 4.77E+05 bx C13HA-V18QG1 4.082 0.972 5.01E+06 bx Y10HA-C13HB3 4.216 3.719 1.74E+06 bx C13HB2-Y10HA 3.469 4.214 7.60E+05 bx C13HB3-Y10HA 3.718 4.216 1.26E+06 bx Y10QE-P29HB2 6.544 2.386 9.24E+05 bx Y10QE-? 6.545 4.379 9.72E+05 bx Y10QE-Y10HA 6.548 4.211 6.90E+05 bx E11HG2-Q12HA 2.495 3.971 5.32E+05 bx E11HG3-Q12HA 2.276 3.963 3.14E+05 bx Q12HA-E11HG2 3.971 2.496 5.01E+05 bx E11HB2-E11HG2 2.092 2.499 3.96E+06 bx V15QG2-Q12HA 1.080 3.966 5.02E+06 bx V15QG1-Q12HA 0.963 3.966 1.61E+06 bx V18QG2-C13HB2 1.063 3.467 8.26E+05 bx V18QG1-C13HB2 0.973 3.470 1.02E+06 bx V18QG1-C13HA 0.973 4.081 5.30E+06 bx N14HB2-V15QG2 3.019 1.079 4.96E+05 bx V18QG2-N14HB2 1.078 3.011 6.46E+05 bx N14HA-K17HA 4.651 4.025 1.09E+06 bx N16HB3-V18QG1 2.671 0.972 3.66E+06 bx V18QG1-N16HB3 0.972 2.671 4.16E+06 bx V18QG1-N16HB2 0.972 2.958 2.79E+06 bx N16HB2-V18QG1 2.958 0.973 2.57E+06 bx K17HB2-K17HD2 1.913 1.771 2.03E+06 bx C23HA-V18QG2 4.056 1.063 2.81E+06 bx C23HB2-V18QG2 3.194 1.063 9.51E+05 bx C23HB3-V18QG2 2.817 1.063 2.20E+06 bx Q22HG2-V18QG2 2.364 1.065 6.99E+05 bx P19HD2-V18HB 3.677 1.942 6.49E+05 bx P19HD2-Q22QB 3.678 2.021 2.33E+06 bx V18QG2-P19HD2 1.063 3.677 5.02E+06 bx V18QG1-P19HD2 0.973 3.677 8.47E+05 bx V18QG2-C23HB2 1.062 3.195 1.14E+06 bx V18QG2-P19HD3 1.063 4.118 2.38E+06 bx V18QG2-C23HA 1.063 4.057 3.12E+06 bx V18QG2-C23HB3 1.063 2.813 2.62E+06 bx V18QG2-Q22QB 1.063 2.022 8.25E+06 bx Q22QB-V18QG2 2.022 1.063 6.69E+06 bx Q22QB-V18QG1 2.019 0.969 4.92E+05 bx V18QG1-Q22QB 0.970 2.021 5.65E+05 bx P19HA-V18QG2 4.510 1.060 5.18E+05 bx P19HA-F20HB2 4.505 3.361 5.12E+05 bx Q22QB-P19HD2 2.022 3.678 2.17E+06 bx P19HB2-V18QG2 2.504 1.074 6.18E+05 bx C27HA-L30QD1 4.750 0.938 7.42E+05 bx P19HB3-V18QG2 2.146 1.057 6.49E+05 bx M26QE-V18QG2 2.067 1.061 2.66E+06 bx V18QG2-P19HB3 1.063 2.151 9.74E+05 bx F20HB2-F20HA 3.367 4.193 4.07E+06 bx F20HB3-F20HA 3.047 4.193 2.59E+06 bx Y24QD-D21HA 7.152 4.275 6.10E+05 bx F20QD-C23HB3 7.320 2.811 5.05E+05 bx F20QD-C23HB2 7.322 3.193 4.90E+05 bx Q22HA-Q25QB 4.092 2.171 4.71E+06 bx Q22HA-Q25HG3 4.091 2.590 6.63E+05 bx Q25HG3-Q22HA 2.592 4.090 5.65E+05 bx Q25QB-Q22HA 2.172 4.090 3.58E+06 bx Q22HG3-V18QG2 2.430 1.061 3.83E+05 bx V18QG2-Q22HG2 1.062 2.360 8.10E+05 bx V18QG2-Q22HG3 1.062 2.435 5.54E+05 bx C23HA-Q25HG3 4.051 2.584 4.59E+05 bx V18HB-C23HB2 1.938 3.196 3.72E+05 bx M26HB3-Y24HA 2.067 4.056 2.37E+06 bx C27HB2-Y10QE 1.787 6.545 9.12E+05 bx C27HB3-Y10QE 2.245 6.545 1.11E+06 bx A6QB-Y10QE 1.457 6.545 2.46E+06 bx A6QB-Y10QD 1.457 7.267 1.76E+06 bx C27HB2-Y10QD 1.779 7.266 4.08E+05 bx C27HB3-Y10QD 2.243 7.267 5.33E+05 bx Y24HB3-Y24QD 2.907 7.150 4.48E+06 bx Y24HB2-Y24QD 2.709 7.150 4.28E+06 bx Y24HA-Y24QD 4.059 7.150 2.95E+06 bx Q25HA-Y24QD 3.875 7.150 1.19E+06 bx S28HB2-Y24QD 3.571 7.149 5.30E+05 bx S28HB2-Y24QE 3.567 6.875 8.03E+05 bx S28HB3-Y24QE 3.283 6.873 7.72E+05 bx S28HB3-Y24QD 3.280 7.151 5.58E+05 bx Y24HB3-Y24QE 2.910 6.875 4.25E+05 bx Y24HB2-Y10QE 2.704 6.546 5.07E+05 bx Y24HA-Y10QE 4.060 6.545 3.11E+06 bx Y10HA-Y10QE 4.218 6.547 5.56E+05 bx ?-Y10QE 4.381 6.545 8.93E+05 bx Y10HA-Y10QD 4.220 7.267 5.24E+06 bx K7HA-Y10QD 4.184 7.268 2.40E+06 bx A6HA-Y10QD 4.048 7.267 5.51E+05 bx F20QD-Y24HB3 7.321 2.905 5.17E+05 bx Y10HB3-Y10QD 2.972 7.267 4.52E+06 bx Y10HB2-Y10QD 3.120 7.267 4.41E+06 bx S28HA-P29HD3 4.378 3.778 2.39E+06 bx E31HB2-L30QD2 2.219 0.871 7.08E+05 bx E31HB2-L30QD1 2.221 0.938 8.39E+05 bx L30QD1-E31HB2 0.941 2.227 1.73E+06 bx L30QD2-E31HB2 0.873 2.218 1.13E+06 bx E31HG2-E31HB2 2.367 2.170 9.92E+05 bx E31HB2-E31HG2 2.173 2.366 4.60E+05 bx C13HA-V18QG2 4.088 1.064 9.78E+05 bx M26QE-V18QG1 2.066 0.971 2.40E+06 bx ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 H . . 6.259 ppm . . . 768 . . 30597 3 2 . . C 13 C-methyl . . 60 ppm . . . 0 . . 30597 3 stop_ save_ save_spectral_peak_list_4 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_4 _Spectral_peak_list.Entry_ID 30597 _Spectral_peak_list.ID 4 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 8 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC aromatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 Volume Y8HN-C9HA 7.862 4.062 1.42E+06 bx C9HN-? 7.921 4.354 1.45E+06 bx F20HN-F20HA 8.875 4.174 3.80E+06 bx F20HN-F20HB2 8.875 3.348 5.44E+06 bx F20HN-F20HB3 8.874 3.028 3.97E+06 bx D21HN-F20HB3 8.998 3.027 3.49E+06 bx D21HN-F20HB2 8.997 3.347 1.67E+06 bx D21HN-D21HB3 8.997 2.690 3.81E+06 bx D21HN-D21HB2 8.998 2.741 3.63E+06 bx D21HN-F20HA 8.998 4.175 1.14E+06 bx D21HN-D21HA 8.998 4.264 4.74E+06 bx D21HN-F20HN 8.996 8.873 3.53E+06 bx D21HN-Q22HN 8.998 7.439 4.28E+06 bx D21HN-F20QD 8.998 7.302 1.50E+06 bx F20HN-F20QD 8.876 7.302 9.75E+05 bx Q22HN-P19HB3 7.440 2.128 2.22E+06 bx F20HN-P19HB3 8.875 2.129 1.15E+06 bx D21HN-P19HB3 8.998 2.129 1.46E+06 bx Q22HN-Q22QB 7.440 2.003 8.14E+06 bx Q22HN-Q22HG2 7.441 2.357 1.01E+06 bx Q22HN-Q22HG3 7.439 2.419 1.72E+06 bx Q22HN-Q22HA 7.440 4.080 3.72E+06 bx Q22HN-D21HB3 7.438 2.690 1.58E+06 bx C23HN-Q22HN 8.570 7.441 3.62E+06 bx C23HN-Q22HA 8.569 4.078 9.72E+05 bx C23HN-C23HB3 8.570 2.788 3.35E+06 bx C23HN-C23HB2 8.570 3.160 2.33E+06 bx Q22HN-D21HA 7.441 4.264 1.31E+06 bx Y24HN-C23HN 8.833 8.570 2.70E+06 bx Y24HN-Y24HA 8.833 4.035 4.12E+06 bx Y24HN-C23HB2 8.833 3.161 3.68E+06 bx Y24HN-Y24HB3 8.833 2.888 5.78E+06 bx Y24HN-C23HB3 8.833 2.788 2.22E+06 bx Y24HN-Y24HB2 8.833 2.677 6.59E+06 bx C23HN-Q22QB 8.576 2.002 4.15E+06 bx Y24HN-Y24QD 8.832 7.128 1.28E+06 bx Y24HN-D21HA 8.833 4.264 1.30E+06 bx Q25HN-Y24HB3 7.604 2.889 2.64E+06 bx Q25HN-Y24HB2 7.604 2.678 1.64E+06 bx Q25HN-Q25HG2 7.604 2.567 1.51E+06 bx Q25HN-Q5QG 7.604 2.481 3.57E+06 bx Q25HN-C23HA 7.604 4.028 1.05E+06 bx Q25HN-Q25QB 7.608 2.155 7.60E+06 bx Q25HN-Q25HA 7.604 3.864 3.60E+06 bx M26HN-M26QE 7.581 2.050 3.06E+06 bx M26HN-M26HB2 7.582 2.153 7.49E+06 bx M26HN-M26HG3 7.581 2.481 8.07E+05 bx M26HN-M26HG2 7.578 2.565 1.72E+06 bx M26HN-C23HA 7.582 4.029 1.26E+06 bx S2HN-S2HB2 8.705 3.973 1.30E+06 bx S2HN-S2HB3 8.704 4.015 1.36E+06 bx S2HN-S2HA 8.706 4.911 1.52E+06 bx C27HN-M26HA 8.438 4.149 1.37E+06 bx L30HN-L30QD2 7.599 0.859 1.19E+06 bx L30HN-L30HB2 7.600 1.475 1.81E+06 bx L30HN-L30HA 7.600 4.226 3.29E+06 bx L30HN-L30HG 7.599 1.689 5.21E+06 bx L30HN-L30HB3 7.599 1.908 4.34E+06 bx E31HN-E31HB3 7.894 2.109 3.67E+06 bx E31HN-E31HB2 7.895 2.188 1.56E+06 bx E31HN-E31HG3 7.895 2.284 1.51E+06 bx E31HN-E31HG2 7.893 2.397 2.10E+06 bx E31HN-L30HB3 7.894 1.909 1.16E+06 bx E31HN-E31HA 7.897 4.309 3.04E+06 bx E31HN-L30HA 7.894 4.227 2.27E+06 bx E31HN-L30HN 7.893 7.599 5.44E+06 bx R32HN-R32HB3 7.662 1.955 1.09E+06 bx R32HN-R32HB2 7.665 1.802 2.48E+06 bx R32HN-R32QG 7.663 1.679 1.60E+06 bx R32HN-E31HA 7.665 4.309 2.92E+06 bx R32HN-R32HA 7.663 4.470 2.83E+06 bx E31HN-R32HN 7.896 7.667 4.89E+06 bx S33HN-R32HB3 8.003 1.958 8.79E+05 bx S33HN-R32HA 8.004 4.470 6.42E+06 bx S33HN-S33QB 8.005 3.875 1.79E+06 bx S2HN-P3HG3 8.705 2.185 1.26E+06 bx A6HN-A6QB 8.361 1.446 1.16E+07 bx K7HN-K7HG2 8.044 1.383 8.29E+05 bx K7HN-A6QB 8.046 1.447 6.07E+06 bx K7HN-K7HD3 8.047 1.687 4.46E+05 bx V18HN-V18HB 8.360 1.911 3.19E+06 bx K7HN-K7HB2 8.046 1.903 7.56E+06 bx A6HN-Q5HB3 8.361 2.184 3.99E+06 bx Q5HN-Q4HB3 8.231 2.072 3.93E+06 bx Q5HN-Q5QB 8.231 2.185 8.41E+06 bx A6HN-A6HA 8.360 4.041 4.63E+06 bx K7HN-A6HA 8.046 4.040 1.94E+06 bx A6HN-Q5HA 8.361 4.212 4.50E+06 bx Q5HN-Q5HA 8.230 4.211 4.32E+06 bx Q5HN-Q4HG3 8.229 2.424 8.91E+05 bx Q25HN-Q4QG 7.610 2.421 1.54E+06 bx Q5HN-Q4HA 8.231 4.173 4.80E+06 bx Q4HN-P3HA 8.579 4.457 6.27E+06 bx A6HN-P3HA 8.361 4.457 1.14E+06 bx A6HN-K7HN 8.362 8.045 6.28E+06 bx A6HN-Q5HN 8.360 8.231 6.20E+06 bx S33HN-S33HA 8.014 4.307 1.85E+06 bx K7HN-K7HA 8.045 4.135 4.25E+06 bx K7HN-K7HG3 8.048 1.479 1.29E+06 bx K7HN-K7HE2 8.047 2.988 1.82E+05 bx Q5HN-Q5QG 8.231 2.481 3.77E+06 bx K7HN-Q5HA 8.048 4.214 1.38E+06 bx K7HN-Q4HA 8.046 4.169 2.27E+06 bx Q4HN-Q5HN 8.579 8.228 3.82E+06 bx Q4HN-P3QD 8.580 3.858 2.34E+06 bx F20QD-F20HB3 7.302 3.028 8.94E+06 bx F20QD-F20HB2 7.301 3.348 8.28E+06 bx Y24QD-Y24HB3 7.127 2.889 8.40E+06 bx Y24QD-Y24HB2 7.127 2.677 8.32E+06 bx Y10QD-A6HA 7.244 4.040 1.11E+06 bx Y10QD-K7HA 7.243 4.136 3.72E+06 bx Y10QD-Y10HA 7.243 4.193 7.94E+06 bx Y10QD-Y10HB2 7.244 3.104 8.51E+06 bx Y10QD-Y10HB3 7.244 2.951 8.13E+06 bx Y10QD-A6QB 7.244 1.447 2.54E+06 bx Y10HN-Y10HB3 8.419 2.950 5.77E+06 bx Y10HN-Y10HB2 8.419 3.103 2.89E+06 bx Y10HN-Y10HA 8.420 4.192 3.63E+06 bx K7HN-Y10HA 8.048 4.192 1.39E+06 bx Y10HN-C9HN 8.419 7.922 3.88E+06 bx C9HN-Y8HN 7.924 7.862 2.48E+06 bx Y8QD-Y8HB3 7.153 3.139 7.76E+06 bx Y8HN-Y8HB3 7.861 3.141 6.54E+06 bx C9HN-Y8HB3 7.922 3.139 1.73E+06 bx C9HN-C9HB2 7.922 2.823 6.65E+06 bx C9HN-C9HB3 7.921 3.230 5.52E+06 bx Y10HN-C9HB2 8.420 2.823 1.90E+06 bx Y10HN-C9HB3 8.419 3.231 4.22E+06 bx C9HN-C9HA 7.921 4.064 3.66E+06 bx C9HN-A6HA 7.926 4.035 2.01E+06 bx Y10HN-C9HA 8.420 4.064 1.36E+06 bx E11HN-Y10HB2 8.322 3.102 1.65E+06 bx E11HN-Y10HB3 8.323 2.951 2.43E+06 bx E11HN-E11HB2 8.323 2.104 4.14E+06 bx E11HN-E11HB3 8.323 2.256 5.98E+06 bx E11HN-E11HG2 8.322 2.539 2.65E+06 bx Q12HN-E11HB3 8.279 2.256 2.06E+06 bx E11HN-E11HA 8.322 4.163 4.31E+06 bx Y10HN-Y10QD 8.419 7.244 3.91E+06 bx Q12HN-Q12HG3 8.280 2.107 7.63E+06 bx Q12HN-Q12HG2 8.280 2.045 2.25E+06 bx Q12HN-Q12HB2 8.280 1.930 3.77E+06 bx C13HN-Q12HG3 8.122 2.106 2.52E+06 bx C13HN-Q12HG2 8.123 2.048 1.02E+06 bx C13HN-Q12HB2 8.122 1.977 1.39E+06 bx C13HN-Q12HB3 8.121 1.921 9.21E+05 bx C13HN-C13HB2 8.122 3.437 3.16E+06 bx C13HN-C13HB3 8.122 3.678 5.80E+06 bx C13HN-C13HA 8.122 4.064 4.42E+06 bx C13HN-Q12HA 8.122 3.945 1.42E+06 bx C13HN-Y10HA 8.121 4.196 2.49E+06 bx Q12HN-C13HA 8.280 4.070 1.35E+06 bx Q12HN-Q12HA 8.280 3.945 4.01E+06 bx Y8HN-K7QB 7.861 1.882 3.30E+06 bx Q12HN-C13HN 8.283 8.124 4.81E+06 bx E11HN-Q12HN 8.325 8.275 3.32E+06 bx Y10HN-E11HN 8.425 8.326 3.10E+06 bx C13HN-N14HN 8.123 7.608 3.45E+06 bx N14HN-C13HB3 7.609 3.673 1.40E+06 bx N14HN-C13HB2 7.612 3.437 8.90E+05 bx N14HN-N14HB2 7.608 2.999 3.84E+06 bx N14HN-N14HA 7.609 4.630 2.45E+06 bx V15HN-Q12HA 7.863 3.945 3.05E+06 bx V15HN-N14QB 7.863 2.997 3.45E+06 bx V15HN-N14HA 7.864 4.630 1.90E+06 bx K17HN-N14HA 7.765 4.628 1.15E+06 bx V15HN-V15HA 7.863 3.748 5.74E+06 bx V15HN-V15QG1 7.863 0.946 5.00E+06 bx V15HN-V15QG2 7.863 1.056 1.00E+07 bx V15HN-V15HB 7.863 2.082 9.86E+06 bx K17HN-K17HB3 7.762 2.079 1.17E+06 bx K17HN-K17HB2 7.764 1.895 1.09E+06 bx K17HN-K17QG 7.764 1.398 2.04E+06 bx K17HN-K17HA 7.764 4.008 1.13E+07 bx N16HN-N16HB2 7.863 2.948 2.85E+06 bx N16HN-N16HB3 7.864 2.651 5.85E+06 bx N16HD21-N16HB3 7.589 2.652 5.06E+06 bx N16HD21-N16HB2 7.589 2.949 2.67E+06 bx Y8HN-? 7.862 4.354 3.77E+06 bx N16HN-N16HA 7.864 4.764 2.03E+06 bx Y24HN-Q25HN 8.833 7.603 3.27E+06 bx C27HN-M26HN 8.441 7.581 5.62E+06 bx S28HN-S28HB2 8.252 3.563 2.70E+06 bx S28HN-P29HD3 8.253 3.761 5.08E+06 bx S28HN-S28HB3 8.253 3.274 3.78E+06 bx S28HN-C27HB2 8.252 1.786 1.33E+06 bx C27HN-C27HB2 8.442 1.785 2.97E+06 bx C27HN-M26QE 8.442 2.051 1.97E+06 bx C27HN-M26HB2 8.441 2.151 2.09E+06 bx C27HN-C27HB3 8.440 2.262 1.78E+06 bx C27HN-C27HA 8.441 4.738 2.34E+06 bx S28HN-C27HA 8.252 4.739 1.45E+06 bx S28HN-S28HA 8.253 4.356 4.55E+06 bx V18HN-V18QG1 8.361 0.949 2.70E+06 bx V18HN-V18HA 8.361 4.265 9.90E+05 bx V18HN-K17HA 8.361 3.997 1.62E+06 bx M26HN-M26HA 7.580 4.149 3.77E+06 bx C23HN-C23HA 8.573 4.031 1.95E+06 bx V18HN-K17HN 8.363 7.764 1.50E+06 bx V18HN-V15HN 8.362 7.866 1.06E+06 bx Y8HN-K7HA 7.861 4.134 1.45E+06 bx K17HN-N16HA 7.761 4.767 8.30E+05 bx V15HN-K17HA 7.859 4.003 7.65E+05 bx Q4HN-Q4QG 8.580 2.422 2.93E+06 bx Q4HN-Q4QB 8.580 2.073 1.03E+07 bx F20HN-P19HA 8.874 4.491 1.16E+07 bx F20HN-P19HB2 8.875 2.495 1.45E+06 bx S28HN-P29HD2 8.253 3.140 2.61E+06 bx L30HN-P29HA 7.599 4.337 2.08E+06 bx D21HN-P19HB2 8.998 2.496 7.26E+05 bx L30HN-P29HD3 7.598 3.755 8.33E+05 bx Q4HN-Q4HA 8.580 4.173 5.79E+06 bx Q4HA-Q4QG 4.171 2.421 2.53E+06 bx Q4HA-Q4QB 4.169 2.074 8.76E+06 bx Q4QG-Q4HA 2.421 4.173 2.47E+06 bx Q4QB-Q4HA 2.074 4.173 9.82E+06 bx Q4QG-Q4QB 2.430 2.080 8.70E+06 bx Q4QB-Q4QG 2.068 2.417 1.18E+07 bx Q5HA-Q5QB 4.208 2.186 6.79E+06 bx Q5HA-Q5QG 4.210 2.483 3.58E+06 bx Q5QG-Q5QB 2.481 2.186 9.63E+06 bx Q5QB-Q5QG 2.186 2.481 4.42E+06 bx Q5QG-Q5HA 2.481 4.212 4.54E+06 bx Q5QB-Q5HA 2.186 4.211 7.34E+06 bx Q5HA-Q5HN 4.211 8.229 2.41E+06 bx Q5HG3-Q5HN 2.480 8.231 2.65E+06 bx Q5HB3-Q5HN 2.183 8.231 5.38E+06 bx Q4HA-Q4HN 4.172 8.578 3.54E+06 bx Q4QG-Q4HN 2.423 8.579 1.82E+06 bx Q4QB-Q4HN 2.073 8.579 6.82E+06 bx Q5HN-Q4HN 8.232 8.582 4.22E+06 bx Q4HN-Q5HB3 8.580 2.190 6.44E+05 bx A6HN-Q5HG3 8.361 2.481 7.62E+05 bx A6QB-A6HA 1.444 4.039 7.83E+06 bx A6HA-A6QB 4.041 1.447 4.98E+06 bx A6QB-A6HN 1.446 8.361 9.75E+06 bx A6HA-A6HN 4.041 8.361 3.25E+06 bx Q5HN-A6HN 8.230 8.357 5.64E+06 bx K7HN-A6HN 8.045 8.361 5.90E+06 bx P3HA-Q4HN 4.455 8.578 7.88E+05 bx P3QD-Q4HN 3.859 8.578 1.81E+06 bx Q4HB3-Q5HN 2.073 8.230 3.00E+06 bx Q4HA-Q5HN 4.172 8.231 2.99E+06 bx K7HA-K7QB 4.136 1.908 3.17E+06 bx K7HA-K7HE2 4.133 2.988 5.28E+04 bx K7HA-K7HG3 4.130 1.478 1.17E+06 bx K7HA-K7HG2 4.135 1.378 9.34E+05 bx K7HE2-K7HA 2.986 4.137 2.50E+05 bx K7HB2-K7HA 1.904 4.135 2.84E+06 bx K7HE2-K7HB2 2.986 1.903 1.18E+05 bx K7HB2-K7HE2 1.899 2.989 1.92E+05 bx L30HB2-L30HB3 1.474 1.907 1.61E+07 bx L30HB3-L30HB2 1.908 1.477 1.58E+07 bx K17HB2-K17QG 1.899 1.399 5.22E+06 bx K17QG-K17HB2 1.393 1.888 4.10E+06 bx K7HG2-K7HG3 1.381 1.478 1.26E+07 bx K7HG3-K7HG2 1.468 1.374 8.98E+06 bx K7HE2-K7HD3 2.987 1.696 5.52E+06 bx L30HB3-K7HD3 1.904 1.688 3.57E+06 bx K7HD3-K7HE2 1.699 2.988 3.38E+06 bx L30HG-L30HB3 1.683 1.889 4.52E+06 bx L30HG-L30HB2 1.675 1.476 6.23E+06 bx K7HD3-K17QG 1.681 1.381 2.98E+06 bx L30HB2-L30HG 1.487 1.683 8.26E+06 bx K17QG-K7QD 1.372 1.679 2.54E+06 bx K7HA-K7HN 4.134 8.046 2.26E+06 bx A6HA-K7HN 4.039 8.045 1.24E+06 bx K7HE2-K7HN 2.991 8.049 -2.03E+04 bx K7HB2-K7HN 1.888 8.046 3.91E+06 bx A6QB-K7HN 1.446 8.046 5.21E+06 bx K7HA-K7HD3 4.137 1.689 3.58E+05 bx C9HN-L30QD1 7.921 0.930 9.10E+05 bx C9HA-C9HN 4.064 7.921 2.23E+06 bx C9HB3-C9HN 3.231 7.922 3.08E+06 bx Y8HB3-C9HN 3.137 7.921 2.19E+06 bx C9HB2-C9HN 2.829 7.922 3.70E+06 bx C9HB3-A6HA 3.232 4.046 2.98E+06 bx C9HB2-C9HA 2.829 4.066 3.97E+06 bx C9HA-C9HB3 4.062 3.229 2.46E+06 bx C9HA-C9HB2 4.062 2.823 4.32E+06 bx C9HB3-C9HB2 3.232 2.824 1.37E+07 bx C9HB2-C9HB3 2.814 3.231 1.47E+07 bx C13HA-C13HB2 4.068 3.436 3.26E+06 bx C13HA-C13HB3 4.065 3.678 2.65E+06 bx C13HB3-C13HB2 3.676 3.436 1.09E+07 bx C13HB2-C13HB3 3.439 3.679 1.22E+07 bx C13HB2-C13HA 3.437 4.063 2.58E+06 bx C13HB3-C13HA 3.677 4.062 2.24E+06 bx C13HN-V15QG1 8.123 0.953 6.99E+05 bx C13HA-C13HN 4.066 8.123 2.71E+06 bx Q12HA-C13HN 3.939 8.122 1.11E+06 bx C13HB3-C13HN 3.677 8.122 2.73E+06 bx C13HB2-C13HN 3.438 8.123 1.62E+06 bx Q12HG3-C13HN 2.106 8.123 1.17E+06 bx Q12HB3-C13HN 1.980 8.125 9.46E+05 bx Q12HG3-C13HN 2.048 8.121 1.10E+06 bx K7HN-Y8HN 8.046 7.857 3.73E+06 bx E11HN-? 8.322 4.353 2.04E+06 bx Y8HN-Q5HA 7.862 4.209 1.40E+06 bx Y8HN-K7HN 7.866 8.049 5.24E+06 bx ?-Y8HB3 4.355 3.138 2.48E+06 bx ?-Y8HB2 4.354 3.074 2.64E+06 bx Y8HB3-? 3.136 4.355 5.68E+06 bx Y8HB2-? 3.077 4.354 5.98E+06 bx Y8HB3-Y8HN 3.137 7.862 5.45E+06 bx Y8HB2-Y8HN 3.076 7.861 4.92E+06 bx ?-Y8HN 4.353 7.861 1.37E+06 bx Q5HA-Y8HN 4.213 7.865 9.06E+05 bx K7HA-Y8HN 4.134 7.862 8.12E+05 bx C9HA-Y8HN 4.056 7.863 9.54E+05 bx K7QB-Y8HN 1.900 7.863 1.56E+06 bx K7QB-Y8HN 1.883 7.861 1.63E+06 bx Y8QD-? 7.153 4.354 6.70E+06 bx Y8QD-Q5HA 7.154 4.211 1.33E+06 bx Y8QD-C9HA 7.154 4.070 1.11E+06 bx Y8QE-Y8HB2 6.791 3.142 7.53E+05 bx Y8QD-Y8QE 7.157 6.795 2.83E+07 bx Y8HN-Y8QD 7.861 7.155 9.15E+05 bx C9HN-Y8QD 7.923 7.154 1.16E+06 bx Y8QE-Y8QD 6.790 7.152 3.13E+07 bx Y8QD-K7HE2 7.149 2.994 9.10E+05 bx ?-Y8QD 4.352 7.155 1.95E+06 bx Y8HB2-Y8QD 3.137 7.154 6.07E+06 bx Y8HN-C9HN 7.858 7.911 5.37E+06 bx ?-C9HN 4.353 7.910 1.04E+06 bx Y10HN-K7HA 8.419 4.136 1.33E+06 bx Y10HA-Y10HB3 4.195 2.951 2.62E+06 bx Y10HA-Y10HB2 4.196 3.104 4.16E+06 bx Y10HB3-Y10HB2 2.953 3.106 2.09E+07 bx Y10HB2-Y10HB3 3.096 2.950 2.41E+07 bx Y10HB3-Y10HA 2.953 4.193 2.90E+06 bx Y10HB2-Y10HA 3.094 4.194 4.08E+06 bx Y10HA-Y10HN 4.192 8.419 2.27E+06 bx Y10HB2-Y10HN 3.097 8.420 3.08E+06 bx Y10HB3-Y10HN 2.952 8.419 3.13E+06 bx C9HB3-Y10HN 3.231 8.419 2.01E+06 bx C9HB2-Y10HN 2.816 8.420 1.35E+06 bx E11HN-Y10HN 8.322 8.424 3.66E+06 bx Y10QE-A6QB 6.524 1.446 3.69E+06 bx Y10QD-Y10QE 7.244 6.525 1.84E+07 bx Y10QE-Y10QD 6.524 7.243 2.00E+07 bx Y10HA-Y10QD 4.193 7.243 4.81E+06 bx Y10HB2-Y10QD 3.096 7.243 6.71E+06 bx Y10HB3-Y10QD 2.952 7.243 4.84E+06 bx Y10QE-Y24HA 6.525 4.037 4.53E+06 bx K7HA-Y10QD 4.134 7.243 1.89E+06 bx A6HA-Y10QD 4.041 7.243 9.91E+05 bx C9HN-Y10HN 7.921 8.418 3.51E+06 bx Y10QD-C9HB3 7.239 3.230 2.18E+06 bx Y10QD-C27HB3 7.244 2.265 1.15E+06 bx Y10QD-C27HB2 7.241 1.794 8.19E+05 bx Y10QE-C27HB3 6.524 2.263 1.81E+06 bx E11HA-E11HN 4.161 8.322 2.21E+06 bx E11HG2-E11HN 2.540 8.323 1.09E+06 bx E11HB3-E11HN 2.252 8.322 2.75E+06 bx E11HB2-E11HN 2.106 8.322 2.67E+06 bx E11HA-E11HG2 4.164 2.539 9.77E+05 bx E11HA-E11HB3 4.164 2.257 1.34E+06 bx E11HA-E11HB2 4.163 2.104 4.88E+06 bx E11HG2-E11HA 2.540 4.162 9.43E+05 bx E11HB3-E11HA 2.254 4.163 1.44E+06 bx E11HB2-E11HA 2.103 4.163 3.16E+06 bx E11HB3-E11HG2 2.257 2.539 2.81E+06 bx E11HB2-E11HG2 2.104 2.540 2.35E+06 bx E11HG2-E11HB2 2.539 2.102 7.44E+05 bx E11HG2-E11HB3 2.537 2.259 1.35E+06 bx E11HB3-E11HB2 2.255 2.106 1.51E+07 bx E11HB2-E11HB3 2.109 2.258 1.98E+07 bx Q12HN-E11HA 8.279 4.163 1.08E+06 bx C13HN-Q12HN 8.120 8.278 4.42E+06 bx Q12HA-Q12HN 3.943 8.280 3.04E+06 bx Q12HG3-Q12HN 2.105 8.280 4.15E+06 bx Q12HG2-Q12HN 2.041 8.280 2.91E+06 bx Q12HB2-Q12HN 1.979 8.280 2.44E+06 bx Q12HB3-Q12HN 1.931 8.281 2.16E+06 bx E11HB3-Q12HN 2.251 8.278 1.32E+06 bx Q12HG3-Q12HA 2.108 3.945 2.70E+06 bx Q12HB3-Q12HA 1.935 3.943 1.94E+06 bx Q12HG2-Q12HA 2.038 3.943 2.02E+06 bx Q12HA-Q12HG2 3.945 2.046 1.49E+06 bx Q12HA-Q12HB3 3.939 1.974 3.25E+06 bx Q12HA-Q12HB2 3.946 1.928 1.91E+06 bx Q12HA-Q12HG3 3.943 2.089 5.88E+06 bx F20QD-F20HA 7.302 4.174 5.71E+06 bx F20QD-D21HA 7.301 4.264 2.76E+06 bx F20QD-Y24HB2 7.297 2.679 1.60E+06 bx F20HA-F20HB2 4.172 3.346 4.12E+06 bx F20HA-F20HB3 4.172 3.023 3.37E+06 bx F20HB2-F20HB3 3.353 3.028 1.74E+07 bx F20HB3-F20HB2 3.026 3.347 1.74E+07 bx F20HB2-F20HA 3.353 4.174 4.04E+06 bx F20HB3-F20HA 3.025 4.173 3.03E+06 bx F20HA-F20HN 4.174 8.874 2.42E+06 bx F20HB2-F20HN 3.350 8.875 3.93E+06 bx F20HB3-F20HN 3.026 8.873 2.76E+06 bx P19HB2-F20HN 2.493 8.876 8.73E+05 bx P19HA-F20HN 4.488 8.874 1.31E+06 bx F20HN-D21HN 8.874 8.995 1.92E+06 bx D21HA-F20QD 4.264 7.300 1.59E+06 bx F20HA-F20QD 4.174 7.302 2.87E+06 bx F20HB2-F20QD 3.350 7.303 4.06E+06 bx F20HB3-F20QD 3.026 7.302 4.18E+06 bx Q22HN-D21HN 7.440 8.998 3.86E+06 bx F20QD-D21HN 7.301 8.998 1.70E+06 bx F20QD-F20HN 7.301 8.872 1.72E+06 bx D21HA-D21HN 4.262 8.996 2.13E+06 bx F20HB2-D21HN 3.342 9.000 1.09E+06 bx F20HB3-D21HN 3.026 8.997 2.14E+06 bx D21HB2-D21HN 2.738 8.997 3.45E+06 bx D21HB2-D21HN 2.693 8.998 3.13E+06 bx D21HB2-D21HA 2.735 4.265 6.55E+06 bx D21HB3-D21HA 2.690 4.264 9.37E+06 bx D21HA-D21HB2 4.266 2.736 4.06E+06 bx D21HA-D21HB3 4.264 2.686 6.28E+06 bx D21HB3-D21HB2 2.691 2.743 5.28E+07 bx D21HB2-D21HB3 2.740 2.688 5.27E+07 bx Q22HN-D21HB2 7.440 2.740 8.89E+05 bx Q22HN-C23HN 7.440 8.570 4.47E+06 bx Q22HA-Q22HN 4.078 7.441 3.22E+06 bx Q22HG3-Q22HN 2.418 7.440 9.86E+05 bx Q22QB-Q22HN 2.002 7.440 5.86E+06 bx P19HB3-Q22HN 2.126 7.440 1.70E+06 bx Q22HG3-Q22HA 2.415 4.080 2.11E+06 bx Q22HG2-Q22HA 2.355 4.080 1.88E+06 bx Q22QB-Q22HA 2.004 4.081 8.77E+06 bx Q22HA-Q22HG3 4.078 2.420 1.99E+06 bx Q22HA-Q22HG2 4.080 2.352 2.09E+06 bx Q22HA-Q22QB 4.077 2.002 9.34E+06 bx Q22HG3-Q22QB 2.429 2.003 1.71E+07 bx Q22HG2-Q22QB 2.359 2.000 6.48E+06 bx Q22HG3-Q22HG2 2.417 2.351 3.73E+07 bx Q22QB-Q22HG2 1.992 2.353 6.97E+06 bx Q22QB-Q22HG3 1.995 2.422 1.69E+07 bx C23HN-Y24HN 8.567 8.835 1.65E+06 bx C23HA-C23HN 4.028 8.572 1.87E+06 bx C23HB2-C23HN 3.164 8.570 1.74E+06 bx C23HB3-C23HN 2.796 8.570 2.30E+06 bx C23HB3-C23HA 2.779 4.030 2.72E+06 bx C23HB2-C23HA 3.164 4.031 1.88E+06 bx Q22QB-C23HN 2.003 8.573 2.99E+06 bx C23HA-C23HB2 4.027 3.161 2.55E+06 bx C23HA-C23HB3 4.030 2.791 3.60E+06 bx C23HB2-C23HB3 3.163 2.788 1.26E+07 bx C23HB3-C23HB2 2.779 3.160 1.43E+07 bx Y24HN-F20HA 8.831 4.172 7.75E+05 bx Y24HA-Y24HB3 4.038 2.891 2.10E+06 bx Y24HA-Y24HB2 4.037 2.677 4.60E+06 bx Y24HB3-Y24HB2 2.887 2.678 1.37E+07 bx Y24HB2-Y24HB3 2.684 2.888 1.65E+07 bx Y24HB3-Y24HA 2.886 4.036 1.98E+06 bx Y24HB2-Y24HA 2.681 4.036 3.35E+06 bx Y24HB2-Y24HN 2.683 8.833 4.28E+06 bx C23HB3-Y24HN 2.778 8.832 1.24E+06 bx Y24HB3-Y24HN 2.887 8.833 3.30E+06 bx C23HB2-Y24HN 3.159 8.832 1.51E+06 bx Y24HA-Y24HN 4.033 8.833 2.69E+06 bx F20HA-Y24HN 4.171 8.831 1.04E+06 bx D21HA-Y24HN 4.260 8.831 7.38E+05 bx Y24QD-Y24HA 7.127 4.036 4.59E+06 bx Y24QD-Y10QE 7.130 6.528 2.56E+06 bx Y24QD-Y24QE 7.126 6.860 2.89E+07 bx Y24QE-Y24QD 6.860 7.127 3.44E+07 bx Y10QE-Y24QD 6.521 7.124 1.66E+06 bx Y24QD-Q25HA 7.128 3.864 1.76E+06 bx N16HD22-N16HB2 6.888 2.947 1.43E+06 bx N16HD22-N16HB3 6.888 2.650 2.69E+06 bx Y24QD-Y24HN 7.128 8.832 1.38E+06 bx Q25HN-Y24HN 7.604 8.832 2.74E+06 bx P29HD3-P29HD2 3.759 3.141 1.64E+07 bx P3QD-Q25QB 3.858 2.152 8.55E+06 bx Q25HA-Q25HG3 3.863 2.566 1.14E+06 bx M26HG2-Q25QB 2.570 2.169 4.86E+06 bx M26HG2-M26HG3 2.565 2.481 6.49E+07 bx M26HG3-Q25HG2 2.483 2.569 6.85E+07 bx Q25QB-Q25HG3 2.142 2.566 6.37E+06 bx M26HG3-Q25QB 2.489 2.153 1.71E+07 bx Q25HG3-Q25HA 2.563 3.861 1.32E+06 bx Q25QB-P3QD 2.153 3.863 7.40E+06 bx Q25HA-Q25HN 3.862 7.603 3.69E+06 bx Q25HG3-Q25HN 2.566 7.606 1.29E+06 bx Q5QG-Q25HN 2.483 7.603 2.78E+06 bx Q25QB-Q25HN 2.153 7.598 7.12E+06 bx Y24HB3-Q25HN 2.888 7.605 2.00E+06 bx Y24HB3-Y24QD 2.888 7.128 4.54E+06 bx Y24HB2-Y24QD 2.683 7.128 4.65E+06 bx Q25HA-Y24QD 3.862 7.126 1.25E+06 bx Y24HA-Y24QD 4.037 7.127 3.02E+06 bx M26HA-M26QE 4.151 2.051 4.10E+06 bx M26HA-M26HB2 4.147 2.152 4.28E+06 bx M26HA-M26HG3 4.149 2.477 1.57E+06 bx M26HA-M26HG2 4.151 2.556 1.39E+06 bx M26HA-M26HN 4.149 7.580 3.27E+06 bx M26HB2-M26HN 2.154 7.581 6.01E+06 bx M26QE-M26HN 2.051 7.586 2.73E+06 bx M26HB2-M26HA 2.151 4.149 3.30E+06 bx M26QE-M26HA 2.050 4.148 3.67E+06 bx M26HG2-M26QE 2.569 2.058 1.42E+06 bx P19HB2-P19QG 2.494 2.081 6.33E+06 bx M26QE-M26HG2 2.062 2.576 2.73E+06 bx M26HG3-M26QE 2.481 2.050 1.41E+06 bx M26QE-M26HG3 2.052 2.479 1.46E+06 bx S28HN-M26HN 8.254 7.588 1.18E+06 bx C27HB3-C27HB2 2.262 1.786 8.31E+06 bx C27HB3-C27HN 2.251 8.438 1.28E+06 bx C27HB2-C27HN 1.785 8.441 1.77E+06 bx M26HB2-C27HN 2.148 8.444 1.13E+06 bx M26QE-C27HN 2.059 8.445 1.26E+06 bx C27HB3-C27HA 2.252 4.737 2.20E+06 bx C27HB2-C27HA 1.781 4.738 9.26E+05 bx C27HN-S28HN 8.441 8.251 5.43E+06 bx S28HN-C27HN 8.254 8.443 6.37E+06 bx M26HN-C27HN 7.580 8.441 4.59E+06 bx S28HN-Y24HA 8.253 4.035 1.79E+06 bx S28HA-S28HB3 4.354 3.275 1.99E+06 bx S28HA-S28HB2 4.354 3.565 2.81E+06 bx S28HB2-S28HB3 3.572 3.276 1.13E+07 bx S28HB3-S28HB2 3.268 3.563 1.12E+07 bx S28HB2-S28HA 3.563 4.356 5.12E+06 bx S28HB3-S28HA 3.278 4.357 3.45E+06 bx S28HA-S28HN 4.355 8.253 1.47E+06 bx P29HD3-S28HN 3.760 8.253 3.08E+06 bx S28HB3-S28HN 3.269 8.253 1.69E+06 bx P29HD2-S28HN 3.138 8.253 1.27E+06 bx S28HB2-S28HN 3.563 8.253 1.11E+06 bx P29HD3-P29HB2 3.757 2.363 8.16E+05 bx P29HD3-P29HB3 3.757 1.679 1.25E+06 bx P29HA-P29HG3 4.339 1.807 1.12E+06 bx P29HD3-P29HG3 3.759 1.820 4.08E+06 bx P29HD3-P29HG2 3.759 1.977 3.55E+06 bx P29HA-P29HB3 4.340 1.691 1.15E+06 bx P29HA-P29HG2 4.342 1.967 7.69E+05 bx P29HD2-P29HB3 3.139 1.681 1.33E+06 bx P29HD2-P29HG3 3.138 1.820 1.58E+06 bx P29HD2-P29HG2 3.139 1.977 2.62E+06 bx P29HG2-P29HD2 1.975 3.142 3.36E+06 bx P29HG3-P29HD2 1.820 3.140 1.78E+06 bx P29HB3-P29HD2 1.682 3.144 1.63E+06 bx P29HB3-P29HD3 1.683 3.760 1.21E+06 bx P29HG3-P29HD3 1.822 3.760 2.77E+06 bx P29HG2-P29HD3 1.974 3.760 3.88E+06 bx P29HG2-P29HA 1.972 4.338 1.95E+06 bx P29HG3-P29HA 1.814 4.334 2.05E+06 bx P29HB3-P29HA 1.676 4.336 2.26E+06 bx P29HD2-P29HD3 3.140 3.761 1.22E+07 bx L30HN-E31HN 7.601 7.895 5.50E+06 bx L30HB2-L30HA 1.474 4.226 3.46E+06 bx L30HG-L30HA 1.686 4.226 1.73E+06 bx L30HB3-L30HA 1.904 4.227 3.01E+06 bx L30QD1-L30HA 0.929 4.221 1.27E+06 bx L30QD2-L30HA 0.858 4.227 9.64E+06 bx L30HA-L30HN 4.224 7.596 1.94E+06 bx L30HB3-L30HN 1.908 7.600 2.85E+06 bx L30HG-L30HN 1.687 7.600 3.44E+06 bx L30HB2-L30HN 1.474 7.599 1.31E+06 bx L30QD1-L30HN 0.929 7.601 1.21E+06 bx L30QD2-L30HN 0.861 7.598 1.54E+06 bx L30HN-L30QD1 7.599 0.928 1.47E+06 bx L30HA-L30QD2 4.225 0.858 4.88E+06 bx L30HA-L30QD1 4.236 0.928 1.05E+06 bx L30HA-L30HB2 4.229 1.476 3.12E+06 bx L30HA-L30HG 4.231 1.680 1.58E+06 bx L30HA-L30HB3 4.231 1.911 2.28E+06 bx V18HB-V18QG1 1.906 0.947 6.15E+06 bx L30HB3-L30QD2 1.912 0.857 1.11E+06 bx L30HB3-L30QD1 1.909 0.927 3.53E+06 bx L30HG-L30QD2 1.681 0.858 4.73E+06 bx L30HG-L30QD1 1.684 0.928 2.95E+06 bx L30HB2-L30QD1 1.472 0.927 2.51E+06 bx L30HB2-L30QD2 1.476 0.857 1.92E+06 bx L30QD1-L30HG 0.927 1.691 5.33E+06 bx L30QD2-L30HG 0.860 1.689 1.01E+07 bx L30QD1-L30HB2 0.928 1.481 5.59E+06 bx L30QD2-L30HB2 0.862 1.487 3.95E+06 bx L30QD2-L30HB3 0.856 1.903 1.61E+06 bx V18QG1-V18HB 0.953 1.917 8.36E+06 bx L30QD1-L30HB3 0.926 1.907 3.96E+06 bx E31HN-L30HG 7.893 1.685 7.46E+05 bx E31HA-E31HB3 4.302 2.104 2.07E+06 bx D21HA-P19QG 4.266 2.067 1.24E+06 bx E31HA-E31HB2 4.303 2.183 1.86E+06 bx E31HA-E31HG3 4.307 2.270 1.90E+06 bx E31HA-E31HG2 4.311 2.388 1.07E+06 bx E31HA-E31HN 4.299 7.902 1.28E+06 bx E31HG2-E31HN 2.392 7.896 1.30E+06 bx E31HG3-E31HN 2.286 7.894 1.33E+06 bx E31HB2-E31HN 2.186 7.895 1.78E+06 bx E31HB3-E31HN 2.111 7.893 2.43E+06 bx E31HG2-E31HA 2.390 4.305 1.74E+06 bx E31HG3-E31HA 2.283 4.308 2.40E+06 bx Q5QB-? 2.187 4.348 1.31E+06 bx E31HB2-E31HA 2.185 4.306 3.82E+06 bx E31HB3-E31HA 2.108 4.305 3.27E+06 bx E31HG2-E31HG3 2.393 2.284 2.65E+07 bx E31HG3-E31HG2 2.286 2.398 2.85E+07 bx E31HG3-E31HB2 2.279 2.190 5.68E+06 bx E31HB2-E31HG3 2.192 2.285 9.09E+06 bx E31HB2-E31HB3 2.186 2.108 1.87E+07 bx E31HB3-E31HB2 2.110 2.187 2.44E+07 bx E31HG2-E31HB2 2.384 2.192 3.64E+06 bx E31HB2-E31HG2 2.190 2.389 4.58E+06 bx E31HB3-E31HG3 2.108 2.283 1.15E+07 bx E31HG3-E31HB3 2.282 2.107 3.49E+06 bx R32HB3-R32HN 1.951 7.663 9.98E+05 bx R32HB2-R32HN 1.804 7.664 1.47E+06 bx R32QG-R32HN 1.678 7.665 1.46E+06 bx R32HB3-R32HA 1.946 4.476 1.51E+06 bx R32HB2-R32HA 1.801 4.469 1.90E+06 bx R32QG-R32HA 1.679 4.470 1.57E+06 bx R32QD-R32QG 3.233 1.685 2.44E+06 bx R32QD-R32HB2 3.225 1.800 1.12E+06 bx R32QD-R32HB3 3.224 1.959 1.05E+06 bx R32HB3-R32QD 1.945 3.225 6.07E+05 bx R32HB2-R32QD 1.796 3.225 1.02E+06 bx R32QG-R32QD 1.677 3.227 1.81E+06 bx P29HB3-P29HG2 1.681 1.969 7.13E+06 bx R32HB2-P29HG2 1.811 1.964 2.56E+07 bx P29HG2-R32HB2 1.965 1.817 2.39E+07 bx P29HG2-P29HB3 1.961 1.688 3.06E+06 bx R32HB2-R32QG 1.803 1.676 1.11E+07 bx R32QG-R32HB2 1.679 1.799 1.81E+07 bx S33HN-R32HB2 8.004 1.797 7.40E+05 bx S33HA-S33HN 4.290 8.000 1.30E+06 bx S33QB-S33HN 3.876 8.004 1.58E+06 bx S33HA-S33QB 4.307 3.878 3.48E+06 bx S33QB-S33HA 3.876 4.300 3.05E+06 bx N14HN-C13HN 7.606 8.124 1.64E+06 bx Q25HN-Q22HA 7.605 4.078 2.15E+06 bx Q25HN-Q22HG2 7.605 2.354 1.12E+06 bx N14HB2-N14HA 2.996 4.629 6.59E+06 bx N14QB-N14HN 2.996 7.608 4.35E+06 bx V15HA-V15QG1 3.747 0.946 6.04E+06 bx V15HA-V15QG2 3.747 1.056 7.58E+06 bx V15HA-V15HB 3.745 2.082 3.12E+06 bx V15HB-V15HA 2.084 3.750 1.78E+06 bx V15QG2-V15HA 1.055 3.747 8.69E+06 bx V15QG1-V15HA 0.946 3.748 6.47E+06 bx V15QG2-V15HB 1.058 2.081 9.11E+06 bx V15QG1-V15HB 0.945 2.079 1.17E+07 bx V15QG1-V15QG2 0.951 1.054 2.37E+07 bx V15QG2-V15QG1 1.049 0.945 1.26E+07 bx V15HB-V15QG2 2.076 1.056 4.81E+06 bx V15HB-V15QG1 2.084 0.946 6.64E+06 bx V15HN-N14HN 7.865 7.609 3.00E+06 bx N14HN-V15HN 7.611 7.861 2.71E+06 bx V15HA-V15HN 3.748 7.864 5.25E+06 bx V15HB-V15HN 2.081 7.864 5.68E+06 bx V15QG2-V15HN 1.056 7.863 1.03E+07 bx V15QG1-V15HN 0.946 7.863 4.56E+06 bx N16HB3-N16HA 2.650 4.761 9.60E+05 bx N16HB2-N16HA 2.947 4.765 1.59E+06 bx N16HB3-N16HB2 2.649 2.949 1.58E+07 bx N16HB2-N16HB3 2.948 2.652 1.12E+07 bx K17HA-K17QG 4.008 1.386 3.06E+06 bx K17HA-K17HD2 4.013 1.764 7.78E+05 bx K17HA-K17HB2 4.005 1.892 5.84E+06 bx K17HA-K17HB3 4.005 2.078 3.43E+06 bx K17HB3-K17HA 2.078 4.009 2.27E+06 bx K17HB2-K17HA 1.895 4.008 4.70E+06 bx K17QG-K17HA 1.393 4.007 2.58E+06 bx K17HN-N16HN 7.764 7.867 3.52E+06 bx K17QE-K17HD2 3.039 1.758 2.24E+06 bx K17QE-K17HD3 3.054 1.679 1.20E+06 bx K17QE-K17QG 3.039 1.391 7.06E+05 bx K17HA-K17HN 4.007 7.765 8.47E+06 bx K17HB3-K17HN 2.087 7.767 5.93E+05 bx K17HB2-K17HN 1.893 7.760 6.65E+05 bx K17QG-K17HN 1.393 7.765 1.35E+06 bx K17HD2-K17QE 1.757 3.042 2.17E+06 bx K17HD3-K17QE 1.681 3.036 8.68E+05 bx K17QG-K17QE 1.395 3.046 6.36E+05 bx K17QG-K17HB3 1.399 2.078 2.48E+06 bx K17HB2-K17HB3 1.896 2.079 1.79E+07 bx K17HB3-K17HB2 2.077 1.894 1.26E+07 bx K17HB3-K17HD2 2.077 1.769 2.86E+06 bx K17HB3-K17HD3 2.080 1.673 1.83E+06 bx K17HB3-K17HG2 2.077 1.403 2.11E+06 bx K17HB2-K17HD2 1.896 1.763 8.33E+06 bx K17HD2-K17HB2 1.765 1.899 6.65E+06 bx K17HD2-K17QG 1.767 1.395 2.47E+06 bx K17HD2-K17HD3 1.754 1.682 1.72E+07 bx K17HD3-K17HD2 1.683 1.758 2.56E+07 bx K17QG-K17HD2 1.392 1.755 3.27E+06 bx V18HA-V18QG1 4.271 0.949 3.28E+06 bx V18HA-V18QG2 4.269 1.041 3.76E+06 bx K17HN-V18HN 7.764 8.360 2.21E+06 bx V15HN-V18HN 7.860 8.355 1.58E+06 bx V18HA-V18HN 4.263 8.362 1.12E+06 bx V18HB-V18HN 1.912 8.359 3.07E+06 bx Q5HB3-A6HN 2.183 8.360 2.47E+06 bx V18QG2-V18HN 1.043 8.359 1.03E+06 bx V18QG1-V18HN 0.949 8.362 4.23E+06 bx V18HB-V18HA 1.908 4.269 2.59E+06 bx V18QG2-V18HA 1.040 4.271 7.34E+06 bx V18QG1-V18HA 0.950 4.271 8.41E+06 bx V18QG2-V18HB 1.043 1.914 9.01E+06 bx V18HB-V18QG2 1.909 1.041 5.31E+06 bx V18HA-V18HB 4.276 1.916 1.98E+06 bx S2HB3-S2HA 3.974 4.913 4.42E+06 bx S2HB2-S2HA 4.012 4.912 3.05E+06 bx P3QD-S2HA 3.859 4.913 1.35E+07 bx S2HB2-S2HN 4.013 8.702 8.46E+05 bx S2HB3-S2HN 3.973 8.703 9.02E+05 bx D21HA-K17QG 4.261 1.360 7.17E+05 bx P19HD2-P19HB3 3.660 2.124 4.38E+06 bx P19HD2-P19QG 3.659 2.079 1.94E+06 bx P19HD3-P19HD2 4.103 3.659 1.94E+07 bx P19HD3-P19QG 4.097 2.088 3.58E+06 bx P19HD3-P19HB3 4.098 2.120 3.75E+06 bx P19HD3-P19HB2 4.089 2.489 7.45E+05 bx P19HD2-P19HB2 3.657 2.495 7.23E+05 bx P19HB2-P19HD2 2.492 3.659 1.17E+06 bx P19HB2-P19HD3 2.494 4.101 1.05E+06 bx P19HB3-P19HD3 2.121 4.102 5.10E+06 bx P19QG-P19HD3 2.083 4.102 2.67E+06 bx P19HB3-P19HD2 2.123 3.659 5.12E+06 bx P19QG-P19HD2 2.080 3.657 1.84E+06 bx P19HB3-P19HB2 2.125 2.493 1.78E+07 bx P19QG-P19HB2 2.066 2.494 6.50E+06 bx P19HB2-P19HB3 2.495 2.132 1.79E+07 bx P19HD2-P19HD3 3.657 4.103 2.12E+07 bx P19HD2-V18QG2 3.657 1.040 4.79E+06 bx P19HD2-V18QG1 3.661 0.950 1.02E+06 bx P19HD3-V18QG2 4.102 1.040 1.87E+06 bx P19HD3-V18QG1 4.102 0.952 7.59E+05 bx V18HA-P19HD2 4.271 3.659 4.20E+06 bx P19HD2-V18HA 3.657 4.272 7.40E+06 bx Q12HA-V15QG2 3.944 1.056 4.26E+06 bx Q12HA-V15QG1 3.945 0.946 1.46E+06 bx P3QD-P3HB3 3.859 2.002 1.90E+06 bx P3QD-P3HB2 3.861 2.422 1.47E+06 bx P3HB2-P3QD 2.431 3.862 1.10E+06 bx P3HG2-P3QD 2.096 3.857 3.66E+06 bx P3HB3-P3QD 2.002 3.858 2.18E+06 bx Q22QB-P19HD2 2.002 3.657 2.54E+06 bx C23HB3-F20HA 2.779 4.174 2.04E+06 bx F20HA-C23HB3 4.175 2.787 1.95E+06 bx Q4HA-K7HB2 4.175 1.919 1.10E+06 bx Q4HA-K7HB3 4.170 1.883 1.62E+06 bx K7HB3-Q4HA 1.885 4.171 1.77E+06 bx S2HB2-Q5QB 3.972 2.184 1.07E+06 bx F20HA-C23HB2 4.173 3.157 2.62E+06 bx M26HA-P29HD2 4.151 3.131 8.54E+05 bx Q5HA-Y8HB2 4.213 3.077 1.82E+06 bx Q5HA-Y8HB3 4.211 3.141 1.28E+06 bx Y8HB2-Q5HA 3.138 4.213 2.04E+06 bx Y8HB2-Q5HA 3.076 4.211 2.14E+06 bx E31HB2-A6QB 2.183 1.446 1.53E+06 bx A6QB-E31HB2 1.445 2.184 2.36E+06 bx Q5HA-A6HN 4.209 8.360 2.72E+06 bx K17HA-V18HN 4.009 8.361 2.08E+06 bx A6HA-L30QD1 4.044 0.932 3.94E+06 bx L30QD1-A6HA 0.929 4.041 4.57E+06 bx P29HB2-P29HB3 2.361 1.679 1.48E+07 bx P29HB3-P29HB2 1.679 2.361 1.16E+07 bx P29HG3-P29HB2 1.813 2.361 5.17E+06 bx A6QB-E31HG2 1.444 2.395 1.99E+06 bx A6QB-E31HG3 1.446 2.281 3.39E+06 bx K7HA-Y10HB3 4.138 2.946 1.45E+06 bx Y10HB3-K7HA 2.951 4.135 1.18E+06 bx S28HA-P29HD3 4.354 3.762 1.27E+06 bx P29HD3-S28HA 3.758 4.354 2.12E+06 bx ?-E11HB3 4.353 2.254 1.33E+06 bx ?-E11HB2 4.351 2.110 1.16E+06 bx E11HB3-? 2.262 4.355 1.94E+06 bx E11HB2-? 2.107 4.354 2.69E+06 bx Y8HB2-Y8HB3 3.078 3.140 2.85E+07 bx Y8QE-Q12HG2 6.795 2.046 2.11E+06 bx Y8QE-Q12HB3 6.794 1.929 9.62E+05 bx Y8QD-Q12HB3 7.155 1.925 7.74E+05 bx Y8QD-Q12HG2 7.152 2.042 7.63E+05 bx Q12HE21-Q12HB2 6.853 1.923 1.18E+06 bx Q12HE21-Q12HG2 6.854 2.046 8.35E+05 bx Q12HE22-Q12HG2 6.948 2.044 1.11E+06 bx Q12HE22-Q12HB2 6.947 1.927 2.46E+06 bx Y8QD-Y8HN 7.158 7.863 1.41E+06 bx Y8QD-C9HN 7.150 7.922 1.62E+06 bx C9HB3-C27HB3 3.232 2.259 1.33E+06 bx C27HB3-C9HB3 2.252 3.231 1.34E+06 bx C27HB3-C9HB2 2.247 2.830 8.11E+05 bx C9HB3-L30QD1 3.232 0.928 1.54E+06 bx C9HB2-L30QD1 2.829 0.929 2.51E+06 bx L30QD1-C9HB2 0.928 2.821 4.59E+06 bx L30QD1-C9HB3 0.927 3.229 2.63E+06 bx A6HA-C9HB3 4.045 3.231 3.38E+06 bx Y10HA-C13HB3 4.187 3.681 1.59E+06 bx Y10HA-C13HB2 4.184 3.431 8.37E+05 bx C13HB3-Y10HA 3.673 4.196 1.38E+06 bx C13HB2-Y10HA 3.442 4.192 1.14E+06 bx Y10QE-C27HB2 6.524 1.788 1.59E+06 bx Y10QD-Y10HN 7.244 8.422 3.97E+06 bx Y10HB2-E11HN 3.096 8.322 1.67E+06 bx Y10HB3-E11HN 2.950 8.324 1.60E+06 bx C13HA-Q12HN 4.070 8.281 1.01E+06 bx E11HA-Q12HN 4.167 8.278 9.66E+05 bx V15QG2-Q12HA 1.056 3.945 5.51E+06 bx V15QG1-Q12HA 0.947 3.947 1.75E+06 bx Q12HG2-Q12HB2 2.043 1.927 4.41E+07 bx Q12HB2-Q12HG2 1.929 2.040 2.38E+07 bx Y10HA-C13HN 4.198 8.120 1.41E+06 bx C13HB2-C23HB3 3.441 2.787 1.02E+06 bx C23HB3-C13HB2 2.778 3.440 1.16E+06 bx C13HB2-V18HB 3.438 1.915 2.66E+06 bx V18HB-C13HB2 1.914 3.435 2.39E+06 bx V18QG2-C13HB2 1.040 3.432 1.04E+06 bx V18QG1-C13HB2 0.950 3.437 1.30E+06 bx C13HB3-N14HN 3.679 7.609 1.24E+06 bx C13HB2-N14HN 3.442 7.606 9.47E+05 bx Q12HA-V15HN 3.945 7.863 2.55E+06 bx N14HB2-V15HN 2.997 7.864 2.73E+06 bx N16HB2-N16HN 2.964 7.866 1.55E+06 bx N16HB2-N16HN 2.936 7.863 1.36E+06 bx N16HB3-N16HN 2.650 7.865 3.01E+06 bx V18QG1-N16HB3 0.950 2.650 5.25E+06 bx V18QG1-N16HB2 0.951 2.951 4.69E+06 bx N16HB3-V18QG1 2.650 0.950 2.81E+06 bx N16HB2-V18QG1 2.958 0.973 4.36E+05 bx N16HB2-V18QG1 2.948 0.951 1.42E+06 bx V18QG1-K17HN 0.950 7.768 1.09E+06 bx K17HN-V18QG1 7.763 0.950 8.09E+05 bx D21HA-Y24HB3 4.264 2.889 1.74E+06 bx C23HA-V18QG2 4.031 1.041 2.47E+06 bx Y24HB3-D21HA 2.888 4.266 2.14E+06 bx V18QG2-P19HD3 1.039 4.101 3.26E+06 bx V18QG2-C23HA 1.040 4.033 3.25E+06 bx C23HA-Q25QB 4.029 2.153 1.45E+06 bx C23HB3-V18QG2 2.793 1.039 2.04E+06 bx V18QG2-C23HB3 1.039 2.789 3.13E+06 bx V18QG2-P19HD2 1.040 3.659 6.66E+06 bx C13HA-V18HB 4.053 1.916 3.55E+06 bx Q22HA-Q25QB 4.079 2.152 4.22E+06 bx Q25QB-Q22HA 2.152 4.079 3.60E+06 bx V18HB-C13HA 1.913 4.057 3.19E+06 bx V18HB-P19HD2 1.915 3.666 1.12E+06 bx P19HD2-V18HB 3.666 1.914 1.34E+06 bx P19HD2-Q22QB 3.657 2.002 2.54E+06 bx C23HB3-V18HB 2.798 1.920 7.49E+05 bx V18HB-C23HB3 1.916 2.792 6.41E+05 bx V18HA-P19HD3 4.273 4.107 6.49E+06 bx P19HD3-V18HA 4.100 4.271 1.29E+07 bx V18QG1-P19HD2 0.953 3.674 1.13E+06 bx V18QG2-C23HB2 1.039 3.160 1.32E+06 bx C23HB2-V18QG2 3.164 1.040 8.41E+05 bx V18QG2-Q22QB 1.040 2.003 1.02E+07 bx Q22QB-V18QG2 2.003 1.040 6.98E+06 bx P19HB2-P19HA 2.494 4.491 6.47E+06 bx P19HB3-P19HA 2.122 4.490 3.81E+06 bx P19QG-P19HA 2.079 4.490 1.62E+06 bx P19HB3-F20HN 2.120 8.872 1.01E+06 bx P19HB3-D21HN 2.126 8.998 8.35E+05 bx Y24HB2-F20QD 2.688 7.298 8.17E+05 bx C23HB2-F20HA 3.161 4.175 2.35E+06 bx Y24QD-D21HA 7.127 4.262 9.42E+05 bx V18QG2-Q22HG2 1.044 2.352 1.42E+06 bx Q22HG2-V18QG2 2.354 1.046 9.97E+05 bx Q22HG3-V18QG2 2.420 1.040 8.08E+05 bx Q22HN-V18QG2 7.440 1.039 9.11E+05 bx V18QG2-Q22HN 1.041 7.440 9.61E+05 bx C23HN-V18QG2 8.569 1.039 2.45E+06 bx C27HN-Y24HA 8.440 4.035 1.30E+06 bx Y24HA-Y10QE 4.037 6.525 2.67E+06 bx A6QB-Y10QE 1.446 6.524 2.51E+06 bx A6QB-Y10QD 1.445 7.243 2.11E+06 bx M26HB2-C23HA 2.145 4.032 1.23E+06 bx C23HA-M26QE 4.029 2.052 2.01E+06 bx Q22HA-Q25HN 4.077 7.606 2.03E+06 bx Q22HG2-Q25HN 2.356 7.608 8.89E+05 bx Q22HG3-Q25HN 2.412 7.608 6.90E+05 bx Y24HA-S28HN 4.036 8.252 1.15E+06 bx Y24HA-Q25HN 4.036 7.592 1.49E+06 bx P29HA-P29HB2 4.331 2.361 2.63E+06 bx P29HB2-P29HG3 2.360 1.816 2.56E+06 bx P29HB2-P29HG2 2.363 1.969 4.26E+06 bx P29HG2-P29HB2 1.966 2.362 5.71E+06 bx L30HN-P29HD2 7.599 3.139 1.41E+06 bx N16HB3-N16HD21 2.651 7.589 2.74E+06 bx P29HD2-L30HN 3.136 7.600 8.66E+05 bx P29HG2-M26HN 1.982 7.595 1.02E+06 bx E31HB2-L30QD2 2.187 0.860 1.03E+06 bx E31HB2-L30QD1 2.180 0.930 1.27E+06 bx E31HN-S28HA 7.896 4.348 1.38E+06 bx L30HA-E31HN 4.222 7.900 1.30E+06 bx A6QB-E31HN 1.449 7.894 9.34E+05 bx E31HN-A6QB 7.893 1.450 9.31E+05 bx E31HA-A6QB 4.301 1.445 9.84E+05 bx E31HG2-A6QB 2.393 1.445 1.52E+06 bx E31HG3-A6QB 2.285 1.447 1.91E+06 bx A6QB-E31HB3 1.443 2.108 1.64E+06 bx L30QD1-E31HB2 0.931 2.183 2.52E+06 bx L30QD2-E31HB2 0.857 2.184 1.59E+06 bx R32HN-E31HN 7.663 7.892 3.50E+06 bx R32HN-E31HB3 7.663 2.097 6.43E+05 bx R32HN-E31HB2 7.663 2.189 6.28E+05 bx A6QB-P3HA 1.446 4.457 2.72E+06 bx A6QB-E31HA 1.445 4.308 2.59E+06 bx P3HB2-P3HA 2.427 4.456 4.25E+06 bx P3HB3-P3HA 1.996 4.456 3.23E+06 bx E31HA-R32HN 4.307 7.662 1.01E+06 bx P29HB2-P29HA 2.362 4.336 5.92E+06 bx Q5QB-S2HB2 2.183 3.974 8.45E+05 bx N16HB2-N16HD21 2.963 7.589 1.40E+06 bx N16HB2-N16HD21 2.936 7.587 1.59E+06 bx C13HA-V18QG1 4.061 0.949 4.20E+06 bx V18QG1-C13HA 0.949 4.064 6.02E+06 bx Q12HE22-Q12HE21 6.947 6.852 4.44E+07 bx Q22HE21-Q22HE22 7.479 6.917 6.55E+07 bx Q25HE22-Q25HE21 7.534 6.896 7.15E+07 bx Q4HE21-Q4HE22 7.609 6.869 6.69E+07 bx Q5HE22-Q5HE21 7.603 6.924 7.47E+07 bx N14HD21-N14HD22 7.716 6.993 6.05E+07 bx N16HD21-N16HD22 7.589 6.889 6.17E+07 bx N14QB-N14HD21 2.997 7.717 1.94E+06 bx N14HD21-N14QB 7.717 2.998 2.08E+06 bx N14HD21-E11HA 7.717 4.164 9.23E+05 bx N14HD22-N14HD21 6.993 7.716 5.79E+07 bx N14QB-N14HD22 2.996 6.994 9.36E+05 bx N14HD22-N14QB 6.994 2.997 1.17E+06 bx N16HD21-V15QG1 7.591 0.945 1.96E+06 bx N16HD22-Q12HB3 6.887 1.973 1.09E+06 bx N16HD22-V18QG1 6.889 0.947 1.16E+06 bx N16HB2-N16HD22 2.963 6.887 9.04E+05 bx N16HB2-N16HD22 2.937 6.888 9.91E+05 bx N16HB3-N16HD22 2.648 6.889 1.30E+06 bx V18QG1-N16HD22 0.946 6.887 1.25E+06 bx V18QG1-N16HD21 0.946 7.588 1.33E+06 bx N16HD22-N16HD21 6.888 7.588 5.90E+07 bx Q4HE22-Q4HE21 6.869 7.610 6.83E+07 bx Q5HE21-Q5HE22 6.924 7.603 7.35E+07 bx Q25HE21-Q25HE22 6.896 7.534 7.37E+07 bx Q22HE22-Q22HE21 6.917 7.479 6.71E+07 bx Q22HE21-Q22HG3 7.480 2.418 1.27E+06 bx Q12HE21-Q12HE22 6.852 6.947 5.05E+07 bx Q12HE22-Q12HA 6.950 3.946 7.30E+05 bx Q12HE21-Q12HA 6.848 3.945 5.75E+05 bx Q12HE21-V15QG1 6.851 0.947 7.47E+05 bx Q12HE21-V15QG2 6.853 1.055 1.31E+06 bx Q12HG2-Q12HE22 2.040 6.943 1.33E+06 bx Q12HB2-Q12HE22 1.929 6.945 1.30E+06 bx V15QG2-Q12HE21 1.057 6.853 1.26E+06 bx V15QG2-Q12HE22 1.059 6.943 7.63E+05 bx V15QG1-Q12HE21 0.946 6.855 8.55E+05 bx Q4HE22-Q4QG 6.870 2.420 6.95E+05 bx Q5HE21-Q5QG 6.921 2.481 1.09E+06 bx Q5QG-Q5HE21 2.478 6.926 8.88E+05 bx Q22HE22-Q22HG3 6.919 2.414 6.14E+05 bx Q22HG3-Q22HE21 2.421 7.478 9.30E+05 bx ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 H . . 3.129 ppm . . . 256 . . 30597 4 2 . . C 13 C-aromatic . . 30 ppm . . . 0 . . 30597 4 stop_ save_