data_30352 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30352 _Entry.Title ; NMR structure of U21-hexatoxin-Hi1a toxin from Australian Funnel-web spider Hadronyche infensa ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-10-12 _Entry.Accession_date 2017-10-12 _Entry.Last_release_date 2017-10-20 _Entry.Original_release_date 2017-10-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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_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 Y.K. Chin Y.K. Y. . . 30352 2 S. Pineda S. S. . . 30352 3 G. King G. F. . . 30352 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Spider toxin Inhibitor cystine knot' . 30352 TOXIN . 30352 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30352 spectral_peak_list 3 30352 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 282 30352 '15N chemical shifts' 78 30352 '1H chemical shifts' 438 30352 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 . . 2018-10-08 . original BMRB . 30352 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6BA3 'BMRB Entry Tracking System' 30352 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30352 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Single-gene recruitment underlies venom complexity in the Australian Funnel-web spider Hadronyche infensa ; _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 S. Pineda S. S. . . 30352 1 2 Y.K. Chin Y.K. Y. . . 30352 1 3 S. Senff S. . . . 30352 1 4 M. Mobli M. . . . 30352 1 5 P. Escoubas P. . . . 30352 1 6 G. Nicholson G. . . . 30352 1 7 Q. Kass Q. . . . 30352 1 8 B. Fry B. G. . . 30352 1 9 J. Mattick J. S. . . 30352 1 10 G. King G. F. . . 30352 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30352 _Assembly.ID 1 _Assembly.Name U21-hexatoxin-Hi1a _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 . . . . . . 30352 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 23 23 SG . 1 . 1 CYS 37 37 SG . . . . . . . . . . . . 30352 1 2 disulfide single . 1 . 1 CYS 30 30 SG . 1 . 1 CYS 49 49 SG . . . . . . . . . . . . 30352 1 3 disulfide single . 1 . 1 CYS 36 36 SG . 1 . 1 CYS 64 64 SG . . . . . . . . . . . . 30352 1 4 disulfide single . 1 . 1 CYS 67 67 SG . 1 . 1 CYS 74 74 SG . . . . . . . . . . . . 30352 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30352 _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 ; SNRWNLGYGIPHKQVKLPNG QLCKEPGDSCSKRDECCKAD DQKTYSSGCAQTWSAMEGGF VRECYICAVESSMC ; _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 74 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8197.243 _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 . SER . 30352 1 2 . ASN . 30352 1 3 . ARG . 30352 1 4 . TRP . 30352 1 5 . ASN . 30352 1 6 . LEU . 30352 1 7 . GLY . 30352 1 8 . TYR . 30352 1 9 . GLY . 30352 1 10 . ILE . 30352 1 11 . PRO . 30352 1 12 . HIS . 30352 1 13 . LYS . 30352 1 14 . GLN . 30352 1 15 . VAL . 30352 1 16 . LYS . 30352 1 17 . LEU . 30352 1 18 . PRO . 30352 1 19 . ASN . 30352 1 20 . GLY . 30352 1 21 . GLN . 30352 1 22 . LEU . 30352 1 23 . CYS . 30352 1 24 . LYS . 30352 1 25 . GLU . 30352 1 26 . PRO . 30352 1 27 . GLY . 30352 1 28 . ASP . 30352 1 29 . SER . 30352 1 30 . CYS . 30352 1 31 . SER . 30352 1 32 . LYS . 30352 1 33 . ARG . 30352 1 34 . ASP . 30352 1 35 . GLU . 30352 1 36 . CYS . 30352 1 37 . CYS . 30352 1 38 . LYS . 30352 1 39 . ALA . 30352 1 40 . ASP . 30352 1 41 . ASP . 30352 1 42 . GLN . 30352 1 43 . LYS . 30352 1 44 . THR . 30352 1 45 . TYR . 30352 1 46 . SER . 30352 1 47 . SER . 30352 1 48 . GLY . 30352 1 49 . CYS . 30352 1 50 . ALA . 30352 1 51 . GLN . 30352 1 52 . THR . 30352 1 53 . TRP . 30352 1 54 . SER . 30352 1 55 . ALA . 30352 1 56 . MET . 30352 1 57 . GLU . 30352 1 58 . GLY . 30352 1 59 . GLY . 30352 1 60 . PHE . 30352 1 61 . VAL . 30352 1 62 . ARG . 30352 1 63 . GLU . 30352 1 64 . CYS . 30352 1 65 . TYR . 30352 1 66 . ILE . 30352 1 67 . CYS . 30352 1 68 . ALA . 30352 1 69 . VAL . 30352 1 70 . GLU . 30352 1 71 . SER . 30352 1 72 . SER . 30352 1 73 . MET . 30352 1 74 . CYS . 30352 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 . SER 1 1 30352 1 . ASN 2 2 30352 1 . ARG 3 3 30352 1 . TRP 4 4 30352 1 . ASN 5 5 30352 1 . LEU 6 6 30352 1 . GLY 7 7 30352 1 . TYR 8 8 30352 1 . GLY 9 9 30352 1 . ILE 10 10 30352 1 . PRO 11 11 30352 1 . HIS 12 12 30352 1 . LYS 13 13 30352 1 . GLN 14 14 30352 1 . VAL 15 15 30352 1 . LYS 16 16 30352 1 . LEU 17 17 30352 1 . PRO 18 18 30352 1 . ASN 19 19 30352 1 . GLY 20 20 30352 1 . GLN 21 21 30352 1 . LEU 22 22 30352 1 . CYS 23 23 30352 1 . LYS 24 24 30352 1 . GLU 25 25 30352 1 . PRO 26 26 30352 1 . GLY 27 27 30352 1 . ASP 28 28 30352 1 . SER 29 29 30352 1 . CYS 30 30 30352 1 . SER 31 31 30352 1 . LYS 32 32 30352 1 . ARG 33 33 30352 1 . ASP 34 34 30352 1 . GLU 35 35 30352 1 . CYS 36 36 30352 1 . CYS 37 37 30352 1 . LYS 38 38 30352 1 . ALA 39 39 30352 1 . ASP 40 40 30352 1 . ASP 41 41 30352 1 . GLN 42 42 30352 1 . LYS 43 43 30352 1 . THR 44 44 30352 1 . TYR 45 45 30352 1 . SER 46 46 30352 1 . SER 47 47 30352 1 . GLY 48 48 30352 1 . CYS 49 49 30352 1 . ALA 50 50 30352 1 . GLN 51 51 30352 1 . THR 52 52 30352 1 . TRP 53 53 30352 1 . SER 54 54 30352 1 . ALA 55 55 30352 1 . MET 56 56 30352 1 . GLU 57 57 30352 1 . GLY 58 58 30352 1 . GLY 59 59 30352 1 . PHE 60 60 30352 1 . VAL 61 61 30352 1 . ARG 62 62 30352 1 . GLU 63 63 30352 1 . CYS 64 64 30352 1 . TYR 65 65 30352 1 . ILE 66 66 30352 1 . CYS 67 67 30352 1 . ALA 68 68 30352 1 . VAL 69 69 30352 1 . GLU 70 70 30352 1 . SER 71 71 30352 1 . SER 72 72 30352 1 . MET 73 73 30352 1 . CYS 74 74 30352 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 30352 _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 . 153481 organism . 'Hadronyche infensa' spiders . . Eukaryota Metazoa Hadronyche infensa . . . . . . . . . . . . . 30352 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 30352 _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 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30352 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30352 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM Sodium citrate, 5 % D2O, 300 uM [U-99% 13C; U-99% 15N] sf26, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 D2O 'natural abundance' . . . . . . 5 . . % . . . . 30352 1 2 'Sodium citrate' 'natural abundance' . . . . . . 20 . . mM . . . . 30352 1 3 sf26 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 300 . . uM . . . . 30352 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30352 _Sample_condition_list.ID 1 _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' 20 . mM 30352 1 pH 4 . pH 30352 1 pressure 1 . atm 30352 1 temperature 298 . K 30352 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30352 _Software.ID 1 _Software.Type . _Software.Name Analysis _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 30352 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 30352 1 'peak picking' 30352 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30352 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30352 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 30352 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30352 _Software.ID 3 _Software.Type . _Software.Name Rowland_NMR_Toolkit _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'For processing NUS data' . . 30352 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30352 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30352 _Software.ID 4 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 30352 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 30352 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30352 _Software.ID 5 _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' . . 30352 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 30352 5 processing 30352 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 30352 _Software.ID 6 _Software.Type . _Software.Name cyana _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30352 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30352 6 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 30352 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30352 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 30352 _NMR_spectrometer_list.ID 1 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 AvanceII . 600 . . . 30352 1 2 NMR_spectrometer_2 Bruker AvanceII . 900 . . . 30352 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 30352 _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-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30352 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30352 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30352 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30352 1 5 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30352 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30352 1 7 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30352 1 8 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30352 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 30352 _Chem_shift_reference.ID 1 _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 water protons . . . . ppm 4.683 internal indirect 0.25144253 . . . . . 30352 1 H 1 water protons . . . . ppm 4.683 internal direct 1 . . . . . 30352 1 N 15 water protons . . . . ppm 4.683 internal indirect 0.10132912 . . . . . 30352 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 30352 _Assigned_chem_shift_list.ID 1 _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-15N HSQC' . . . 30352 1 2 '3D HNCO' . . . 30352 1 3 '3D HNCACB' . . . 30352 1 4 '3D CBCA(CO)NH' . . . 30352 1 5 '3D HBHA(CO)NH' . . . 30352 1 6 '3D 1H-15N NOESY' . . . 30352 1 7 '3D 1H-13C NOESY aromatic' . . . 30352 1 8 '3D 1H-13C NOESY aliphatic' . . . 30352 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 SER HA H 1 4.160 0.000 . 1 . . . . A 1 SER HA . 30352 1 2 . 1 1 1 1 SER HB2 H 1 3.895 0.000 . 2 . . . . A 1 SER HB2 . 30352 1 3 . 1 1 1 1 SER HB3 H 1 3.895 0.000 . 2 . . . . A 1 SER HB3 . 30352 1 4 . 1 1 1 1 SER C C 13 170.660 0.000 . 1 . . . . A 1 SER C . 30352 1 5 . 1 1 1 1 SER CA C 13 57.236 0.000 . 1 . . . . A 1 SER CA . 30352 1 6 . 1 1 1 1 SER CB C 13 63.331 0.000 . 1 . . . . A 1 SER CB . 30352 1 7 . 1 1 2 2 ASN H H 1 8.868 0.003 . 1 . . . . A 2 ASN H . 30352 1 8 . 1 1 2 2 ASN HA H 1 4.764 0.000 . 1 . . . . A 2 ASN HA . 30352 1 9 . 1 1 2 2 ASN HB2 H 1 2.879 0.001 . 2 . . . . A 2 ASN HB2 . 30352 1 10 . 1 1 2 2 ASN HB3 H 1 2.828 0.003 . 2 . . . . A 2 ASN HB3 . 30352 1 11 . 1 1 2 2 ASN HD21 H 1 7.020 0.000 . 2 . . . . A 2 ASN HD21 . 30352 1 12 . 1 1 2 2 ASN HD22 H 1 7.585 0.000 . 2 . . . . A 2 ASN HD22 . 30352 1 13 . 1 1 2 2 ASN C C 13 176.137 0.000 . 1 . . . . A 2 ASN C . 30352 1 14 . 1 1 2 2 ASN CA C 13 52.922 0.000 . 1 . . . . A 2 ASN CA . 30352 1 15 . 1 1 2 2 ASN CB C 13 39.273 0.004 . 1 . . . . A 2 ASN CB . 30352 1 16 . 1 1 2 2 ASN N N 15 120.324 0.074 . 1 . . . . A 2 ASN N . 30352 1 17 . 1 1 2 2 ASN ND2 N 15 112.916 0.004 . 1 . . . . A 2 ASN ND2 . 30352 1 18 . 1 1 3 3 ARG H H 1 8.444 0.003 . 1 . . . . A 3 ARG H . 30352 1 19 . 1 1 3 3 ARG HA H 1 3.792 0.000 . 1 . . . . A 3 ARG HA . 30352 1 20 . 1 1 3 3 ARG HB2 H 1 1.389 0.000 . 2 . . . . A 3 ARG HB2 . 30352 1 21 . 1 1 3 3 ARG HB3 H 1 1.460 0.000 . 2 . . . . A 3 ARG HB3 . 30352 1 22 . 1 1 3 3 ARG C C 13 176.997 0.000 . 1 . . . . A 3 ARG C . 30352 1 23 . 1 1 3 3 ARG CA C 13 58.600 0.000 . 1 . . . . A 3 ARG CA . 30352 1 24 . 1 1 3 3 ARG CB C 13 29.270 0.004 . 1 . . . . A 3 ARG CB . 30352 1 25 . 1 1 3 3 ARG N N 15 118.870 0.009 . 1 . . . . A 3 ARG N . 30352 1 26 . 1 1 4 4 TRP H H 1 8.015 0.001 . 1 . . . . A 4 TRP H . 30352 1 27 . 1 1 4 4 TRP HA H 1 4.350 0.000 . 1 . . . . A 4 TRP HA . 30352 1 28 . 1 1 4 4 TRP HB2 H 1 3.384 0.000 . 2 . . . . A 4 TRP HB2 . 30352 1 29 . 1 1 4 4 TRP HB3 H 1 3.252 0.000 . 2 . . . . A 4 TRP HB3 . 30352 1 30 . 1 1 4 4 TRP HD1 H 1 7.245 0.001 . 1 . . . . A 4 TRP HD1 . 30352 1 31 . 1 1 4 4 TRP HE1 H 1 10.162 0.000 . 1 . . . . A 4 TRP HE1 . 30352 1 32 . 1 1 4 4 TRP HE3 H 1 7.640 0.001 . 1 . . . . A 4 TRP HE3 . 30352 1 33 . 1 1 4 4 TRP HZ2 H 1 7.450 0.001 . 1 . . . . A 4 TRP HZ2 . 30352 1 34 . 1 1 4 4 TRP HZ3 H 1 7.083 0.001 . 1 . . . . A 4 TRP HZ3 . 30352 1 35 . 1 1 4 4 TRP HH2 H 1 7.215 0.001 . 1 . . . . A 4 TRP HH2 . 30352 1 36 . 1 1 4 4 TRP C C 13 179.170 0.000 . 1 . . . . A 4 TRP C . 30352 1 37 . 1 1 4 4 TRP CA C 13 60.088 0.000 . 1 . . . . A 4 TRP CA . 30352 1 38 . 1 1 4 4 TRP CB C 13 28.247 0.001 . 1 . . . . A 4 TRP CB . 30352 1 39 . 1 1 4 4 TRP CD1 C 13 127.540 0.019 . 1 . . . . A 4 TRP CD1 . 30352 1 40 . 1 1 4 4 TRP CE3 C 13 120.748 0.010 . 1 . . . . A 4 TRP CE3 . 30352 1 41 . 1 1 4 4 TRP CZ2 C 13 114.833 0.007 . 1 . . . . A 4 TRP CZ2 . 30352 1 42 . 1 1 4 4 TRP CZ3 C 13 122.318 0.082 . 1 . . . . A 4 TRP CZ3 . 30352 1 43 . 1 1 4 4 TRP CH2 C 13 125.022 0.001 . 1 . . . . A 4 TRP CH2 . 30352 1 44 . 1 1 4 4 TRP N N 15 122.139 0.029 . 1 . . . . A 4 TRP N . 30352 1 45 . 1 1 4 4 TRP NE1 N 15 129.405 0.000 . 1 . . . . A 4 TRP NE1 . 30352 1 46 . 1 1 5 5 ASN H H 1 8.142 0.002 . 1 . . . . A 5 ASN H . 30352 1 47 . 1 1 5 5 ASN HA H 1 4.649 0.000 . 1 . . . . A 5 ASN HA . 30352 1 48 . 1 1 5 5 ASN HB2 H 1 2.935 0.000 . 2 . . . . A 5 ASN HB2 . 30352 1 49 . 1 1 5 5 ASN HB3 H 1 2.787 0.000 . 2 . . . . A 5 ASN HB3 . 30352 1 50 . 1 1 5 5 ASN HD21 H 1 6.972 0.000 . 2 . . . . A 5 ASN HD21 . 30352 1 51 . 1 1 5 5 ASN HD22 H 1 7.683 0.000 . 2 . . . . A 5 ASN HD22 . 30352 1 52 . 1 1 5 5 ASN C C 13 175.412 0.000 . 1 . . . . A 5 ASN C . 30352 1 53 . 1 1 5 5 ASN CA C 13 54.982 0.000 . 1 . . . . A 5 ASN CA . 30352 1 54 . 1 1 5 5 ASN CB C 13 38.428 0.001 . 1 . . . . A 5 ASN CB . 30352 1 55 . 1 1 5 5 ASN N N 15 119.554 0.010 . 1 . . . . A 5 ASN N . 30352 1 56 . 1 1 5 5 ASN ND2 N 15 111.574 0.007 . 1 . . . . A 5 ASN ND2 . 30352 1 57 . 1 1 6 6 LEU H H 1 7.315 0.004 . 1 . . . . A 6 LEU H . 30352 1 58 . 1 1 6 6 LEU HA H 1 4.388 0.000 . 1 . . . . A 6 LEU HA . 30352 1 59 . 1 1 6 6 LEU HB2 H 1 2.071 0.000 . 2 . . . . A 6 LEU HB2 . 30352 1 60 . 1 1 6 6 LEU HB3 H 1 1.468 0.004 . 2 . . . . A 6 LEU HB3 . 30352 1 61 . 1 1 6 6 LEU HG H 1 0.794 0.000 . 1 . . . . A 6 LEU HG . 30352 1 62 . 1 1 6 6 LEU HD11 H 1 0.706 0.000 . 2 . . . . A 6 LEU HD11 . 30352 1 63 . 1 1 6 6 LEU HD12 H 1 0.706 0.000 . 2 . . . . A 6 LEU HD12 . 30352 1 64 . 1 1 6 6 LEU HD13 H 1 0.706 0.000 . 2 . . . . A 6 LEU HD13 . 30352 1 65 . 1 1 6 6 LEU C C 13 176.011 0.000 . 1 . . . . A 6 LEU C . 30352 1 66 . 1 1 6 6 LEU CA C 13 54.795 0.000 . 1 . . . . A 6 LEU CA . 30352 1 67 . 1 1 6 6 LEU CB C 13 42.019 0.005 . 1 . . . . A 6 LEU CB . 30352 1 68 . 1 1 6 6 LEU CG C 13 26.662 0.001 . 1 . . . . A 6 LEU CG . 30352 1 69 . 1 1 6 6 LEU CD1 C 13 22.950 0.001 . 1 . . . . A 6 LEU CD1 . 30352 1 70 . 1 1 6 6 LEU N N 15 118.238 0.002 . 1 . . . . A 6 LEU N . 30352 1 71 . 1 1 7 7 GLY H H 1 7.593 0.002 . 1 . . . . A 7 GLY H . 30352 1 72 . 1 1 7 7 GLY HA2 H 1 4.699 0.000 . 2 . . . . A 7 GLY HA2 . 30352 1 73 . 1 1 7 7 GLY HA3 H 1 3.670 0.000 . 2 . . . . A 7 GLY HA3 . 30352 1 74 . 1 1 7 7 GLY C C 13 175.513 0.000 . 1 . . . . A 7 GLY C . 30352 1 75 . 1 1 7 7 GLY CA C 13 46.281 0.000 . 1 . . . . A 7 GLY CA . 30352 1 76 . 1 1 7 7 GLY N N 15 105.064 0.000 . 1 . . . . A 7 GLY N . 30352 1 77 . 1 1 8 8 TYR H H 1 7.680 0.001 . 1 . . . . A 8 TYR H . 30352 1 78 . 1 1 8 8 TYR HA H 1 3.337 0.003 . 1 . . . . A 8 TYR HA . 30352 1 79 . 1 1 8 8 TYR HB2 H 1 2.512 0.000 . 2 . . . . A 8 TYR HB2 . 30352 1 80 . 1 1 8 8 TYR HB3 H 1 2.512 0.000 . 2 . . . . A 8 TYR HB3 . 30352 1 81 . 1 1 8 8 TYR HD1 H 1 6.323 0.000 . 1 . . . . A 8 TYR HD1 . 30352 1 82 . 1 1 8 8 TYR HD2 H 1 6.323 0.000 . 1 . . . . A 8 TYR HD2 . 30352 1 83 . 1 1 8 8 TYR HE1 H 1 6.585 0.002 . 1 . . . . A 8 TYR HE1 . 30352 1 84 . 1 1 8 8 TYR HE2 H 1 6.585 0.002 . 1 . . . . A 8 TYR HE2 . 30352 1 85 . 1 1 8 8 TYR C C 13 175.220 0.000 . 1 . . . . A 8 TYR C . 30352 1 86 . 1 1 8 8 TYR CA C 13 61.930 0.001 . 1 . . . . A 8 TYR CA . 30352 1 87 . 1 1 8 8 TYR CB C 13 39.607 0.000 . 1 . . . . A 8 TYR CB . 30352 1 88 . 1 1 8 8 TYR CD2 C 13 132.466 0.000 . 1 . . . . A 8 TYR CD2 . 30352 1 89 . 1 1 8 8 TYR CE2 C 13 118.290 0.000 . 1 . . . . A 8 TYR CE2 . 30352 1 90 . 1 1 8 8 TYR N N 15 118.102 0.005 . 1 . . . . A 8 TYR N . 30352 1 91 . 1 1 9 9 GLY H H 1 8.774 0.002 . 1 . . . . A 9 GLY H . 30352 1 92 . 1 1 9 9 GLY HA2 H 1 3.825 0.000 . 2 . . . . A 9 GLY HA2 . 30352 1 93 . 1 1 9 9 GLY HA3 H 1 3.588 0.000 . 2 . . . . A 9 GLY HA3 . 30352 1 94 . 1 1 9 9 GLY C C 13 174.536 0.000 . 1 . . . . A 9 GLY C . 30352 1 95 . 1 1 9 9 GLY CA C 13 44.922 0.000 . 1 . . . . A 9 GLY CA . 30352 1 96 . 1 1 9 9 GLY N N 15 102.441 0.001 . 1 . . . . A 9 GLY N . 30352 1 97 . 1 1 10 10 ILE H H 1 7.555 0.002 . 1 . . . . A 10 ILE H . 30352 1 98 . 1 1 10 10 ILE HA H 1 3.953 0.019 . 1 . . . . A 10 ILE HA . 30352 1 99 . 1 1 10 10 ILE HB H 1 1.602 0.001 . 1 . . . . A 10 ILE HB . 30352 1 100 . 1 1 10 10 ILE HG12 H 1 1.153 0.000 . 2 . . . . A 10 ILE HG12 . 30352 1 101 . 1 1 10 10 ILE HG13 H 1 0.718 0.000 . 2 . . . . A 10 ILE HG13 . 30352 1 102 . 1 1 10 10 ILE HG21 H 1 -0.128 0.000 . 1 . . . . A 10 ILE HG21 . 30352 1 103 . 1 1 10 10 ILE HG22 H 1 -0.128 0.000 . 1 . . . . A 10 ILE HG22 . 30352 1 104 . 1 1 10 10 ILE HG23 H 1 -0.128 0.000 . 1 . . . . A 10 ILE HG23 . 30352 1 105 . 1 1 10 10 ILE HD11 H 1 0.509 0.001 . 1 . . . . A 10 ILE HD11 . 30352 1 106 . 1 1 10 10 ILE HD12 H 1 0.509 0.001 . 1 . . . . A 10 ILE HD12 . 30352 1 107 . 1 1 10 10 ILE HD13 H 1 0.509 0.001 . 1 . . . . A 10 ILE HD13 . 30352 1 108 . 1 1 10 10 ILE CA C 13 58.758 0.000 . 1 . . . . A 10 ILE CA . 30352 1 109 . 1 1 10 10 ILE CB C 13 37.278 0.046 . 1 . . . . A 10 ILE CB . 30352 1 110 . 1 1 10 10 ILE CG1 C 13 27.837 0.100 . 1 . . . . A 10 ILE CG1 . 30352 1 111 . 1 1 10 10 ILE CG2 C 13 15.470 0.000 . 1 . . . . A 10 ILE CG2 . 30352 1 112 . 1 1 10 10 ILE CD1 C 13 12.680 0.012 . 1 . . . . A 10 ILE CD1 . 30352 1 113 . 1 1 10 10 ILE N N 15 126.328 0.002 . 1 . . . . A 10 ILE N . 30352 1 114 . 1 1 11 11 PRO HA H 1 4.089 0.004 . 1 . . . . A 11 PRO HA . 30352 1 115 . 1 1 11 11 PRO HB2 H 1 1.764 0.000 . 2 . . . . A 11 PRO HB2 . 30352 1 116 . 1 1 11 11 PRO HB3 H 1 2.132 0.000 . 2 . . . . A 11 PRO HB3 . 30352 1 117 . 1 1 11 11 PRO HG2 H 1 2.043 0.000 . 2 . . . . A 11 PRO HG2 . 30352 1 118 . 1 1 11 11 PRO HG3 H 1 1.852 0.000 . 2 . . . . A 11 PRO HG3 . 30352 1 119 . 1 1 11 11 PRO HD2 H 1 3.333 0.001 . 2 . . . . A 11 PRO HD2 . 30352 1 120 . 1 1 11 11 PRO HD3 H 1 3.995 0.007 . 2 . . . . A 11 PRO HD3 . 30352 1 121 . 1 1 11 11 PRO C C 13 176.109 0.000 . 1 . . . . A 11 PRO C . 30352 1 122 . 1 1 11 11 PRO CA C 13 64.428 0.000 . 1 . . . . A 11 PRO CA . 30352 1 123 . 1 1 11 11 PRO CB C 13 31.925 0.024 . 1 . . . . A 11 PRO CB . 30352 1 124 . 1 1 11 11 PRO CG C 13 27.620 0.000 . 1 . . . . A 11 PRO CG . 30352 1 125 . 1 1 11 11 PRO CD C 13 51.442 0.056 . 1 . . . . A 11 PRO CD . 30352 1 126 . 1 1 12 12 HIS H H 1 8.210 0.003 . 1 . . . . A 12 HIS H . 30352 1 127 . 1 1 12 12 HIS HA H 1 4.716 0.000 . 1 . . . . A 12 HIS HA . 30352 1 128 . 1 1 12 12 HIS HB2 H 1 2.646 0.000 . 2 . . . . A 12 HIS HB2 . 30352 1 129 . 1 1 12 12 HIS HB3 H 1 2.724 0.000 . 2 . . . . A 12 HIS HB3 . 30352 1 130 . 1 1 12 12 HIS HD2 H 1 6.318 0.000 . 1 . . . . A 12 HIS HD2 . 30352 1 131 . 1 1 12 12 HIS HE1 H 1 8.194 0.000 . 1 . . . . A 12 HIS HE1 . 30352 1 132 . 1 1 12 12 HIS CA C 13 54.779 0.000 . 1 . . . . A 12 HIS CA . 30352 1 133 . 1 1 12 12 HIS CB C 13 30.542 0.000 . 1 . . . . A 12 HIS CB . 30352 1 134 . 1 1 12 12 HIS CD2 C 13 119.012 0.000 . 1 . . . . A 12 HIS CD2 . 30352 1 135 . 1 1 12 12 HIS CE1 C 13 136.673 0.000 . 1 . . . . A 12 HIS CE1 . 30352 1 136 . 1 1 12 12 HIS N N 15 120.049 0.005 . 1 . . . . A 12 HIS N . 30352 1 137 . 1 1 13 13 LYS H H 1 8.347 0.003 . 1 . . . . A 13 LYS H . 30352 1 138 . 1 1 13 13 LYS HA H 1 4.294 0.001 . 1 . . . . A 13 LYS HA . 30352 1 139 . 1 1 13 13 LYS HB2 H 1 1.576 0.000 . 2 . . . . A 13 LYS HB2 . 30352 1 140 . 1 1 13 13 LYS HB3 H 1 1.576 0.000 . 2 . . . . A 13 LYS HB3 . 30352 1 141 . 1 1 13 13 LYS C C 13 175.764 0.000 . 1 . . . . A 13 LYS C . 30352 1 142 . 1 1 13 13 LYS CA C 13 55.019 0.000 . 1 . . . . A 13 LYS CA . 30352 1 143 . 1 1 13 13 LYS CB C 13 34.380 0.000 . 1 . . . . A 13 LYS CB . 30352 1 144 . 1 1 13 13 LYS N N 15 120.944 0.003 . 1 . . . . A 13 LYS N . 30352 1 145 . 1 1 14 14 GLN H H 1 8.708 0.003 . 1 . . . . A 14 GLN H . 30352 1 146 . 1 1 14 14 GLN HA H 1 4.469 0.000 . 1 . . . . A 14 GLN HA . 30352 1 147 . 1 1 14 14 GLN HB2 H 1 2.006 0.000 . 2 . . . . A 14 GLN HB2 . 30352 1 148 . 1 1 14 14 GLN HB3 H 1 1.794 0.000 . 2 . . . . A 14 GLN HB3 . 30352 1 149 . 1 1 14 14 GLN HG2 H 1 2.121 0.000 . 2 . . . . A 14 GLN HG2 . 30352 1 150 . 1 1 14 14 GLN HG3 H 1 2.338 0.000 . 2 . . . . A 14 GLN HG3 . 30352 1 151 . 1 1 14 14 GLN HE21 H 1 6.853 0.007 . 2 . . . . A 14 GLN HE21 . 30352 1 152 . 1 1 14 14 GLN HE22 H 1 7.857 0.000 . 2 . . . . A 14 GLN HE22 . 30352 1 153 . 1 1 14 14 GLN C C 13 174.396 0.000 . 1 . . . . A 14 GLN C . 30352 1 154 . 1 1 14 14 GLN CA C 13 56.197 0.000 . 1 . . . . A 14 GLN CA . 30352 1 155 . 1 1 14 14 GLN CB C 13 28.996 0.006 . 1 . . . . A 14 GLN CB . 30352 1 156 . 1 1 14 14 GLN CG C 13 34.764 0.013 . 1 . . . . A 14 GLN CG . 30352 1 157 . 1 1 14 14 GLN N N 15 124.765 0.001 . 1 . . . . A 14 GLN N . 30352 1 158 . 1 1 14 14 GLN NE2 N 15 113.212 0.004 . 1 . . . . A 14 GLN NE2 . 30352 1 159 . 1 1 15 15 VAL H H 1 7.266 0.005 . 1 . . . . A 15 VAL H . 30352 1 160 . 1 1 15 15 VAL HA H 1 4.458 0.003 . 1 . . . . A 15 VAL HA . 30352 1 161 . 1 1 15 15 VAL HB H 1 2.076 0.000 . 1 . . . . A 15 VAL HB . 30352 1 162 . 1 1 15 15 VAL HG11 H 1 0.764 0.000 . 2 . . . . A 15 VAL HG11 . 30352 1 163 . 1 1 15 15 VAL HG12 H 1 0.764 0.000 . 2 . . . . A 15 VAL HG12 . 30352 1 164 . 1 1 15 15 VAL HG13 H 1 0.764 0.000 . 2 . . . . A 15 VAL HG13 . 30352 1 165 . 1 1 15 15 VAL HG21 H 1 0.684 0.000 . 2 . . . . A 15 VAL HG21 . 30352 1 166 . 1 1 15 15 VAL HG22 H 1 0.684 0.000 . 2 . . . . A 15 VAL HG22 . 30352 1 167 . 1 1 15 15 VAL HG23 H 1 0.684 0.000 . 2 . . . . A 15 VAL HG23 . 30352 1 168 . 1 1 15 15 VAL C C 13 174.500 0.000 . 1 . . . . A 15 VAL C . 30352 1 169 . 1 1 15 15 VAL CA C 13 59.072 0.000 . 1 . . . . A 15 VAL CA . 30352 1 170 . 1 1 15 15 VAL CB C 13 35.372 0.007 . 1 . . . . A 15 VAL CB . 30352 1 171 . 1 1 15 15 VAL CG1 C 13 21.583 0.000 . 1 . . . . A 15 VAL CG1 . 30352 1 172 . 1 1 15 15 VAL CG2 C 13 18.658 0.000 . 1 . . . . A 15 VAL CG2 . 30352 1 173 . 1 1 15 15 VAL N N 15 120.884 0.008 . 1 . . . . A 15 VAL N . 30352 1 174 . 1 1 16 16 LYS H H 1 8.352 0.005 . 1 . . . . A 16 LYS H . 30352 1 175 . 1 1 16 16 LYS HA H 1 4.307 0.006 . 1 . . . . A 16 LYS HA . 30352 1 176 . 1 1 16 16 LYS HB2 H 1 1.563 0.000 . 2 . . . . A 16 LYS HB2 . 30352 1 177 . 1 1 16 16 LYS HB3 H 1 1.563 0.000 . 2 . . . . A 16 LYS HB3 . 30352 1 178 . 1 1 16 16 LYS HG2 H 1 1.299 0.000 . 2 . . . . A 16 LYS HG2 . 30352 1 179 . 1 1 16 16 LYS HG3 H 1 1.185 0.000 . 2 . . . . A 16 LYS HG3 . 30352 1 180 . 1 1 16 16 LYS HD2 H 1 1.466 0.000 . 2 . . . . A 16 LYS HD2 . 30352 1 181 . 1 1 16 16 LYS HE2 H 1 2.854 0.000 . 2 . . . . A 16 LYS HE2 . 30352 1 182 . 1 1 16 16 LYS HE3 H 1 2.854 0.000 . 2 . . . . A 16 LYS HE3 . 30352 1 183 . 1 1 16 16 LYS C C 13 177.067 0.000 . 1 . . . . A 16 LYS C . 30352 1 184 . 1 1 16 16 LYS CA C 13 56.911 0.000 . 1 . . . . A 16 LYS CA . 30352 1 185 . 1 1 16 16 LYS CB C 13 33.418 0.031 . 1 . . . . A 16 LYS CB . 30352 1 186 . 1 1 16 16 LYS CG C 13 25.628 0.007 . 1 . . . . A 16 LYS CG . 30352 1 187 . 1 1 16 16 LYS CD C 13 29.099 0.000 . 1 . . . . A 16 LYS CD . 30352 1 188 . 1 1 16 16 LYS CE C 13 41.995 0.000 . 1 . . . . A 16 LYS CE . 30352 1 189 . 1 1 16 16 LYS N N 15 121.200 0.055 . 1 . . . . A 16 LYS N . 30352 1 190 . 1 1 17 17 LEU H H 1 9.040 0.001 . 1 . . . . A 17 LEU H . 30352 1 191 . 1 1 17 17 LEU HA H 1 4.424 0.000 . 1 . . . . A 17 LEU HA . 30352 1 192 . 1 1 17 17 LEU HB2 H 1 1.968 0.009 . 2 . . . . A 17 LEU HB2 . 30352 1 193 . 1 1 17 17 LEU HB3 H 1 1.427 0.000 . 2 . . . . A 17 LEU HB3 . 30352 1 194 . 1 1 17 17 LEU HG H 1 1.533 0.000 . 1 . . . . A 17 LEU HG . 30352 1 195 . 1 1 17 17 LEU HD11 H 1 0.824 0.000 . 2 . . . . A 17 LEU HD11 . 30352 1 196 . 1 1 17 17 LEU HD12 H 1 0.824 0.000 . 2 . . . . A 17 LEU HD12 . 30352 1 197 . 1 1 17 17 LEU HD13 H 1 0.824 0.000 . 2 . . . . A 17 LEU HD13 . 30352 1 198 . 1 1 17 17 LEU HD21 H 1 0.822 0.000 . 2 . . . . A 17 LEU HD21 . 30352 1 199 . 1 1 17 17 LEU HD22 H 1 0.822 0.000 . 2 . . . . A 17 LEU HD22 . 30352 1 200 . 1 1 17 17 LEU HD23 H 1 0.822 0.000 . 2 . . . . A 17 LEU HD23 . 30352 1 201 . 1 1 17 17 LEU CA C 13 53.577 0.000 . 1 . . . . A 17 LEU CA . 30352 1 202 . 1 1 17 17 LEU CB C 13 40.092 0.001 . 1 . . . . A 17 LEU CB . 30352 1 203 . 1 1 17 17 LEU CG C 13 27.397 0.001 . 1 . . . . A 17 LEU CG . 30352 1 204 . 1 1 17 17 LEU CD1 C 13 25.816 0.000 . 1 . . . . A 17 LEU CD1 . 30352 1 205 . 1 1 17 17 LEU CD2 C 13 22.332 0.000 . 1 . . . . A 17 LEU CD2 . 30352 1 206 . 1 1 17 17 LEU N N 15 125.304 0.001 . 1 . . . . A 17 LEU N . 30352 1 207 . 1 1 18 18 PRO HA H 1 4.218 0.005 . 1 . . . . A 18 PRO HA . 30352 1 208 . 1 1 18 18 PRO HB2 H 1 2.305 0.000 . 2 . . . . A 18 PRO HB2 . 30352 1 209 . 1 1 18 18 PRO HB3 H 1 1.781 0.000 . 2 . . . . A 18 PRO HB3 . 30352 1 210 . 1 1 18 18 PRO HG2 H 1 2.019 0.000 . 2 . . . . A 18 PRO HG2 . 30352 1 211 . 1 1 18 18 PRO HG3 H 1 1.899 0.000 . 2 . . . . A 18 PRO HG3 . 30352 1 212 . 1 1 18 18 PRO HD2 H 1 3.727 0.000 . 2 . . . . A 18 PRO HD2 . 30352 1 213 . 1 1 18 18 PRO HD3 H 1 3.673 0.000 . 2 . . . . A 18 PRO HD3 . 30352 1 214 . 1 1 18 18 PRO C C 13 176.658 0.000 . 1 . . . . A 18 PRO C . 30352 1 215 . 1 1 18 18 PRO CA C 13 65.499 0.000 . 1 . . . . A 18 PRO CA . 30352 1 216 . 1 1 18 18 PRO CB C 13 31.586 0.007 . 1 . . . . A 18 PRO CB . 30352 1 217 . 1 1 18 18 PRO CG C 13 27.785 0.000 . 1 . . . . A 18 PRO CG . 30352 1 218 . 1 1 18 18 PRO CD C 13 50.595 0.000 . 1 . . . . A 18 PRO CD . 30352 1 219 . 1 1 19 19 ASN H H 1 7.286 0.005 . 1 . . . . A 19 ASN H . 30352 1 220 . 1 1 19 19 ASN HA H 1 4.446 0.000 . 1 . . . . A 19 ASN HA . 30352 1 221 . 1 1 19 19 ASN HB2 H 1 3.127 0.000 . 2 . . . . A 19 ASN HB2 . 30352 1 222 . 1 1 19 19 ASN HB3 H 1 2.674 0.000 . 2 . . . . A 19 ASN HB3 . 30352 1 223 . 1 1 19 19 ASN HD21 H 1 6.550 0.000 . 2 . . . . A 19 ASN HD21 . 30352 1 224 . 1 1 19 19 ASN HD22 H 1 7.188 0.000 . 2 . . . . A 19 ASN HD22 . 30352 1 225 . 1 1 19 19 ASN C C 13 176.706 0.000 . 1 . . . . A 19 ASN C . 30352 1 226 . 1 1 19 19 ASN CA C 13 52.653 0.000 . 1 . . . . A 19 ASN CA . 30352 1 227 . 1 1 19 19 ASN CB C 13 37.144 0.000 . 1 . . . . A 19 ASN CB . 30352 1 228 . 1 1 19 19 ASN N N 15 111.696 0.023 . 1 . . . . A 19 ASN N . 30352 1 229 . 1 1 19 19 ASN ND2 N 15 107.526 0.002 . 1 . . . . A 19 ASN ND2 . 30352 1 230 . 1 1 20 20 GLY H H 1 8.356 0.002 . 1 . . . . A 20 GLY H . 30352 1 231 . 1 1 20 20 GLY HA2 H 1 4.251 0.000 . 2 . . . . A 20 GLY HA2 . 30352 1 232 . 1 1 20 20 GLY HA3 H 1 3.466 0.003 . 2 . . . . A 20 GLY HA3 . 30352 1 233 . 1 1 20 20 GLY C C 13 174.046 0.000 . 1 . . . . A 20 GLY C . 30352 1 234 . 1 1 20 20 GLY CA C 13 45.284 0.001 . 1 . . . . A 20 GLY CA . 30352 1 235 . 1 1 20 20 GLY N N 15 108.448 0.014 . 1 . . . . A 20 GLY N . 30352 1 236 . 1 1 21 21 GLN H H 1 7.760 0.001 . 1 . . . . A 21 GLN H . 30352 1 237 . 1 1 21 21 GLN HA H 1 4.294 0.004 . 1 . . . . A 21 GLN HA . 30352 1 238 . 1 1 21 21 GLN HB2 H 1 2.032 0.000 . 2 . . . . A 21 GLN HB2 . 30352 1 239 . 1 1 21 21 GLN HB3 H 1 1.940 0.001 . 2 . . . . A 21 GLN HB3 . 30352 1 240 . 1 1 21 21 GLN HG2 H 1 2.149 0.000 . 2 . . . . A 21 GLN HG2 . 30352 1 241 . 1 1 21 21 GLN HG3 H 1 2.149 0.000 . 2 . . . . A 21 GLN HG3 . 30352 1 242 . 1 1 21 21 GLN HE21 H 1 6.781 0.000 . 2 . . . . A 21 GLN HE21 . 30352 1 243 . 1 1 21 21 GLN HE22 H 1 7.441 0.000 . 2 . . . . A 21 GLN HE22 . 30352 1 244 . 1 1 21 21 GLN C C 13 175.341 0.000 . 1 . . . . A 21 GLN C . 30352 1 245 . 1 1 21 21 GLN CA C 13 54.393 0.009 . 1 . . . . A 21 GLN CA . 30352 1 246 . 1 1 21 21 GLN CB C 13 29.673 0.015 . 1 . . . . A 21 GLN CB . 30352 1 247 . 1 1 21 21 GLN CG C 13 33.778 0.000 . 1 . . . . A 21 GLN CG . 30352 1 248 . 1 1 21 21 GLN N N 15 119.352 0.020 . 1 . . . . A 21 GLN N . 30352 1 249 . 1 1 21 21 GLN NE2 N 15 112.919 0.001 . 1 . . . . A 21 GLN NE2 . 30352 1 250 . 1 1 22 22 LEU H H 1 8.455 0.003 . 1 . . . . A 22 LEU H . 30352 1 251 . 1 1 22 22 LEU HA H 1 4.378 0.016 . 1 . . . . A 22 LEU HA . 30352 1 252 . 1 1 22 22 LEU HB2 H 1 1.363 0.002 . 2 . . . . A 22 LEU HB2 . 30352 1 253 . 1 1 22 22 LEU HB3 H 1 1.600 0.000 . 2 . . . . A 22 LEU HB3 . 30352 1 254 . 1 1 22 22 LEU HG H 1 1.649 0.002 . 1 . . . . A 22 LEU HG . 30352 1 255 . 1 1 22 22 LEU HD11 H 1 0.761 0.000 . 2 . . . . A 22 LEU HD11 . 30352 1 256 . 1 1 22 22 LEU HD12 H 1 0.761 0.000 . 2 . . . . A 22 LEU HD12 . 30352 1 257 . 1 1 22 22 LEU HD13 H 1 0.761 0.000 . 2 . . . . A 22 LEU HD13 . 30352 1 258 . 1 1 22 22 LEU HD21 H 1 0.617 0.000 . 2 . . . . A 22 LEU HD21 . 30352 1 259 . 1 1 22 22 LEU HD22 H 1 0.617 0.000 . 2 . . . . A 22 LEU HD22 . 30352 1 260 . 1 1 22 22 LEU HD23 H 1 0.617 0.000 . 2 . . . . A 22 LEU HD23 . 30352 1 261 . 1 1 22 22 LEU C C 13 178.201 0.000 . 1 . . . . A 22 LEU C . 30352 1 262 . 1 1 22 22 LEU CA C 13 55.100 0.000 . 1 . . . . A 22 LEU CA . 30352 1 263 . 1 1 22 22 LEU CB C 13 42.538 0.023 . 1 . . . . A 22 LEU CB . 30352 1 264 . 1 1 22 22 LEU CG C 13 26.952 0.037 . 1 . . . . A 22 LEU CG . 30352 1 265 . 1 1 22 22 LEU CD1 C 13 24.999 0.000 . 1 . . . . A 22 LEU CD1 . 30352 1 266 . 1 1 22 22 LEU CD2 C 13 23.055 0.000 . 1 . . . . A 22 LEU CD2 . 30352 1 267 . 1 1 22 22 LEU N N 15 120.745 0.007 . 1 . . . . A 22 LEU N . 30352 1 268 . 1 1 23 23 CYS H H 1 8.352 0.002 . 1 . . . . A 23 CYS H . 30352 1 269 . 1 1 23 23 CYS HA H 1 4.480 0.000 . 1 . . . . A 23 CYS HA . 30352 1 270 . 1 1 23 23 CYS HB2 H 1 3.193 0.000 . 2 . . . . A 23 CYS HB2 . 30352 1 271 . 1 1 23 23 CYS HB3 H 1 2.981 0.000 . 2 . . . . A 23 CYS HB3 . 30352 1 272 . 1 1 23 23 CYS C C 13 172.428 0.000 . 1 . . . . A 23 CYS C . 30352 1 273 . 1 1 23 23 CYS CA C 13 55.105 0.000 . 1 . . . . A 23 CYS CA . 30352 1 274 . 1 1 23 23 CYS CB C 13 40.920 0.020 . 1 . . . . A 23 CYS CB . 30352 1 275 . 1 1 23 23 CYS N N 15 117.356 0.001 . 1 . . . . A 23 CYS N . 30352 1 276 . 1 1 24 24 LYS H H 1 9.030 0.001 . 1 . . . . A 24 LYS H . 30352 1 277 . 1 1 24 24 LYS HA H 1 4.366 0.005 . 1 . . . . A 24 LYS HA . 30352 1 278 . 1 1 24 24 LYS HB2 H 1 1.812 0.000 . 2 . . . . A 24 LYS HB2 . 30352 1 279 . 1 1 24 24 LYS HB3 H 1 1.860 0.000 . 2 . . . . A 24 LYS HB3 . 30352 1 280 . 1 1 24 24 LYS HG2 H 1 1.596 0.000 . 2 . . . . A 24 LYS HG2 . 30352 1 281 . 1 1 24 24 LYS HG3 H 1 1.417 0.000 . 2 . . . . A 24 LYS HG3 . 30352 1 282 . 1 1 24 24 LYS HD2 H 1 1.809 0.000 . 2 . . . . A 24 LYS HD2 . 30352 1 283 . 1 1 24 24 LYS HD3 H 1 1.451 0.000 . 2 . . . . A 24 LYS HD3 . 30352 1 284 . 1 1 24 24 LYS HE2 H 1 2.954 0.002 . 2 . . . . A 24 LYS HE2 . 30352 1 285 . 1 1 24 24 LYS HE3 H 1 2.954 0.002 . 2 . . . . A 24 LYS HE3 . 30352 1 286 . 1 1 24 24 LYS C C 13 175.589 0.000 . 1 . . . . A 24 LYS C . 30352 1 287 . 1 1 24 24 LYS CA C 13 55.984 0.000 . 1 . . . . A 24 LYS CA . 30352 1 288 . 1 1 24 24 LYS CB C 13 35.181 0.000 . 1 . . . . A 24 LYS CB . 30352 1 289 . 1 1 24 24 LYS CG C 13 25.738 0.000 . 1 . . . . A 24 LYS CG . 30352 1 290 . 1 1 24 24 LYS CD C 13 29.296 0.021 . 1 . . . . A 24 LYS CD . 30352 1 291 . 1 1 24 24 LYS CE C 13 42.898 0.000 . 1 . . . . A 24 LYS CE . 30352 1 292 . 1 1 24 24 LYS N N 15 119.900 0.004 . 1 . . . . A 24 LYS N . 30352 1 293 . 1 1 25 25 GLU H H 1 8.686 0.002 . 1 . . . . A 25 GLU H . 30352 1 294 . 1 1 25 25 GLU HA H 1 4.009 0.000 . 1 . . . . A 25 GLU HA . 30352 1 295 . 1 1 25 25 GLU HB2 H 1 1.747 0.000 . 2 . . . . A 25 GLU HB2 . 30352 1 296 . 1 1 25 25 GLU HB3 H 1 1.910 0.000 . 2 . . . . A 25 GLU HB3 . 30352 1 297 . 1 1 25 25 GLU HG2 H 1 2.553 0.004 . 2 . . . . A 25 GLU HG2 . 30352 1 298 . 1 1 25 25 GLU HG3 H 1 2.099 0.000 . 2 . . . . A 25 GLU HG3 . 30352 1 299 . 1 1 25 25 GLU CA C 13 54.511 0.000 . 1 . . . . A 25 GLU CA . 30352 1 300 . 1 1 25 25 GLU CB C 13 29.530 0.000 . 1 . . . . A 25 GLU CB . 30352 1 301 . 1 1 25 25 GLU CG C 13 36.094 0.005 . 1 . . . . A 25 GLU CG . 30352 1 302 . 1 1 25 25 GLU N N 15 123.239 0.012 . 1 . . . . A 25 GLU N . 30352 1 303 . 1 1 26 26 PRO HA H 1 3.696 0.000 . 1 . . . . A 26 PRO HA . 30352 1 304 . 1 1 26 26 PRO HB2 H 1 1.248 0.002 . 2 . . . . A 26 PRO HB2 . 30352 1 305 . 1 1 26 26 PRO HB3 H 1 2.202 0.004 . 2 . . . . A 26 PRO HB3 . 30352 1 306 . 1 1 26 26 PRO C C 13 176.362 0.000 . 1 . . . . A 26 PRO C . 30352 1 307 . 1 1 26 26 PRO CA C 13 63.854 0.000 . 1 . . . . A 26 PRO CA . 30352 1 308 . 1 1 26 26 PRO CB C 13 31.428 0.010 . 1 . . . . A 26 PRO CB . 30352 1 309 . 1 1 27 27 GLY H H 1 9.002 0.001 . 1 . . . . A 27 GLY H . 30352 1 310 . 1 1 27 27 GLY HA2 H 1 3.532 0.005 . 2 . . . . A 27 GLY HA2 . 30352 1 311 . 1 1 27 27 GLY HA3 H 1 4.114 0.004 . 2 . . . . A 27 GLY HA3 . 30352 1 312 . 1 1 27 27 GLY C C 13 173.553 0.000 . 1 . . . . A 27 GLY C . 30352 1 313 . 1 1 27 27 GLY CA C 13 44.698 0.022 . 1 . . . . A 27 GLY CA . 30352 1 314 . 1 1 27 27 GLY N N 15 111.521 0.007 . 1 . . . . A 27 GLY N . 30352 1 315 . 1 1 28 28 ASP H H 1 8.303 0.001 . 1 . . . . A 28 ASP H . 30352 1 316 . 1 1 28 28 ASP HA H 1 4.615 0.001 . 1 . . . . A 28 ASP HA . 30352 1 317 . 1 1 28 28 ASP HB2 H 1 2.911 0.000 . 2 . . . . A 28 ASP HB2 . 30352 1 318 . 1 1 28 28 ASP HB3 H 1 2.560 0.000 . 2 . . . . A 28 ASP HB3 . 30352 1 319 . 1 1 28 28 ASP C C 13 176.116 0.000 . 1 . . . . A 28 ASP C . 30352 1 320 . 1 1 28 28 ASP CA C 13 53.576 0.000 . 1 . . . . A 28 ASP CA . 30352 1 321 . 1 1 28 28 ASP CB C 13 41.271 0.001 . 1 . . . . A 28 ASP CB . 30352 1 322 . 1 1 28 28 ASP N N 15 121.251 0.009 . 1 . . . . A 28 ASP N . 30352 1 323 . 1 1 29 29 SER H H 1 8.420 0.001 . 1 . . . . A 29 SER H . 30352 1 324 . 1 1 29 29 SER HA H 1 4.763 0.005 . 1 . . . . A 29 SER HA . 30352 1 325 . 1 1 29 29 SER HB2 H 1 3.805 0.000 . 2 . . . . A 29 SER HB2 . 30352 1 326 . 1 1 29 29 SER HB3 H 1 3.805 0.000 . 2 . . . . A 29 SER HB3 . 30352 1 327 . 1 1 29 29 SER C C 13 173.056 0.000 . 1 . . . . A 29 SER C . 30352 1 328 . 1 1 29 29 SER CA C 13 58.686 0.001 . 1 . . . . A 29 SER CA . 30352 1 329 . 1 1 29 29 SER CB C 13 63.657 0.019 . 1 . . . . A 29 SER CB . 30352 1 330 . 1 1 29 29 SER N N 15 116.163 0.008 . 1 . . . . A 29 SER N . 30352 1 331 . 1 1 30 30 CYS H H 1 7.787 0.002 . 1 . . . . A 30 CYS H . 30352 1 332 . 1 1 30 30 CYS HA H 1 4.810 0.004 . 1 . . . . A 30 CYS HA . 30352 1 333 . 1 1 30 30 CYS HB2 H 1 2.949 0.001 . 2 . . . . A 30 CYS HB2 . 30352 1 334 . 1 1 30 30 CYS HB3 H 1 3.107 0.001 . 2 . . . . A 30 CYS HB3 . 30352 1 335 . 1 1 30 30 CYS C C 13 172.749 0.000 . 1 . . . . A 30 CYS C . 30352 1 336 . 1 1 30 30 CYS CA C 13 53.492 0.000 . 1 . . . . A 30 CYS CA . 30352 1 337 . 1 1 30 30 CYS CB C 13 47.645 0.028 . 1 . . . . A 30 CYS CB . 30352 1 338 . 1 1 30 30 CYS N N 15 117.124 0.014 . 1 . . . . A 30 CYS N . 30352 1 339 . 1 1 31 31 SER H H 1 9.482 0.003 . 1 . . . . A 31 SER H . 30352 1 340 . 1 1 31 31 SER HA H 1 4.462 0.001 . 1 . . . . A 31 SER HA . 30352 1 341 . 1 1 31 31 SER HB2 H 1 3.790 0.000 . 2 . . . . A 31 SER HB2 . 30352 1 342 . 1 1 31 31 SER HB3 H 1 3.723 0.000 . 2 . . . . A 31 SER HB3 . 30352 1 343 . 1 1 31 31 SER C C 13 173.875 0.000 . 1 . . . . A 31 SER C . 30352 1 344 . 1 1 31 31 SER CA C 13 59.072 0.000 . 1 . . . . A 31 SER CA . 30352 1 345 . 1 1 31 31 SER CB C 13 65.057 0.014 . 1 . . . . A 31 SER CB . 30352 1 346 . 1 1 31 31 SER N N 15 113.471 0.010 . 1 . . . . A 31 SER N . 30352 1 347 . 1 1 32 32 LYS H H 1 7.802 0.007 . 1 . . . . A 32 LYS H . 30352 1 348 . 1 1 32 32 LYS HA H 1 4.554 0.017 . 1 . . . . A 32 LYS HA . 30352 1 349 . 1 1 32 32 LYS HB2 H 1 1.649 0.000 . 2 . . . . A 32 LYS HB2 . 30352 1 350 . 1 1 32 32 LYS HB3 H 1 1.950 0.000 . 2 . . . . A 32 LYS HB3 . 30352 1 351 . 1 1 32 32 LYS HG2 H 1 1.251 0.000 . 2 . . . . A 32 LYS HG2 . 30352 1 352 . 1 1 32 32 LYS HG3 H 1 1.251 0.000 . 2 . . . . A 32 LYS HG3 . 30352 1 353 . 1 1 32 32 LYS C C 13 176.356 0.000 . 1 . . . . A 32 LYS C . 30352 1 354 . 1 1 32 32 LYS CA C 13 54.726 0.000 . 1 . . . . A 32 LYS CA . 30352 1 355 . 1 1 32 32 LYS CB C 13 35.850 0.000 . 1 . . . . A 32 LYS CB . 30352 1 356 . 1 1 32 32 LYS CG C 13 24.551 0.001 . 1 . . . . A 32 LYS CG . 30352 1 357 . 1 1 32 32 LYS N N 15 120.062 0.006 . 1 . . . . A 32 LYS N . 30352 1 358 . 1 1 33 33 ARG H H 1 8.889 0.002 . 1 . . . . A 33 ARG H . 30352 1 359 . 1 1 33 33 ARG HA H 1 3.631 0.000 . 1 . . . . A 33 ARG HA . 30352 1 360 . 1 1 33 33 ARG HB2 H 1 1.923 0.000 . 2 . . . . A 33 ARG HB2 . 30352 1 361 . 1 1 33 33 ARG HB3 H 1 1.783 0.000 . 2 . . . . A 33 ARG HB3 . 30352 1 362 . 1 1 33 33 ARG HG2 H 1 1.491 0.000 . 2 . . . . A 33 ARG HG2 . 30352 1 363 . 1 1 33 33 ARG HG3 H 1 1.491 0.000 . 2 . . . . A 33 ARG HG3 . 30352 1 364 . 1 1 33 33 ARG HD2 H 1 3.189 0.000 . 2 . . . . A 33 ARG HD2 . 30352 1 365 . 1 1 33 33 ARG HD3 H 1 3.189 0.000 . 2 . . . . A 33 ARG HD3 . 30352 1 366 . 1 1 33 33 ARG HE H 1 7.121 0.000 . 1 . . . . A 33 ARG HE . 30352 1 367 . 1 1 33 33 ARG C C 13 178.014 0.000 . 1 . . . . A 33 ARG C . 30352 1 368 . 1 1 33 33 ARG CA C 13 60.063 0.000 . 1 . . . . A 33 ARG CA . 30352 1 369 . 1 1 33 33 ARG CB C 13 29.897 0.012 . 1 . . . . A 33 ARG CB . 30352 1 370 . 1 1 33 33 ARG CG C 13 26.640 0.000 . 1 . . . . A 33 ARG CG . 30352 1 371 . 1 1 33 33 ARG CD C 13 43.641 0.000 . 1 . . . . A 33 ARG CD . 30352 1 372 . 1 1 33 33 ARG N N 15 121.120 0.022 . 1 . . . . A 33 ARG N . 30352 1 373 . 1 1 33 33 ARG NE N 15 84.289 0.000 . 1 . . . . A 33 ARG NE . 30352 1 374 . 1 1 34 34 ASP H H 1 8.429 0.002 . 1 . . . . A 34 ASP H . 30352 1 375 . 1 1 34 34 ASP HA H 1 4.284 0.003 . 1 . . . . A 34 ASP HA . 30352 1 376 . 1 1 34 34 ASP HB2 H 1 2.673 0.000 . 2 . . . . A 34 ASP HB2 . 30352 1 377 . 1 1 34 34 ASP HB3 H 1 2.553 0.000 . 2 . . . . A 34 ASP HB3 . 30352 1 378 . 1 1 34 34 ASP C C 13 176.537 0.000 . 1 . . . . A 34 ASP C . 30352 1 379 . 1 1 34 34 ASP CA C 13 55.508 0.000 . 1 . . . . A 34 ASP CA . 30352 1 380 . 1 1 34 34 ASP CB C 13 39.422 0.029 . 1 . . . . A 34 ASP CB . 30352 1 381 . 1 1 34 34 ASP N N 15 115.759 0.001 . 1 . . . . A 34 ASP N . 30352 1 382 . 1 1 35 35 GLU H H 1 7.311 0.003 . 1 . . . . A 35 GLU H . 30352 1 383 . 1 1 35 35 GLU HA H 1 4.166 0.000 . 1 . . . . A 35 GLU HA . 30352 1 384 . 1 1 35 35 GLU HB2 H 1 2.205 0.000 . 2 . . . . A 35 GLU HB2 . 30352 1 385 . 1 1 35 35 GLU HB3 H 1 1.907 0.000 . 2 . . . . A 35 GLU HB3 . 30352 1 386 . 1 1 35 35 GLU HG2 H 1 2.376 0.000 . 2 . . . . A 35 GLU HG2 . 30352 1 387 . 1 1 35 35 GLU HG3 H 1 2.134 0.000 . 2 . . . . A 35 GLU HG3 . 30352 1 388 . 1 1 35 35 GLU C C 13 176.895 0.000 . 1 . . . . A 35 GLU C . 30352 1 389 . 1 1 35 35 GLU CA C 13 57.040 0.000 . 1 . . . . A 35 GLU CA . 30352 1 390 . 1 1 35 35 GLU CB C 13 31.501 0.000 . 1 . . . . A 35 GLU CB . 30352 1 391 . 1 1 35 35 GLU CG C 13 36.299 0.056 . 1 . . . . A 35 GLU CG . 30352 1 392 . 1 1 35 35 GLU N N 15 116.107 0.003 . 1 . . . . A 35 GLU N . 30352 1 393 . 1 1 36 36 CYS H H 1 7.378 0.004 . 1 . . . . A 36 CYS H . 30352 1 394 . 1 1 36 36 CYS HA H 1 4.767 0.000 . 1 . . . . A 36 CYS HA . 30352 1 395 . 1 1 36 36 CYS HB2 H 1 3.390 0.001 . 2 . . . . A 36 CYS HB2 . 30352 1 396 . 1 1 36 36 CYS HB3 H 1 2.410 0.002 . 2 . . . . A 36 CYS HB3 . 30352 1 397 . 1 1 36 36 CYS C C 13 175.875 0.000 . 1 . . . . A 36 CYS C . 30352 1 398 . 1 1 36 36 CYS CA C 13 54.848 0.000 . 1 . . . . A 36 CYS CA . 30352 1 399 . 1 1 36 36 CYS CB C 13 37.697 0.029 . 1 . . . . A 36 CYS CB . 30352 1 400 . 1 1 36 36 CYS N N 15 118.020 0.001 . 1 . . . . A 36 CYS N . 30352 1 401 . 1 1 37 37 CYS H H 1 10.026 0.000 . 1 . . . . A 37 CYS H . 30352 1 402 . 1 1 37 37 CYS HA H 1 4.446 0.000 . 1 . . . . A 37 CYS HA . 30352 1 403 . 1 1 37 37 CYS HB2 H 1 2.048 0.000 . 2 . . . . A 37 CYS HB2 . 30352 1 404 . 1 1 37 37 CYS HB3 H 1 3.236 0.000 . 2 . . . . A 37 CYS HB3 . 30352 1 405 . 1 1 37 37 CYS C C 13 173.265 0.000 . 1 . . . . A 37 CYS C . 30352 1 406 . 1 1 37 37 CYS CA C 13 54.933 0.000 . 1 . . . . A 37 CYS CA . 30352 1 407 . 1 1 37 37 CYS CB C 13 39.216 0.008 . 1 . . . . A 37 CYS CB . 30352 1 408 . 1 1 37 37 CYS N N 15 124.805 0.040 . 1 . . . . A 37 CYS N . 30352 1 409 . 1 1 38 38 LYS H H 1 8.673 0.002 . 1 . . . . A 38 LYS H . 30352 1 410 . 1 1 38 38 LYS HA H 1 4.276 0.000 . 1 . . . . A 38 LYS HA . 30352 1 411 . 1 1 38 38 LYS HB2 H 1 1.590 0.000 . 2 . . . . A 38 LYS HB2 . 30352 1 412 . 1 1 38 38 LYS HB3 H 1 1.766 0.000 . 2 . . . . A 38 LYS HB3 . 30352 1 413 . 1 1 38 38 LYS HG2 H 1 1.408 0.000 . 2 . . . . A 38 LYS HG2 . 30352 1 414 . 1 1 38 38 LYS HG3 H 1 1.321 0.000 . 2 . . . . A 38 LYS HG3 . 30352 1 415 . 1 1 38 38 LYS C C 13 176.758 0.000 . 1 . . . . A 38 LYS C . 30352 1 416 . 1 1 38 38 LYS CA C 13 54.826 0.000 . 1 . . . . A 38 LYS CA . 30352 1 417 . 1 1 38 38 LYS CB C 13 34.549 0.000 . 1 . . . . A 38 LYS CB . 30352 1 418 . 1 1 38 38 LYS CG C 13 25.716 0.000 . 1 . . . . A 38 LYS CG . 30352 1 419 . 1 1 38 38 LYS N N 15 120.797 0.002 . 1 . . . . A 38 LYS N . 30352 1 420 . 1 1 39 39 ALA H H 1 8.515 0.002 . 1 . . . . A 39 ALA H . 30352 1 421 . 1 1 39 39 ALA HA H 1 4.033 0.000 . 1 . . . . A 39 ALA HA . 30352 1 422 . 1 1 39 39 ALA HB1 H 1 1.202 0.000 . 1 . . . . A 39 ALA HB1 . 30352 1 423 . 1 1 39 39 ALA HB2 H 1 1.202 0.000 . 1 . . . . A 39 ALA HB2 . 30352 1 424 . 1 1 39 39 ALA HB3 H 1 1.202 0.000 . 1 . . . . A 39 ALA HB3 . 30352 1 425 . 1 1 39 39 ALA C C 13 176.607 0.000 . 1 . . . . A 39 ALA C . 30352 1 426 . 1 1 39 39 ALA CA C 13 51.836 0.000 . 1 . . . . A 39 ALA CA . 30352 1 427 . 1 1 39 39 ALA CB C 13 20.385 0.001 . 1 . . . . A 39 ALA CB . 30352 1 428 . 1 1 39 39 ALA N N 15 121.879 0.007 . 1 . . . . A 39 ALA N . 30352 1 429 . 1 1 40 40 ASP H H 1 8.024 0.004 . 1 . . . . A 40 ASP H . 30352 1 430 . 1 1 40 40 ASP HA H 1 4.244 0.000 . 1 . . . . A 40 ASP HA . 30352 1 431 . 1 1 40 40 ASP HB2 H 1 2.550 0.000 . 2 . . . . A 40 ASP HB2 . 30352 1 432 . 1 1 40 40 ASP HB3 H 1 2.622 0.000 . 2 . . . . A 40 ASP HB3 . 30352 1 433 . 1 1 40 40 ASP C C 13 176.595 0.000 . 1 . . . . A 40 ASP C . 30352 1 434 . 1 1 40 40 ASP CA C 13 56.599 0.000 . 1 . . . . A 40 ASP CA . 30352 1 435 . 1 1 40 40 ASP CB C 13 38.513 0.000 . 1 . . . . A 40 ASP CB . 30352 1 436 . 1 1 40 40 ASP N N 15 120.135 0.002 . 1 . . . . A 40 ASP N . 30352 1 437 . 1 1 41 41 ASP H H 1 8.511 0.003 . 1 . . . . A 41 ASP H . 30352 1 438 . 1 1 41 41 ASP HA H 1 4.826 0.000 . 1 . . . . A 41 ASP HA . 30352 1 439 . 1 1 41 41 ASP HB2 H 1 3.090 0.000 . 2 . . . . A 41 ASP HB2 . 30352 1 440 . 1 1 41 41 ASP HB3 H 1 2.616 0.000 . 2 . . . . A 41 ASP HB3 . 30352 1 441 . 1 1 41 41 ASP C C 13 175.836 0.000 . 1 . . . . A 41 ASP C . 30352 1 442 . 1 1 41 41 ASP CA C 13 51.757 0.000 . 1 . . . . A 41 ASP CA . 30352 1 443 . 1 1 41 41 ASP CB C 13 39.390 0.018 . 1 . . . . A 41 ASP CB . 30352 1 444 . 1 1 41 41 ASP N N 15 117.567 0.015 . 1 . . . . A 41 ASP N . 30352 1 445 . 1 1 42 42 GLN H H 1 8.270 0.004 . 1 . . . . A 42 GLN H . 30352 1 446 . 1 1 42 42 GLN HA H 1 4.594 0.000 . 1 . . . . A 42 GLN HA . 30352 1 447 . 1 1 42 42 GLN HB2 H 1 2.348 0.001 . 2 . . . . A 42 GLN HB2 . 30352 1 448 . 1 1 42 42 GLN HB3 H 1 1.802 0.000 . 2 . . . . A 42 GLN HB3 . 30352 1 449 . 1 1 42 42 GLN HG2 H 1 2.508 0.000 . 2 . . . . A 42 GLN HG2 . 30352 1 450 . 1 1 42 42 GLN HG3 H 1 2.384 0.000 . 2 . . . . A 42 GLN HG3 . 30352 1 451 . 1 1 42 42 GLN C C 13 176.498 0.000 . 1 . . . . A 42 GLN C . 30352 1 452 . 1 1 42 42 GLN CA C 13 56.797 0.000 . 1 . . . . A 42 GLN CA . 30352 1 453 . 1 1 42 42 GLN CB C 13 29.006 0.032 . 1 . . . . A 42 GLN CB . 30352 1 454 . 1 1 42 42 GLN CG C 13 35.096 0.030 . 1 . . . . A 42 GLN CG . 30352 1 455 . 1 1 42 42 GLN N N 15 121.347 0.005 . 1 . . . . A 42 GLN N . 30352 1 456 . 1 1 43 43 LYS H H 1 8.041 0.002 . 1 . . . . A 43 LYS H . 30352 1 457 . 1 1 43 43 LYS HA H 1 4.203 0.000 . 1 . . . . A 43 LYS HA . 30352 1 458 . 1 1 43 43 LYS HB2 H 1 1.822 0.000 . 2 . . . . A 43 LYS HB2 . 30352 1 459 . 1 1 43 43 LYS HB3 H 1 1.822 0.000 . 2 . . . . A 43 LYS HB3 . 30352 1 460 . 1 1 43 43 LYS HG2 H 1 1.387 0.000 . 2 . . . . A 43 LYS HG2 . 30352 1 461 . 1 1 43 43 LYS HG3 H 1 1.283 0.000 . 2 . . . . A 43 LYS HG3 . 30352 1 462 . 1 1 43 43 LYS HD2 H 1 1.574 0.000 . 2 . . . . A 43 LYS HD2 . 30352 1 463 . 1 1 43 43 LYS HD3 H 1 1.551 0.000 . 2 . . . . A 43 LYS HD3 . 30352 1 464 . 1 1 43 43 LYS HE2 H 1 2.886 0.000 . 2 . . . . A 43 LYS HE2 . 30352 1 465 . 1 1 43 43 LYS HE3 H 1 2.886 0.000 . 2 . . . . A 43 LYS HE3 . 30352 1 466 . 1 1 43 43 LYS C C 13 178.181 0.000 . 1 . . . . A 43 LYS C . 30352 1 467 . 1 1 43 43 LYS CA C 13 57.685 0.000 . 1 . . . . A 43 LYS CA . 30352 1 468 . 1 1 43 43 LYS CB C 13 32.371 0.000 . 1 . . . . A 43 LYS CB . 30352 1 469 . 1 1 43 43 LYS CG C 13 25.011 0.000 . 1 . . . . A 43 LYS CG . 30352 1 470 . 1 1 43 43 LYS CD C 13 29.058 0.019 . 1 . . . . A 43 LYS CD . 30352 1 471 . 1 1 43 43 LYS CE C 13 42.051 0.000 . 1 . . . . A 43 LYS CE . 30352 1 472 . 1 1 43 43 LYS N N 15 118.711 0.002 . 1 . . . . A 43 LYS N . 30352 1 473 . 1 1 44 44 THR H H 1 7.249 0.003 . 1 . . . . A 44 THR H . 30352 1 474 . 1 1 44 44 THR HA H 1 3.686 0.005 . 1 . . . . A 44 THR HA . 30352 1 475 . 1 1 44 44 THR HB H 1 3.203 0.002 . 1 . . . . A 44 THR HB . 30352 1 476 . 1 1 44 44 THR HG21 H 1 0.361 0.000 . 1 . . . . A 44 THR HG21 . 30352 1 477 . 1 1 44 44 THR HG22 H 1 0.361 0.000 . 1 . . . . A 44 THR HG22 . 30352 1 478 . 1 1 44 44 THR HG23 H 1 0.361 0.000 . 1 . . . . A 44 THR HG23 . 30352 1 479 . 1 1 44 44 THR C C 13 174.258 0.000 . 1 . . . . A 44 THR C . 30352 1 480 . 1 1 44 44 THR CA C 13 64.212 0.000 . 1 . . . . A 44 THR CA . 30352 1 481 . 1 1 44 44 THR CB C 13 69.033 0.000 . 1 . . . . A 44 THR CB . 30352 1 482 . 1 1 44 44 THR CG2 C 13 21.960 0.000 . 1 . . . . A 44 THR CG2 . 30352 1 483 . 1 1 44 44 THR N N 15 114.815 0.003 . 1 . . . . A 44 THR N . 30352 1 484 . 1 1 45 45 TYR H H 1 7.558 0.003 . 1 . . . . A 45 TYR H . 30352 1 485 . 1 1 45 45 TYR HA H 1 5.198 0.000 . 1 . . . . A 45 TYR HA . 30352 1 486 . 1 1 45 45 TYR HB2 H 1 2.700 0.000 . 2 . . . . A 45 TYR HB2 . 30352 1 487 . 1 1 45 45 TYR HB3 H 1 2.546 0.000 . 2 . . . . A 45 TYR HB3 . 30352 1 488 . 1 1 45 45 TYR HD1 H 1 7.063 0.000 . 1 . . . . A 45 TYR HD1 . 30352 1 489 . 1 1 45 45 TYR HD2 H 1 7.063 0.000 . 1 . . . . A 45 TYR HD2 . 30352 1 490 . 1 1 45 45 TYR HE1 H 1 6.761 0.000 . 1 . . . . A 45 TYR HE1 . 30352 1 491 . 1 1 45 45 TYR HE2 H 1 6.761 0.000 . 1 . . . . A 45 TYR HE2 . 30352 1 492 . 1 1 45 45 TYR C C 13 174.519 0.000 . 1 . . . . A 45 TYR C . 30352 1 493 . 1 1 45 45 TYR CA C 13 57.274 0.000 . 1 . . . . A 45 TYR CA . 30352 1 494 . 1 1 45 45 TYR CB C 13 41.442 0.000 . 1 . . . . A 45 TYR CB . 30352 1 495 . 1 1 45 45 TYR CD2 C 13 133.970 0.003 . 1 . . . . A 45 TYR CD2 . 30352 1 496 . 1 1 45 45 TYR CE1 C 13 118.424 0.049 . 1 . . . . A 45 TYR CE1 . 30352 1 497 . 1 1 45 45 TYR N N 15 118.832 0.008 . 1 . . . . A 45 TYR N . 30352 1 498 . 1 1 46 46 SER H H 1 9.066 0.001 . 1 . . . . A 46 SER H . 30352 1 499 . 1 1 46 46 SER HA H 1 4.739 0.001 . 1 . . . . A 46 SER HA . 30352 1 500 . 1 1 46 46 SER HB2 H 1 3.729 0.000 . 2 . . . . A 46 SER HB2 . 30352 1 501 . 1 1 46 46 SER HB3 H 1 3.729 0.000 . 2 . . . . A 46 SER HB3 . 30352 1 502 . 1 1 46 46 SER C C 13 172.770 0.000 . 1 . . . . A 46 SER C . 30352 1 503 . 1 1 46 46 SER CA C 13 56.271 0.000 . 1 . . . . A 46 SER CA . 30352 1 504 . 1 1 46 46 SER CB C 13 65.566 0.001 . 1 . . . . A 46 SER CB . 30352 1 505 . 1 1 46 46 SER N N 15 116.036 0.006 . 1 . . . . A 46 SER N . 30352 1 506 . 1 1 47 47 SER H H 1 8.064 0.000 . 1 . . . . A 47 SER H . 30352 1 507 . 1 1 47 47 SER HA H 1 5.226 0.001 . 1 . . . . A 47 SER HA . 30352 1 508 . 1 1 47 47 SER HB2 H 1 3.597 0.000 . 2 . . . . A 47 SER HB2 . 30352 1 509 . 1 1 47 47 SER HB3 H 1 3.597 0.000 . 2 . . . . A 47 SER HB3 . 30352 1 510 . 1 1 47 47 SER C C 13 173.773 0.000 . 1 . . . . A 47 SER C . 30352 1 511 . 1 1 47 47 SER CA C 13 56.102 0.000 . 1 . . . . A 47 SER CA . 30352 1 512 . 1 1 47 47 SER CB C 13 66.266 0.000 . 1 . . . . A 47 SER CB . 30352 1 513 . 1 1 47 47 SER N N 15 115.742 0.000 . 1 . . . . A 47 SER N . 30352 1 514 . 1 1 48 48 GLY H H 1 7.309 0.003 . 1 . . . . A 48 GLY H . 30352 1 515 . 1 1 48 48 GLY HA2 H 1 3.728 0.000 . 2 . . . . A 48 GLY HA2 . 30352 1 516 . 1 1 48 48 GLY HA3 H 1 3.553 0.000 . 2 . . . . A 48 GLY HA3 . 30352 1 517 . 1 1 48 48 GLY C C 13 168.296 0.000 . 1 . . . . A 48 GLY C . 30352 1 518 . 1 1 48 48 GLY CA C 13 45.441 0.000 . 1 . . . . A 48 GLY CA . 30352 1 519 . 1 1 48 48 GLY N N 15 107.064 0.003 . 1 . . . . A 48 GLY N . 30352 1 520 . 1 1 49 49 CYS H H 1 8.307 0.003 . 1 . . . . A 49 CYS H . 30352 1 521 . 1 1 49 49 CYS HA H 1 4.970 0.000 . 1 . . . . A 49 CYS HA . 30352 1 522 . 1 1 49 49 CYS HB2 H 1 2.495 0.000 . 2 . . . . A 49 CYS HB2 . 30352 1 523 . 1 1 49 49 CYS HB3 H 1 2.563 0.000 . 2 . . . . A 49 CYS HB3 . 30352 1 524 . 1 1 49 49 CYS C C 13 173.424 0.000 . 1 . . . . A 49 CYS C . 30352 1 525 . 1 1 49 49 CYS CA C 13 54.764 0.000 . 1 . . . . A 49 CYS CA . 30352 1 526 . 1 1 49 49 CYS CB C 13 42.451 0.012 . 1 . . . . A 49 CYS CB . 30352 1 527 . 1 1 49 49 CYS N N 15 118.652 0.021 . 1 . . . . A 49 CYS N . 30352 1 528 . 1 1 50 50 ALA H H 1 8.696 0.002 . 1 . . . . A 50 ALA H . 30352 1 529 . 1 1 50 50 ALA HA H 1 4.754 0.006 . 1 . . . . A 50 ALA HA . 30352 1 530 . 1 1 50 50 ALA HB1 H 1 1.392 0.002 . 1 . . . . A 50 ALA HB1 . 30352 1 531 . 1 1 50 50 ALA HB2 H 1 1.392 0.002 . 1 . . . . A 50 ALA HB2 . 30352 1 532 . 1 1 50 50 ALA HB3 H 1 1.392 0.002 . 1 . . . . A 50 ALA HB3 . 30352 1 533 . 1 1 50 50 ALA C C 13 176.727 0.000 . 1 . . . . A 50 ALA C . 30352 1 534 . 1 1 50 50 ALA CA C 13 51.474 0.000 . 1 . . . . A 50 ALA CA . 30352 1 535 . 1 1 50 50 ALA CB C 13 23.099 0.000 . 1 . . . . A 50 ALA CB . 30352 1 536 . 1 1 50 50 ALA N N 15 128.688 0.003 . 1 . . . . A 50 ALA N . 30352 1 537 . 1 1 51 51 GLN H H 1 8.726 0.003 . 1 . . . . A 51 GLN H . 30352 1 538 . 1 1 51 51 GLN HA H 1 4.602 0.001 . 1 . . . . A 51 GLN HA . 30352 1 539 . 1 1 51 51 GLN HB2 H 1 1.759 0.003 . 2 . . . . A 51 GLN HB2 . 30352 1 540 . 1 1 51 51 GLN HB3 H 1 1.756 0.000 . 2 . . . . A 51 GLN HB3 . 30352 1 541 . 1 1 51 51 GLN HG2 H 1 2.123 0.000 . 2 . . . . A 51 GLN HG2 . 30352 1 542 . 1 1 51 51 GLN HG3 H 1 2.042 0.000 . 2 . . . . A 51 GLN HG3 . 30352 1 543 . 1 1 51 51 GLN C C 13 175.406 0.000 . 1 . . . . A 51 GLN C . 30352 1 544 . 1 1 51 51 GLN CA C 13 56.550 0.000 . 1 . . . . A 51 GLN CA . 30352 1 545 . 1 1 51 51 GLN CB C 13 29.898 0.000 . 1 . . . . A 51 GLN CB . 30352 1 546 . 1 1 51 51 GLN CG C 13 34.403 0.028 . 1 . . . . A 51 GLN CG . 30352 1 547 . 1 1 51 51 GLN N N 15 120.857 0.018 . 1 . . . . A 51 GLN N . 30352 1 548 . 1 1 52 52 THR H H 1 9.095 0.001 . 1 . . . . A 52 THR H . 30352 1 549 . 1 1 52 52 THR HA H 1 4.700 0.001 . 1 . . . . A 52 THR HA . 30352 1 550 . 1 1 52 52 THR HB H 1 3.955 0.000 . 1 . . . . A 52 THR HB . 30352 1 551 . 1 1 52 52 THR HG21 H 1 1.012 0.000 . 1 . . . . A 52 THR HG21 . 30352 1 552 . 1 1 52 52 THR HG22 H 1 1.012 0.000 . 1 . . . . A 52 THR HG22 . 30352 1 553 . 1 1 52 52 THR HG23 H 1 1.012 0.000 . 1 . . . . A 52 THR HG23 . 30352 1 554 . 1 1 52 52 THR C C 13 172.183 0.000 . 1 . . . . A 52 THR C . 30352 1 555 . 1 1 52 52 THR CA C 13 60.903 0.001 . 1 . . . . A 52 THR CA . 30352 1 556 . 1 1 52 52 THR CB C 13 70.905 0.000 . 1 . . . . A 52 THR CB . 30352 1 557 . 1 1 52 52 THR CG2 C 13 19.761 0.000 . 1 . . . . A 52 THR CG2 . 30352 1 558 . 1 1 52 52 THR N N 15 120.172 0.000 . 1 . . . . A 52 THR N . 30352 1 559 . 1 1 53 53 TRP H H 1 8.750 0.002 . 1 . . . . A 53 TRP H . 30352 1 560 . 1 1 53 53 TRP HA H 1 3.957 0.001 . 1 . . . . A 53 TRP HA . 30352 1 561 . 1 1 53 53 TRP HB2 H 1 2.937 0.000 . 2 . . . . A 53 TRP HB2 . 30352 1 562 . 1 1 53 53 TRP HB3 H 1 2.776 0.000 . 2 . . . . A 53 TRP HB3 . 30352 1 563 . 1 1 53 53 TRP HD1 H 1 6.664 0.000 . 1 . . . . A 53 TRP HD1 . 30352 1 564 . 1 1 53 53 TRP HE1 H 1 9.954 0.000 . 1 . . . . A 53 TRP HE1 . 30352 1 565 . 1 1 53 53 TRP HE3 H 1 5.712 0.001 . 1 . . . . A 53 TRP HE3 . 30352 1 566 . 1 1 53 53 TRP HZ2 H 1 7.183 0.000 . 1 . . . . A 53 TRP HZ2 . 30352 1 567 . 1 1 53 53 TRP HZ3 H 1 6.539 0.000 . 1 . . . . A 53 TRP HZ3 . 30352 1 568 . 1 1 53 53 TRP HH2 H 1 6.866 0.001 . 1 . . . . A 53 TRP HH2 . 30352 1 569 . 1 1 53 53 TRP C C 13 175.553 0.000 . 1 . . . . A 53 TRP C . 30352 1 570 . 1 1 53 53 TRP CA C 13 58.327 0.058 . 1 . . . . A 53 TRP CA . 30352 1 571 . 1 1 53 53 TRP CB C 13 29.601 0.000 . 1 . . . . A 53 TRP CB . 30352 1 572 . 1 1 53 53 TRP CD1 C 13 126.764 0.006 . 1 . . . . A 53 TRP CD1 . 30352 1 573 . 1 1 53 53 TRP CE3 C 13 120.072 0.024 . 1 . . . . A 53 TRP CE3 . 30352 1 574 . 1 1 53 53 TRP CZ2 C 13 113.791 0.011 . 1 . . . . A 53 TRP CZ2 . 30352 1 575 . 1 1 53 53 TRP CZ3 C 13 121.586 0.060 . 1 . . . . A 53 TRP CZ3 . 30352 1 576 . 1 1 53 53 TRP CH2 C 13 124.634 0.019 . 1 . . . . A 53 TRP CH2 . 30352 1 577 . 1 1 53 53 TRP N N 15 126.769 0.001 . 1 . . . . A 53 TRP N . 30352 1 578 . 1 1 53 53 TRP NE1 N 15 128.365 0.000 . 1 . . . . A 53 TRP NE1 . 30352 1 579 . 1 1 54 54 SER H H 1 7.680 0.003 . 1 . . . . A 54 SER H . 30352 1 580 . 1 1 54 54 SER HA H 1 4.470 0.000 . 1 . . . . A 54 SER HA . 30352 1 581 . 1 1 54 54 SER HB2 H 1 3.484 0.000 . 2 . . . . A 54 SER HB2 . 30352 1 582 . 1 1 54 54 SER HB3 H 1 3.484 0.000 . 2 . . . . A 54 SER HB3 . 30352 1 583 . 1 1 54 54 SER C C 13 174.318 0.000 . 1 . . . . A 54 SER C . 30352 1 584 . 1 1 54 54 SER CA C 13 55.075 0.000 . 1 . . . . A 54 SER CA . 30352 1 585 . 1 1 54 54 SER CB C 13 63.719 0.001 . 1 . . . . A 54 SER CB . 30352 1 586 . 1 1 54 54 SER N N 15 122.459 0.007 . 1 . . . . A 54 SER N . 30352 1 587 . 1 1 55 55 ALA H H 1 8.679 0.003 . 1 . . . . A 55 ALA H . 30352 1 588 . 1 1 55 55 ALA HA H 1 3.831 0.000 . 1 . . . . A 55 ALA HA . 30352 1 589 . 1 1 55 55 ALA HB1 H 1 1.407 0.000 . 1 . . . . A 55 ALA HB1 . 30352 1 590 . 1 1 55 55 ALA HB2 H 1 1.407 0.000 . 1 . . . . A 55 ALA HB2 . 30352 1 591 . 1 1 55 55 ALA HB3 H 1 1.407 0.000 . 1 . . . . A 55 ALA HB3 . 30352 1 592 . 1 1 55 55 ALA C C 13 179.897 0.000 . 1 . . . . A 55 ALA C . 30352 1 593 . 1 1 55 55 ALA CA C 13 54.625 0.000 . 1 . . . . A 55 ALA CA . 30352 1 594 . 1 1 55 55 ALA CB C 13 18.480 0.001 . 1 . . . . A 55 ALA CB . 30352 1 595 . 1 1 55 55 ALA N N 15 131.817 0.007 . 1 . . . . A 55 ALA N . 30352 1 596 . 1 1 56 56 MET H H 1 8.053 0.004 . 1 . . . . A 56 MET H . 30352 1 597 . 1 1 56 56 MET HA H 1 4.066 0.000 . 1 . . . . A 56 MET HA . 30352 1 598 . 1 1 56 56 MET HB2 H 1 1.875 0.000 . 2 . . . . A 56 MET HB2 . 30352 1 599 . 1 1 56 56 MET HB3 H 1 1.818 0.000 . 2 . . . . A 56 MET HB3 . 30352 1 600 . 1 1 56 56 MET HG2 H 1 2.475 0.000 . 2 . . . . A 56 MET HG2 . 30352 1 601 . 1 1 56 56 MET HG3 H 1 2.394 0.000 . 2 . . . . A 56 MET HG3 . 30352 1 602 . 1 1 56 56 MET C C 13 177.440 0.000 . 1 . . . . A 56 MET C . 30352 1 603 . 1 1 56 56 MET CA C 13 57.766 0.000 . 1 . . . . A 56 MET CA . 30352 1 604 . 1 1 56 56 MET CB C 13 32.081 0.000 . 1 . . . . A 56 MET CB . 30352 1 605 . 1 1 56 56 MET CG C 13 32.105 0.003 . 1 . . . . A 56 MET CG . 30352 1 606 . 1 1 56 56 MET N N 15 115.996 0.007 . 1 . . . . A 56 MET N . 30352 1 607 . 1 1 57 57 GLU H H 1 7.345 0.005 . 1 . . . . A 57 GLU H . 30352 1 608 . 1 1 57 57 GLU HA H 1 4.130 0.004 . 1 . . . . A 57 GLU HA . 30352 1 609 . 1 1 57 57 GLU HB2 H 1 1.424 0.000 . 2 . . . . A 57 GLU HB2 . 30352 1 610 . 1 1 57 57 GLU HB3 H 1 1.890 0.000 . 2 . . . . A 57 GLU HB3 . 30352 1 611 . 1 1 57 57 GLU HG2 H 1 2.123 0.000 . 2 . . . . A 57 GLU HG2 . 30352 1 612 . 1 1 57 57 GLU HG3 H 1 2.123 0.000 . 2 . . . . A 57 GLU HG3 . 30352 1 613 . 1 1 57 57 GLU C C 13 176.637 0.000 . 1 . . . . A 57 GLU C . 30352 1 614 . 1 1 57 57 GLU CA C 13 55.764 0.000 . 1 . . . . A 57 GLU CA . 30352 1 615 . 1 1 57 57 GLU CB C 13 28.879 0.003 . 1 . . . . A 57 GLU CB . 30352 1 616 . 1 1 57 57 GLU CG C 13 33.881 0.000 . 1 . . . . A 57 GLU CG . 30352 1 617 . 1 1 57 57 GLU N N 15 115.242 0.006 . 1 . . . . A 57 GLU N . 30352 1 618 . 1 1 58 58 GLY H H 1 7.723 0.003 . 1 . . . . A 58 GLY H . 30352 1 619 . 1 1 58 58 GLY HA2 H 1 3.383 0.000 . 2 . . . . A 58 GLY HA2 . 30352 1 620 . 1 1 58 58 GLY HA3 H 1 3.735 0.000 . 2 . . . . A 58 GLY HA3 . 30352 1 621 . 1 1 58 58 GLY C C 13 173.844 0.000 . 1 . . . . A 58 GLY C . 30352 1 622 . 1 1 58 58 GLY CA C 13 46.145 0.029 . 1 . . . . A 58 GLY CA . 30352 1 623 . 1 1 58 58 GLY N N 15 109.063 0.005 . 1 . . . . A 58 GLY N . 30352 1 624 . 1 1 59 59 GLY H H 1 6.495 0.002 . 1 . . . . A 59 GLY H . 30352 1 625 . 1 1 59 59 GLY HA2 H 1 3.479 0.000 . 2 . . . . A 59 GLY HA2 . 30352 1 626 . 1 1 59 59 GLY HA3 H 1 3.030 0.000 . 2 . . . . A 59 GLY HA3 . 30352 1 627 . 1 1 59 59 GLY C C 13 171.140 0.000 . 1 . . . . A 59 GLY C . 30352 1 628 . 1 1 59 59 GLY CA C 13 44.528 0.001 . 1 . . . . A 59 GLY CA . 30352 1 629 . 1 1 59 59 GLY N N 15 105.253 0.005 . 1 . . . . A 59 GLY N . 30352 1 630 . 1 1 60 60 PHE H H 1 8.373 0.003 . 1 . . . . A 60 PHE H . 30352 1 631 . 1 1 60 60 PHE HA H 1 4.787 0.001 . 1 . . . . A 60 PHE HA . 30352 1 632 . 1 1 60 60 PHE HB2 H 1 2.776 0.000 . 2 . . . . A 60 PHE HB2 . 30352 1 633 . 1 1 60 60 PHE HB3 H 1 2.726 0.000 . 2 . . . . A 60 PHE HB3 . 30352 1 634 . 1 1 60 60 PHE HD1 H 1 7.136 0.001 . 1 . . . . A 60 PHE HD1 . 30352 1 635 . 1 1 60 60 PHE HD2 H 1 7.136 0.001 . 1 . . . . A 60 PHE HD2 . 30352 1 636 . 1 1 60 60 PHE HE1 H 1 7.389 0.001 . 1 . . . . A 60 PHE HE1 . 30352 1 637 . 1 1 60 60 PHE HE2 H 1 7.389 0.001 . 1 . . . . A 60 PHE HE2 . 30352 1 638 . 1 1 60 60 PHE HZ H 1 7.217 0.000 . 1 . . . . A 60 PHE HZ . 30352 1 639 . 1 1 60 60 PHE C C 13 176.489 0.000 . 1 . . . . A 60 PHE C . 30352 1 640 . 1 1 60 60 PHE CA C 13 59.087 0.000 . 1 . . . . A 60 PHE CA . 30352 1 641 . 1 1 60 60 PHE CB C 13 40.496 0.005 . 1 . . . . A 60 PHE CB . 30352 1 642 . 1 1 60 60 PHE CD1 C 13 131.861 0.000 . 1 . . . . A 60 PHE CD1 . 30352 1 643 . 1 1 60 60 PHE CE1 C 13 131.699 0.007 . 1 . . . . A 60 PHE CE1 . 30352 1 644 . 1 1 60 60 PHE CZ C 13 130.299 0.006 . 1 . . . . A 60 PHE CZ . 30352 1 645 . 1 1 60 60 PHE N N 15 118.280 0.011 . 1 . . . . A 60 PHE N . 30352 1 646 . 1 1 61 61 VAL H H 1 8.965 0.002 . 1 . . . . A 61 VAL H . 30352 1 647 . 1 1 61 61 VAL HA H 1 4.422 0.002 . 1 . . . . A 61 VAL HA . 30352 1 648 . 1 1 61 61 VAL HB H 1 1.988 0.006 . 1 . . . . A 61 VAL HB . 30352 1 649 . 1 1 61 61 VAL HG11 H 1 0.647 0.000 . 2 . . . . A 61 VAL HG11 . 30352 1 650 . 1 1 61 61 VAL HG12 H 1 0.647 0.000 . 2 . . . . A 61 VAL HG12 . 30352 1 651 . 1 1 61 61 VAL HG13 H 1 0.647 0.000 . 2 . . . . A 61 VAL HG13 . 30352 1 652 . 1 1 61 61 VAL HG21 H 1 0.721 0.000 . 2 . . . . A 61 VAL HG21 . 30352 1 653 . 1 1 61 61 VAL HG22 H 1 0.721 0.000 . 2 . . . . A 61 VAL HG22 . 30352 1 654 . 1 1 61 61 VAL HG23 H 1 0.721 0.000 . 2 . . . . A 61 VAL HG23 . 30352 1 655 . 1 1 61 61 VAL C C 13 174.857 0.000 . 1 . . . . A 61 VAL C . 30352 1 656 . 1 1 61 61 VAL CA C 13 59.958 0.000 . 1 . . . . A 61 VAL CA . 30352 1 657 . 1 1 61 61 VAL CB C 13 35.315 0.000 . 1 . . . . A 61 VAL CB . 30352 1 658 . 1 1 61 61 VAL CG1 C 13 19.482 0.000 . 1 . . . . A 61 VAL CG1 . 30352 1 659 . 1 1 61 61 VAL CG2 C 13 21.450 0.000 . 1 . . . . A 61 VAL CG2 . 30352 1 660 . 1 1 61 61 VAL N N 15 119.328 0.005 . 1 . . . . A 61 VAL N . 30352 1 661 . 1 1 62 62 ARG H H 1 8.419 0.003 . 1 . . . . A 62 ARG H . 30352 1 662 . 1 1 62 62 ARG HA H 1 4.687 0.004 . 1 . . . . A 62 ARG HA . 30352 1 663 . 1 1 62 62 ARG HB2 H 1 1.800 0.000 . 2 . . . . A 62 ARG HB2 . 30352 1 664 . 1 1 62 62 ARG HB3 H 1 1.800 0.000 . 2 . . . . A 62 ARG HB3 . 30352 1 665 . 1 1 62 62 ARG HG2 H 1 1.484 0.000 . 2 . . . . A 62 ARG HG2 . 30352 1 666 . 1 1 62 62 ARG HG3 H 1 1.257 0.000 . 2 . . . . A 62 ARG HG3 . 30352 1 667 . 1 1 62 62 ARG HD2 H 1 3.067 0.000 . 2 . . . . A 62 ARG HD2 . 30352 1 668 . 1 1 62 62 ARG HD3 H 1 3.031 0.000 . 2 . . . . A 62 ARG HD3 . 30352 1 669 . 1 1 62 62 ARG C C 13 176.543 0.000 . 1 . . . . A 62 ARG C . 30352 1 670 . 1 1 62 62 ARG CA C 13 56.409 0.000 . 1 . . . . A 62 ARG CA . 30352 1 671 . 1 1 62 62 ARG CB C 13 31.274 0.000 . 1 . . . . A 62 ARG CB . 30352 1 672 . 1 1 62 62 ARG CG C 13 28.620 0.020 . 1 . . . . A 62 ARG CG . 30352 1 673 . 1 1 62 62 ARG CD C 13 43.712 0.000 . 1 . . . . A 62 ARG CD . 30352 1 674 . 1 1 62 62 ARG N N 15 124.189 0.007 . 1 . . . . A 62 ARG N . 30352 1 675 . 1 1 63 63 GLU H H 1 8.416 0.005 . 1 . . . . A 63 GLU H . 30352 1 676 . 1 1 63 63 GLU HA H 1 5.215 0.000 . 1 . . . . A 63 GLU HA . 30352 1 677 . 1 1 63 63 GLU HB2 H 1 1.719 0.000 . 2 . . . . A 63 GLU HB2 . 30352 1 678 . 1 1 63 63 GLU HB3 H 1 1.578 0.000 . 2 . . . . A 63 GLU HB3 . 30352 1 679 . 1 1 63 63 GLU HG2 H 1 2.050 0.000 . 2 . . . . A 63 GLU HG2 . 30352 1 680 . 1 1 63 63 GLU HG3 H 1 1.958 0.000 . 2 . . . . A 63 GLU HG3 . 30352 1 681 . 1 1 63 63 GLU C C 13 176.955 0.000 . 1 . . . . A 63 GLU C . 30352 1 682 . 1 1 63 63 GLU CA C 13 54.113 0.000 . 1 . . . . A 63 GLU CA . 30352 1 683 . 1 1 63 63 GLU CB C 13 34.671 0.003 . 1 . . . . A 63 GLU CB . 30352 1 684 . 1 1 63 63 GLU CG C 13 33.672 0.006 . 1 . . . . A 63 GLU CG . 30352 1 685 . 1 1 63 63 GLU N N 15 121.715 0.001 . 1 . . . . A 63 GLU N . 30352 1 686 . 1 1 64 64 CYS H H 1 8.360 0.002 . 1 . . . . A 64 CYS H . 30352 1 687 . 1 1 64 64 CYS HA H 1 5.378 0.004 . 1 . . . . A 64 CYS HA . 30352 1 688 . 1 1 64 64 CYS HB2 H 1 3.100 0.001 . 2 . . . . A 64 CYS HB2 . 30352 1 689 . 1 1 64 64 CYS HB3 H 1 2.797 0.000 . 2 . . . . A 64 CYS HB3 . 30352 1 690 . 1 1 64 64 CYS C C 13 175.003 0.000 . 1 . . . . A 64 CYS C . 30352 1 691 . 1 1 64 64 CYS CA C 13 54.835 0.000 . 1 . . . . A 64 CYS CA . 30352 1 692 . 1 1 64 64 CYS CB C 13 38.425 0.000 . 1 . . . . A 64 CYS CB . 30352 1 693 . 1 1 64 64 CYS N N 15 120.930 0.016 . 1 . . . . A 64 CYS N . 30352 1 694 . 1 1 65 65 TYR H H 1 8.600 0.002 . 1 . . . . A 65 TYR H . 30352 1 695 . 1 1 65 65 TYR HA H 1 5.333 0.000 . 1 . . . . A 65 TYR HA . 30352 1 696 . 1 1 65 65 TYR HB2 H 1 2.805 0.000 . 2 . . . . A 65 TYR HB2 . 30352 1 697 . 1 1 65 65 TYR HB3 H 1 2.896 0.000 . 2 . . . . A 65 TYR HB3 . 30352 1 698 . 1 1 65 65 TYR HD1 H 1 6.746 0.000 . 1 . . . . A 65 TYR HD1 . 30352 1 699 . 1 1 65 65 TYR HD2 H 1 6.746 0.000 . 1 . . . . A 65 TYR HD2 . 30352 1 700 . 1 1 65 65 TYR HE1 H 1 6.497 0.000 . 1 . . . . A 65 TYR HE1 . 30352 1 701 . 1 1 65 65 TYR HE2 H 1 6.497 0.000 . 1 . . . . A 65 TYR HE2 . 30352 1 702 . 1 1 65 65 TYR C C 13 173.856 0.000 . 1 . . . . A 65 TYR C . 30352 1 703 . 1 1 65 65 TYR CA C 13 56.010 0.000 . 1 . . . . A 65 TYR CA . 30352 1 704 . 1 1 65 65 TYR CB C 13 42.509 0.012 . 1 . . . . A 65 TYR CB . 30352 1 705 . 1 1 65 65 TYR CD2 C 13 133.954 0.011 . 1 . . . . A 65 TYR CD2 . 30352 1 706 . 1 1 65 65 TYR CE2 C 13 117.479 0.000 . 1 . . . . A 65 TYR CE2 . 30352 1 707 . 1 1 65 65 TYR N N 15 117.985 0.003 . 1 . . . . A 65 TYR N . 30352 1 708 . 1 1 66 66 ILE H H 1 8.532 0.002 . 1 . . . . A 66 ILE H . 30352 1 709 . 1 1 66 66 ILE HA H 1 4.694 0.000 . 1 . . . . A 66 ILE HA . 30352 1 710 . 1 1 66 66 ILE HB H 1 1.413 0.000 . 1 . . . . A 66 ILE HB . 30352 1 711 . 1 1 66 66 ILE HG12 H 1 1.339 0.000 . 2 . . . . A 66 ILE HG12 . 30352 1 712 . 1 1 66 66 ILE HG13 H 1 0.740 0.000 . 2 . . . . A 66 ILE HG13 . 30352 1 713 . 1 1 66 66 ILE HG21 H 1 0.628 0.000 . 1 . . . . A 66 ILE HG21 . 30352 1 714 . 1 1 66 66 ILE HG22 H 1 0.628 0.000 . 1 . . . . A 66 ILE HG22 . 30352 1 715 . 1 1 66 66 ILE HG23 H 1 0.628 0.000 . 1 . . . . A 66 ILE HG23 . 30352 1 716 . 1 1 66 66 ILE HD11 H 1 0.056 0.000 . 1 . . . . A 66 ILE HD11 . 30352 1 717 . 1 1 66 66 ILE HD12 H 1 0.056 0.000 . 1 . . . . A 66 ILE HD12 . 30352 1 718 . 1 1 66 66 ILE HD13 H 1 0.056 0.000 . 1 . . . . A 66 ILE HD13 . 30352 1 719 . 1 1 66 66 ILE C C 13 174.776 0.000 . 1 . . . . A 66 ILE C . 30352 1 720 . 1 1 66 66 ILE CA C 13 61.651 0.000 . 1 . . . . A 66 ILE CA . 30352 1 721 . 1 1 66 66 ILE CB C 13 41.103 0.000 . 1 . . . . A 66 ILE CB . 30352 1 722 . 1 1 66 66 ILE CG1 C 13 28.006 0.000 . 1 . . . . A 66 ILE CG1 . 30352 1 723 . 1 1 66 66 ILE CG2 C 13 19.719 0.000 . 1 . . . . A 66 ILE CG2 . 30352 1 724 . 1 1 66 66 ILE CD1 C 13 12.811 0.001 . 1 . . . . A 66 ILE CD1 . 30352 1 725 . 1 1 66 66 ILE N N 15 120.653 0.001 . 1 . . . . A 66 ILE N . 30352 1 726 . 1 1 67 67 CYS H H 1 9.205 0.002 . 1 . . . . A 67 CYS H . 30352 1 727 . 1 1 67 67 CYS HA H 1 4.966 0.000 . 1 . . . . A 67 CYS HA . 30352 1 728 . 1 1 67 67 CYS HB2 H 1 3.036 0.000 . 2 . . . . A 67 CYS HB2 . 30352 1 729 . 1 1 67 67 CYS HB3 H 1 3.036 0.000 . 2 . . . . A 67 CYS HB3 . 30352 1 730 . 1 1 67 67 CYS C C 13 172.828 0.000 . 1 . . . . A 67 CYS C . 30352 1 731 . 1 1 67 67 CYS CA C 13 53.886 0.000 . 1 . . . . A 67 CYS CA . 30352 1 732 . 1 1 67 67 CYS CB C 13 45.189 0.035 . 1 . . . . A 67 CYS CB . 30352 1 733 . 1 1 67 67 CYS N N 15 122.570 0.001 . 1 . . . . A 67 CYS N . 30352 1 734 . 1 1 68 68 ALA H H 1 9.099 0.002 . 1 . . . . A 68 ALA H . 30352 1 735 . 1 1 68 68 ALA HA H 1 4.576 0.000 . 1 . . . . A 68 ALA HA . 30352 1 736 . 1 1 68 68 ALA HB1 H 1 1.373 0.000 . 1 . . . . A 68 ALA HB1 . 30352 1 737 . 1 1 68 68 ALA HB2 H 1 1.373 0.000 . 1 . . . . A 68 ALA HB2 . 30352 1 738 . 1 1 68 68 ALA HB3 H 1 1.373 0.000 . 1 . . . . A 68 ALA HB3 . 30352 1 739 . 1 1 68 68 ALA C C 13 177.664 0.000 . 1 . . . . A 68 ALA C . 30352 1 740 . 1 1 68 68 ALA CA C 13 52.344 0.001 . 1 . . . . A 68 ALA CA . 30352 1 741 . 1 1 68 68 ALA CB C 13 18.305 0.000 . 1 . . . . A 68 ALA CB . 30352 1 742 . 1 1 68 68 ALA N N 15 126.893 0.000 . 1 . . . . A 68 ALA N . 30352 1 743 . 1 1 69 69 VAL H H 1 8.122 0.003 . 1 . . . . A 69 VAL H . 30352 1 744 . 1 1 69 69 VAL HA H 1 3.738 0.000 . 1 . . . . A 69 VAL HA . 30352 1 745 . 1 1 69 69 VAL HB H 1 1.885 0.000 . 1 . . . . A 69 VAL HB . 30352 1 746 . 1 1 69 69 VAL HG21 H 1 0.796 0.000 . 2 . . . . A 69 VAL HG21 . 30352 1 747 . 1 1 69 69 VAL HG22 H 1 0.796 0.000 . 2 . . . . A 69 VAL HG22 . 30352 1 748 . 1 1 69 69 VAL HG23 H 1 0.796 0.000 . 2 . . . . A 69 VAL HG23 . 30352 1 749 . 1 1 69 69 VAL C C 13 177.182 0.000 . 1 . . . . A 69 VAL C . 30352 1 750 . 1 1 69 69 VAL CA C 13 64.804 0.000 . 1 . . . . A 69 VAL CA . 30352 1 751 . 1 1 69 69 VAL CB C 13 31.909 0.000 . 1 . . . . A 69 VAL CB . 30352 1 752 . 1 1 69 69 VAL CG2 C 13 21.244 0.000 . 1 . . . . A 69 VAL CG2 . 30352 1 753 . 1 1 69 69 VAL N N 15 123.230 0.010 . 1 . . . . A 69 VAL N . 30352 1 754 . 1 1 70 70 GLU H H 1 8.389 0.002 . 1 . . . . A 70 GLU H . 30352 1 755 . 1 1 70 70 GLU HA H 1 4.178 0.001 . 1 . . . . A 70 GLU HA . 30352 1 756 . 1 1 70 70 GLU HB2 H 1 2.071 0.008 . 2 . . . . A 70 GLU HB2 . 30352 1 757 . 1 1 70 70 GLU HB3 H 1 1.889 0.008 . 2 . . . . A 70 GLU HB3 . 30352 1 758 . 1 1 70 70 GLU HG2 H 1 2.314 0.000 . 2 . . . . A 70 GLU HG2 . 30352 1 759 . 1 1 70 70 GLU HG3 H 1 2.314 0.000 . 2 . . . . A 70 GLU HG3 . 30352 1 760 . 1 1 70 70 GLU C C 13 176.032 0.000 . 1 . . . . A 70 GLU C . 30352 1 761 . 1 1 70 70 GLU CA C 13 56.534 0.000 . 1 . . . . A 70 GLU CA . 30352 1 762 . 1 1 70 70 GLU CB C 13 27.992 0.000 . 1 . . . . A 70 GLU CB . 30352 1 763 . 1 1 70 70 GLU CG C 13 33.875 0.000 . 1 . . . . A 70 GLU CG . 30352 1 764 . 1 1 70 70 GLU N N 15 117.730 0.005 . 1 . . . . A 70 GLU N . 30352 1 765 . 1 1 71 71 SER H H 1 7.819 0.003 . 1 . . . . A 71 SER H . 30352 1 766 . 1 1 71 71 SER HA H 1 4.382 0.000 . 1 . . . . A 71 SER HA . 30352 1 767 . 1 1 71 71 SER HB2 H 1 3.934 0.002 . 2 . . . . A 71 SER HB2 . 30352 1 768 . 1 1 71 71 SER HB3 H 1 3.936 0.000 . 2 . . . . A 71 SER HB3 . 30352 1 769 . 1 1 71 71 SER C C 13 175.068 0.000 . 1 . . . . A 71 SER C . 30352 1 770 . 1 1 71 71 SER CA C 13 58.279 0.000 . 1 . . . . A 71 SER CA . 30352 1 771 . 1 1 71 71 SER CB C 13 64.481 0.001 . 1 . . . . A 71 SER CB . 30352 1 772 . 1 1 71 71 SER N N 15 114.469 0.004 . 1 . . . . A 71 SER N . 30352 1 773 . 1 1 72 72 SER H H 1 8.407 0.003 . 1 . . . . A 72 SER H . 30352 1 774 . 1 1 72 72 SER HA H 1 4.317 0.001 . 1 . . . . A 72 SER HA . 30352 1 775 . 1 1 72 72 SER HB2 H 1 3.917 0.001 . 2 . . . . A 72 SER HB2 . 30352 1 776 . 1 1 72 72 SER HB3 H 1 3.863 0.001 . 2 . . . . A 72 SER HB3 . 30352 1 777 . 1 1 72 72 SER C C 13 174.598 0.000 . 1 . . . . A 72 SER C . 30352 1 778 . 1 1 72 72 SER CA C 13 59.500 0.000 . 1 . . . . A 72 SER CA . 30352 1 779 . 1 1 72 72 SER CB C 13 63.349 0.000 . 1 . . . . A 72 SER CB . 30352 1 780 . 1 1 72 72 SER N N 15 117.731 0.008 . 1 . . . . A 72 SER N . 30352 1 781 . 1 1 73 73 MET H H 1 8.027 0.002 . 1 . . . . A 73 MET H . 30352 1 782 . 1 1 73 73 MET HA H 1 4.442 0.001 . 1 . . . . A 73 MET HA . 30352 1 783 . 1 1 73 73 MET HB2 H 1 2.068 0.000 . 2 . . . . A 73 MET HB2 . 30352 1 784 . 1 1 73 73 MET HB3 H 1 1.823 0.000 . 2 . . . . A 73 MET HB3 . 30352 1 785 . 1 1 73 73 MET HG2 H 1 2.478 0.000 . 2 . . . . A 73 MET HG2 . 30352 1 786 . 1 1 73 73 MET HG3 H 1 2.391 0.000 . 2 . . . . A 73 MET HG3 . 30352 1 787 . 1 1 73 73 MET C C 13 174.889 0.000 . 1 . . . . A 73 MET C . 30352 1 788 . 1 1 73 73 MET CA C 13 55.280 0.000 . 1 . . . . A 73 MET CA . 30352 1 789 . 1 1 73 73 MET CB C 13 32.807 0.003 . 1 . . . . A 73 MET CB . 30352 1 790 . 1 1 73 73 MET CG C 13 32.279 0.001 . 1 . . . . A 73 MET CG . 30352 1 791 . 1 1 73 73 MET N N 15 119.375 0.017 . 1 . . . . A 73 MET N . 30352 1 792 . 1 1 74 74 CYS H H 1 7.725 0.003 . 1 . . . . A 74 CYS H . 30352 1 793 . 1 1 74 74 CYS HA H 1 4.394 0.000 . 1 . . . . A 74 CYS HA . 30352 1 794 . 1 1 74 74 CYS HB2 H 1 2.910 0.000 . 2 . . . . A 74 CYS HB2 . 30352 1 795 . 1 1 74 74 CYS HB3 H 1 2.770 0.000 . 2 . . . . A 74 CYS HB3 . 30352 1 796 . 1 1 74 74 CYS CA C 13 56.283 0.000 . 1 . . . . A 74 CYS CA . 30352 1 797 . 1 1 74 74 CYS CB C 13 41.324 0.028 . 1 . . . . A 74 CYS CB . 30352 1 798 . 1 1 74 74 CYS N N 15 123.155 0.010 . 1 . . . . A 74 CYS N . 30352 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 30352 _Spectral_peak_list.ID 1 _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 8 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aliphatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 # FORMAT xeasy3D # INAME 1 HC # INAME 2 C # INAME 3 H # SPECTRUM C13NOESY HC C H 2 3.694 63.854 0.363 1 T 1.020e+04 0.00e+00 a 0 0 0 0 0 3 3.201 69.038 0.352 1 T 4.981e+03 0.00e+00 a 0 0 0 0 0 4 3.201 69.033 3.681 1 T 1.500e+03 0.00e+00 a 0 730 729 728 0 5 3.203 69.056 3.208 1 T 5.842e+03 0.00e+00 a 0 0 0 0 0 7 4.069 56.659 1.495 1 T 2.703e+03 0.00e+00 a 0 0 0 0 0 8 4.071 56.806 7.994 1 T 2.485e+03 0.00e+00 a 0 0 0 0 0 10 4.071 56.718 1.219 1 T 7.651e+02 0.00e+00 a 0 0 0 0 0 11 4.069 56.775 8.200 1 T 7.477e+02 0.00e+00 a 0 0 0 0 0 21 3.955 70.905 4.697 1 T 3.218e+03 0.00e+00 a 0 837 836 0 0 22 3.952 70.869 2.773 1 T 5.117e+02 0.00e+00 a 0 0 0 0 0 23 3.954 70.880 2.042 1 T 4.541e+02 0.00e+00 a 0 0 0 0 0 24 3.955 70.880 1.765 1 T 5.059e+02 0.00e+00 a 0 0 0 0 0 25 3.955 70.928 1.016 1 T 7.105e+03 0.00e+00 a 0 0 0 0 0 26 3.956 70.897 0.726 1 T 7.043e+02 0.00e+00 a 0 0 0 0 0 27 3.955 70.880 0.654 1 T 7.506e+02 0.00e+00 a 0 0 0 0 0 28 3.955 70.880 9.095 1 T 1.189e+03 0.00e+00 a 0 0 0 0 0 29 3.954 70.880 8.751 1 T 1.362e+03 0.00e+00 a 0 0 0 0 0 38 1.456 42.213 4.126 1 T 7.680e+02 0.00e+00 a 0 0 0 0 0 40 4.119 55.572 8.156 1 T 2.030e+03 0.00e+00 a 0 0 0 0 0 41 1.455 42.213 7.893 1 T 7.470e+02 0.00e+00 a 0 0 0 0 0 43 4.124 55.627 7.717 1 T 1.513e+03 0.00e+00 a 0 0 0 0 0 44 4.124 55.798 7.348 1 T 3.706e+03 0.00e+00 a 0 0 0 0 0 45 4.125 55.791 6.473 1 T 6.521e+02 0.00e+00 a 0 0 0 0 0 47 4.119 55.619 0.745 1 T 2.554e+03 0.00e+00 a 0 0 0 0 0 50 4.126 55.762 1.898 1 T 8.565e+03 0.00e+00 a 0 0 0 0 0 51 4.125 55.760 2.116 1 T 6.402e+03 0.00e+00 a 0 0 0 0 0 52 1.424 28.950 7.348 1 T 1.149e+03 0.00e+00 a 0 0 0 0 0 53 1.461 41.919 0.766 1 T 2.632e+03 0.00e+00 a 0 0 0 0 0 54 1.892 28.888 7.347 1 T 8.475e+02 0.00e+00 a 0 0 0 0 0 56 1.890 28.876 4.128 1 T 3.141e+03 0.00e+00 a 0 915 914 0 0 57 1.889 29.067 3.477 1 T 8.822e+02 0.00e+00 a 0 0 0 0 0 58 4.126 55.840 3.439 1 T 1.144e+03 0.00e+00 a 0 0 0 0 0 60 4.125 55.578 1.640 1 T 9.501e+02 0.00e+00 a 0 0 0 0 0 61 1.464 42.024 2.070 1 T 1.095e+03 0.00e+00 a 0 98 96 97 0 62 1.890 28.876 1.429 1 T 5.362e+03 0.00e+00 a 0 0 0 0 0 71 1.463 42.018 2.813 1 T 1.010e+03 0.00e+00 a 0 0 0 0 0 77 3.727 45.478 1.482 1 T 1.181e+03 0.00e+00 a 0 0 0 0 0 78 3.799 45.235 8.165 1 T 1.034e+03 0.00e+00 a 0 0 0 0 0 90 3.381 46.190 7.719 1 T 2.722e+03 0.00e+00 a 0 0 0 0 0 91 3.734 46.116 7.721 1 T 1.836e+03 0.00e+00 a 0 0 0 0 0 92 3.385 46.000 7.194 1 T 4.972e+02 0.00e+00 a 0 0 0 0 0 93 3.742 45.963 7.225 1 T 4.757e+02 0.00e+00 a 0 0 0 0 0 94 3.382 46.148 6.482 1 T 9.383e+02 0.00e+00 a 0 0 0 0 0 95 3.737 46.036 6.478 1 T 9.258e+02 0.00e+00 a 0 0 0 0 0 96 3.383 46.174 3.735 1 T 8.359e+03 0.00e+00 a 0 930 928 929 0 98 3.735 46.116 3.384 1 T 8.545e+03 0.00e+00 a 0 929 928 930 0 100 3.384 46.110 1.380 1 T 6.735e+02 0.00e+00 a 0 0 0 0 0 101 3.734 46.116 1.383 1 T 4.599e+02 0.00e+00 a 0 0 0 0 0 102 4.110 44.676 3.527 1 T 3.246e+03 0.00e+00 a 0 468 467 469 0 103 3.537 44.739 0.781 1 T 1.645e+03 0.00e+00 a 0 0 0 0 0 105 3.536 44.720 4.118 1 T 2.960e+03 0.00e+00 a 0 469 467 468 0 106 4.109 44.712 0.773 1 T 1.196e+03 0.00e+00 a 0 0 0 0 0 108 4.109 44.712 1.492 1 T 5.123e+02 0.00e+00 a 0 0 0 0 0 109 3.536 44.710 1.500 1 T 4.950e+02 0.00e+00 a 0 0 0 0 0 110 3.535 44.710 1.741 1 T 4.477e+02 0.00e+00 a 0 0 0 0 0 111 4.109 44.712 1.735 1 T 3.423e+02 0.00e+00 a 0 0 0 0 0 114 3.536 44.710 8.984 1 T 1.038e+03 0.00e+00 a 0 0 0 0 0 115 4.109 44.749 8.978 1 T 7.463e+02 0.00e+00 a 0 0 0 0 0 117 3.538 44.710 8.346 1 T 7.500e+02 0.00e+00 a 0 0 0 0 0 118 4.110 44.712 8.340 1 T 4.074e+02 0.00e+00 a 0 0 0 0 0 119 3.469 45.286 4.251 1 T 6.176e+03 0.00e+00 a 0 352 350 351 0 121 4.251 45.283 3.463 1 T 5.974e+03 0.00e+00 a 0 351 350 352 0 122 3.471 45.286 1.550 1 T 1.123e+03 0.00e+00 a 0 0 0 0 0 123 4.252 45.283 1.534 1 T 6.802e+02 0.00e+00 a 0 0 0 0 0 124 3.469 45.286 8.353 1 T 2.367e+03 0.00e+00 a 0 0 0 0 0 125 3.468 45.286 7.759 1 T 6.250e+02 0.00e+00 a 0 0 0 0 0 126 4.250 45.283 7.763 1 T 6.130e+02 0.00e+00 a 0 0 0 0 0 127 4.252 45.283 8.353 1 T 1.504e+03 0.00e+00 a 0 0 0 0 0 128 3.480 44.527 6.486 1 T 1.353e+03 0.00e+00 a 0 0 0 0 0 131 3.035 44.527 6.490 1 T 1.256e+03 0.00e+00 a 0 0 0 0 0 132 3.480 44.527 8.367 1 T 2.614e+03 0.00e+00 a 0 0 0 0 0 133 3.033 44.570 8.367 1 T 1.244e+03 0.00e+00 a 0 0 0 0 0 134 3.036 45.184 4.959 1 T 2.607e+03 0.00e+00 a 0 0 0 0 0 135 3.479 44.527 3.030 1 T 6.515e+03 0.00e+00 a 0 936 935 937 0 136 3.030 44.529 3.479 1 T 3.966e+03 0.00e+00 a 0 937 935 936 0 137 3.554 45.441 8.304 1 T 1.664e+03 0.00e+00 a 0 0 0 0 0 138 3.554 45.441 7.254 1 T 4.604e+02 0.00e+00 a 0 0 0 0 0 139 3.553 45.441 1.479 1 T 8.480e+02 0.00e+00 a 0 0 0 0 0 141 3.728 45.441 8.303 1 T 1.891e+03 0.00e+00 a 0 0 0 0 0 142 3.553 45.441 3.728 1 T 3.011e+03 0.00e+00 a 0 789 787 788 0 143 3.727 45.441 3.553 1 T 3.531e+03 0.00e+00 a 0 788 787 789 0 150 3.739 45.082 3.739 1 T 3.734e+04 0.00e+00 a 0 0 0 0 0 151 4.318 59.500 3.918 1 T 1.387e+04 0.00e+00 a 0 1149 1148 1151 0 152 3.860 63.165 3.864 1 T 7.308e+04 0.00e+00 a 0 0 0 0 0 153 3.916 63.349 4.318 1 T 2.270e+03 0.00e+00 a 0 1151 1150 1149 0 154 3.917 63.394 8.403 1 T 9.524e+02 0.00e+00 a 0 0 0 0 0 155 3.864 63.314 8.399 1 T 9.709e+02 0.00e+00 a 0 0 0 0 0 156 4.318 59.502 8.404 1 T 5.057e+03 0.00e+00 a 0 0 0 0 0 157 3.863 63.349 4.315 1 T 3.837e+03 0.00e+00 a 0 1152 1150 1149 0 158 4.318 59.500 3.862 1 T 1.222e+04 0.00e+00 a 0 1149 1148 1152 0 159 3.916 63.349 3.863 1 T 2.889e+04 0.00e+00 a 0 1151 1150 1152 0 160 3.863 63.349 3.918 1 T 3.203e+04 0.00e+00 a 0 1152 1150 1151 0 161 4.317 59.500 1.374 1 T 5.364e+02 0.00e+00 a 0 0 0 0 0 162 4.318 59.682 0.187 1 T 4.492e+02 0.00e+00 a 0 0 0 0 0 163 4.320 59.490 7.742 1 T 8.183e+02 0.00e+00 a 0 0 0 0 0 164 4.317 59.526 8.035 1 T 4.088e+03 0.00e+00 a 0 0 0 0 0 166 3.936 64.481 4.381 1 T 4.405e+03 0.00e+00 a 0 1142 1139 1138 0 167 4.382 58.279 3.932 1 T 7.666e+03 0.00e+00 a 0 1138 1137 1140 0 168 3.934 64.484 9.111 1 T 5.905e+02 0.00e+00 a 0 0 0 0 0 169 3.936 64.477 8.404 1 T 1.464e+03 0.00e+00 a 0 0 0 0 0 171 3.935 64.457 7.816 1 T 2.831e+03 0.00e+00 a 0 0 0 0 0 172 4.383 58.286 7.823 1 T 2.787e+03 0.00e+00 a 0 0 0 0 0 173 4.380 58.286 8.415 1 T 5.687e+03 0.00e+00 a 0 0 0 0 0 174 3.935 64.409 2.341 1 T 6.661e+02 0.00e+00 a 0 0 0 0 0 175 3.935 64.475 2.801 1 T 5.345e+02 0.00e+00 a 0 0 0 0 0 176 3.935 64.405 1.371 1 T 2.246e+03 0.00e+00 a 0 0 0 0 0 177 4.384 58.286 1.400 1 T 7.200e+02 0.00e+00 a 0 0 0 0 0 178 4.384 58.286 1.837 1 T 4.896e+02 0.00e+00 a 0 0 0 0 0 179 3.485 63.651 4.471 1 T 2.176e+03 0.00e+00 a 0 0 0 0 0 180 3.485 63.602 3.480 1 T 1.307e+04 0.00e+00 a 0 0 0 0 0 181 3.482 63.612 2.124 1 T 5.434e+02 0.00e+00 a 0 0 0 0 0 182 3.487 63.581 1.890 1 T 9.754e+02 0.00e+00 a 0 0 0 0 0 183 3.485 63.609 0.671 1 T 2.243e+03 0.00e+00 a 0 0 0 0 0 184 3.484 63.580 1.435 1 T 1.778e+03 0.00e+00 a 0 0 0 0 0 185 3.484 63.719 6.484 1 T 6.073e+02 0.00e+00 a 0 877 874 0 0 186 3.483 63.710 7.345 1 T 5.524e+02 0.00e+00 a 0 0 0 0 0 187 3.485 63.536 7.678 1 T 1.620e+03 0.00e+00 a 0 0 0 0 0 188 3.484 63.516 8.639 1 T 5.785e+02 0.00e+00 a 0 0 0 0 0 189 4.471 55.075 3.485 1 T 1.972e+03 0.00e+00 a 0 0 0 0 0 190 4.470 55.075 7.690 1 T 9.033e+02 0.00e+00 a 0 873 872 0 0 192 4.699 60.903 4.701 1 T 2.116e+02 0.00e+00 a 0 835 834 835 0 193 5.227 56.102 3.597 1 T 5.523e+03 0.00e+00 a 0 777 776 779 0 196 3.597 66.366 4.273 1 T 1.701e+03 0.00e+00 a 0 0 0 0 0 197 3.596 66.346 4.709 1 T 1.195e+03 0.00e+00 a 0 0 0 0 0 198 3.597 66.266 5.225 1 T 3.873e+03 0.00e+00 a 0 781 778 777 0 200 5.228 56.177 4.684 1 T 3.029e+03 0.00e+00 a 0 0 0 0 0 201 3.595 66.319 0.079 1 T 5.373e+02 0.00e+00 a 0 0 0 0 0 202 5.225 56.149 0.058 1 T 5.062e+02 0.00e+00 a 0 0 0 0 0 203 3.597 66.276 0.605 1 T 1.412e+03 0.00e+00 a 0 0 0 0 0 204 3.598 66.319 0.761 1 T 9.933e+02 0.00e+00 a 0 0 0 0 0 205 3.598 66.285 1.326 1 T 1.405e+03 0.00e+00 a 0 0 0 0 0 206 3.598 66.319 1.477 1 T 9.443e+02 0.00e+00 a 0 0 0 0 0 207 3.598 66.286 1.776 1 T 4.321e+02 0.00e+00 a 0 0 0 0 0 208 5.229 56.064 0.714 1 T 9.648e+02 0.00e+00 a 0 0 0 0 0 209 5.227 56.298 1.360 1 T 6.935e+02 0.00e+00 a 0 0 0 0 0 210 5.225 56.221 6.717 1 T 6.146e+02 0.00e+00 a 0 0 0 0 0 211 5.227 56.134 6.483 1 T 8.252e+02 0.00e+00 a 0 0 0 0 0 212 5.227 56.144 7.306 1 T 4.396e+03 0.00e+00 a 0 0 0 0 0 213 5.231 56.110 8.078 1 T 1.488e+03 0.00e+00 a 0 0 0 0 0 214 5.225 56.147 8.553 1 T 6.020e+02 0.00e+00 a 0 0 0 0 0 215 5.227 56.149 9.201 1 T 1.137e+03 0.00e+00 a 0 0 0 0 0 217 3.599 66.319 8.541 1 T 7.522e+02 0.00e+00 a 0 0 0 0 0 218 3.599 66.273 8.070 1 T 2.256e+03 0.00e+00 a 0 0 0 0 0 220 3.599 66.273 7.304 1 T 1.788e+03 0.00e+00 a 0 0 0 0 0 221 3.599 66.319 6.747 1 T 4.299e+02 0.00e+00 a 0 0 0 0 0 222 3.729 65.564 4.740 1 T 2.292e+03 0.00e+00 a 0 0 0 0 0 225 4.740 56.271 4.738 1 T -1.135e+02 0.00e+00 a 0 766 765 766 0 226 3.727 65.624 8.071 1 T 1.948e+03 0.00e+00 a 0 0 0 0 0 227 3.729 65.629 9.068 1 T 1.487e+03 0.00e+00 a 0 0 0 0 0 228 3.729 65.566 0.803 1 T 3.102e+03 0.00e+00 a 0 770 767 0 0 229 3.200 69.027 7.556 1 T 8.749e+02 0.00e+00 a 0 0 0 0 0 230 3.201 69.019 7.256 1 T 1.546e+03 0.00e+00 a 0 0 0 0 0 231 3.200 69.079 7.057 1 T 6.604e+02 0.00e+00 a 0 0 0 0 0 232 3.199 69.027 8.058 1 T 7.173e+02 0.00e+00 a 0 0 0 0 0 233 3.204 69.027 6.783 1 T 5.392e+02 0.00e+00 a 0 0 0 0 0 234 3.203 69.027 1.863 1 T 4.896e+02 0.00e+00 a 0 0 0 0 0 235 3.690 64.212 3.205 1 T 1.909e+03 0.00e+00 a 0 728 727 730 0 240 3.694 63.854 0.795 1 T 3.752e+03 0.00e+00 a 0 0 0 0 0 241 1.246 31.418 2.201 1 T 8.884e+02 0.00e+00 a 0 455 453 454 0 242 3.696 63.854 2.197 1 T 1.359e+03 0.00e+00 a 0 452 451 454 0 243 3.695 63.877 1.512 1 T 1.560e+03 0.00e+00 a 0 0 0 0 0 244 3.694 63.844 1.251 1 T 2.235e+03 0.00e+00 a 0 0 0 0 0 245 3.695 63.851 2.820 1 T 1.876e+03 0.00e+00 a 0 0 0 0 0 246 3.695 63.845 3.141 1 T 1.961e+03 0.00e+00 a 0 0 0 0 0 247 3.695 63.885 8.311 1 T 1.429e+03 0.00e+00 a 0 0 0 0 0 248 3.692 63.895 8.548 1 T 7.519e+02 0.00e+00 a 0 0 0 0 0 249 3.695 63.868 9.003 1 T 4.637e+03 0.00e+00 a 0 0 0 0 0 250 3.691 63.903 6.759 1 T 5.777e+02 0.00e+00 a 0 0 0 0 0 251 3.696 63.827 5.348 1 T 1.369e+03 0.00e+00 a 0 0 0 0 0 252 2.208 31.439 1.250 1 T 1.630e+03 0.00e+00 a 0 454 453 455 0 255 2.208 31.439 1.477 1 T 1.137e+03 0.00e+00 a 0 0 0 0 0 256 1.250 31.435 1.470 1 T 6.075e+02 0.00e+00 a 0 0 0 0 0 258 3.788 64.817 4.461 1 T 2.949e+03 0.00e+00 a 0 0 0 0 0 259 3.724 64.914 4.464 1 T 3.411e+03 0.00e+00 a 0 0 0 0 0 260 4.463 59.072 3.790 1 T 7.049e+03 0.00e+00 a 0 0 0 0 0 261 4.463 59.072 3.728 1 T 4.980e+03 0.00e+00 a 0 0 0 0 0 265 3.787 64.779 1.269 1 T 7.468e+02 0.00e+00 a 0 0 0 0 0 266 3.723 64.818 1.273 1 T 6.967e+02 0.00e+00 a 0 0 0 0 0 267 3.790 65.061 7.805 1 T 8.591e+02 0.00e+00 a 0 511 510 518 0 268 3.722 65.061 7.805 1 T 1.458e+03 0.00e+00 a 0 512 510 0 0 269 3.789 65.072 9.481 1 T 1.017e+03 0.00e+00 a 0 511 510 507 0 270 3.723 65.034 9.489 1 T 1.352e+03 0.00e+00 a 0 512 510 507 0 271 4.463 59.072 9.481 1 T 9.051e+02 0.00e+00 a 0 509 508 507 0 272 4.465 59.072 9.878 1 T 5.703e+02 0.00e+00 a 0 0 0 0 0 274 4.461 59.072 8.355 1 T 6.560e+03 0.00e+00 a 0 254 253 270 0 275 4.461 59.072 7.791 1 T 1.213e+03 0.00e+00 a 0 509 508 518 0 276 4.463 59.072 3.037 1 T 1.374e+03 0.00e+00 a 0 0 0 0 0 277 4.462 59.072 1.249 1 T 1.093e+03 0.00e+00 a 0 0 0 0 0 278 4.461 59.072 1.577 1 T 1.209e+03 0.00e+00 a 0 0 0 0 0 279 4.462 59.072 2.083 1 T 5.497e+03 0.00e+00 a 0 0 0 0 0 280 4.457 59.095 0.769 1 T 4.664e+03 0.00e+00 a 0 0 0 0 0 281 3.804 63.638 4.756 1 T 2.291e+03 0.00e+00 a 0 491 488 487 0 282 3.804 63.611 4.599 1 T 1.002e+03 0.00e+00 a 0 0 0 0 0 283 3.805 63.669 5.221 1 T 6.695e+02 0.00e+00 a 0 0 0 0 0 285 3.806 63.591 7.780 1 T 1.410e+03 0.00e+00 a 0 0 0 0 0 286 3.805 63.676 8.417 1 T 3.474e+03 0.00e+00 a 0 491 488 0 0 287 3.806 63.669 2.014 1 T 5.773e+02 0.00e+00 a 0 0 0 0 0 288 3.803 63.669 1.783 1 T 5.781e+02 0.00e+00 a 0 0 0 0 0 289 3.805 63.669 0.729 1 T 7.383e+02 0.00e+00 a 0 0 0 0 0 290 4.767 58.686 4.766 1 T 3.322e+02 0.00e+00 a 0 487 486 487 0 295 4.066 57.766 1.876 1 T 1.131e+04 0.00e+00 a 0 894 893 0 0 297 4.062 57.523 8.690 1 T 4.299e+02 0.00e+00 a 0 0 0 0 0 298 4.062 57.764 8.054 1 T 4.905e+03 0.00e+00 a 0 0 0 0 0 301 4.062 57.671 7.346 1 T 1.873e+03 0.00e+00 a 0 0 0 0 0 302 2.479 32.338 2.085 1 T 1.819e+03 0.00e+00 a 0 0 0 0 0 303 2.396 32.279 2.091 1 T 1.819e+03 0.00e+00 a 0 0 0 0 0 309 2.397 32.121 4.067 1 T 6.346e+02 0.00e+00 a 0 0 0 0 0 310 2.392 32.078 8.049 1 T 7.674e+02 0.00e+00 a 0 0 0 0 0 311 2.476 32.140 8.046 1 T 1.025e+03 0.00e+00 a 0 0 0 0 0 312 4.062 57.852 1.400 1 T 1.349e+03 0.00e+00 a 0 0 0 0 0 313 4.065 57.795 2.396 1 T 1.774e+03 0.00e+00 a 0 0 0 0 0 314 4.064 57.795 2.472 1 T 2.628e+03 0.00e+00 a 0 0 0 0 0 315 1.824 32.376 8.041 1 T 5.931e+03 0.00e+00 a 0 0 0 0 0 316 1.827 32.383 7.265 1 T 2.218e+03 0.00e+00 a 0 0 0 0 0 317 2.570 38.894 4.567 1 T 1.303e+03 0.00e+00 a 0 0 0 0 0 321 2.570 38.899 7.451 1 T 6.978e+02 0.00e+00 a 0 0 0 0 0 322 2.570 38.899 8.016 1 T 6.528e+02 0.00e+00 a 0 0 0 0 0 324 4.501 53.093 7.927 1 T 8.081e+02 0.00e+00 a 0 0 0 0 0 325 2.048 39.251 3.235 1 T 1.880e+03 0.00e+00 a 0 0 0 0 0 326 3.235 39.213 2.057 1 T 3.364e+03 0.00e+00 a 0 0 0 0 0 327 3.236 39.208 4.460 1 T 1.354e+03 0.00e+00 a 0 614 613 0 0 328 2.048 39.224 4.463 1 T 6.801e+02 0.00e+00 a 0 615 613 0 0 329 2.049 39.224 8.649 1 T 6.796e+02 0.00e+00 a 0 0 0 0 0 330 2.049 39.224 10.028 1 T 6.128e+02 0.00e+00 a 0 0 0 0 0 331 3.233 39.189 8.661 1 T 1.013e+03 0.00e+00 a 0 0 0 0 0 332 3.235 39.190 10.032 1 T 7.437e+02 0.00e+00 a 0 0 0 0 0 333 3.235 39.073 1.604 1 T 4.227e+02 0.00e+00 a 0 0 0 0 0 334 3.189 43.618 7.118 1 T 1.642e+03 0.00e+00 a 0 0 0 0 0 336 3.191 43.393 6.563 1 T 5.314e+02 0.00e+00 a 0 0 0 0 0 337 3.189 43.641 1.501 1 T 6.247e+03 0.00e+00 a 0 558 555 0 0 338 1.491 26.642 3.182 1 T 4.445e+03 0.00e+00 a 0 0 0 0 0 339 1.491 26.692 8.671 1 T 5.429e+02 0.00e+00 a 0 0 0 0 0 340 1.495 26.733 8.868 1 T 6.233e+02 0.00e+00 a 0 0 0 0 0 342 1.488 26.694 1.933 1 T 1.631e+03 0.00e+00 a 0 0 0 0 0 343 1.491 26.640 1.782 1 T 2.585e+03 0.00e+00 a 0 554 551 0 0 344 1.490 26.640 3.684 1 T 1.331e+03 0.00e+00 a 0 0 0 0 0 346 1.492 26.640 7.102 1 T 5.452e+02 0.00e+00 a 0 0 0 0 0 347 1.490 26.640 8.382 1 T 7.044e+02 0.00e+00 a 0 0 0 0 0 348 1.489 26.694 3.626 1 T 1.279e+03 0.00e+00 a 0 0 0 0 0 349 1.798 31.274 1.483 1 T 1.263e+03 0.00e+00 a 0 0 0 0 0 350 3.630 60.008 1.498 1 T 3.692e+03 0.00e+00 a 0 0 0 0 0 351 1.781 31.579 4.209 1 T 1.525e+03 0.00e+00 a 0 323 321 0 0 353 1.798 31.205 1.248 1 T 1.016e+03 0.00e+00 a 0 0 0 0 0 354 1.795 31.191 8.406 1 T 2.157e+03 0.00e+00 a 0 0 0 0 0 355 1.798 31.289 4.690 1 T 1.374e+03 0.00e+00 a 0 0 0 0 0 356 1.797 31.091 4.450 1 T 1.142e+03 0.00e+00 a 0 0 0 0 0 358 1.800 31.274 3.066 1 T 2.441e+03 0.00e+00 a 0 988 985 0 0 360 2.948 38.748 4.426 1 T 9.098e+02 0.00e+00 a 0 0 0 0 0 364 2.818 38.717 6.958 1 T 9.768e+02 0.00e+00 a 0 0 0 0 0 365 2.948 38.713 6.957 1 T 1.499e+03 0.00e+00 a 0 0 0 0 0 369 2.938 38.414 8.143 1 T 1.623e+03 0.00e+00 a 0 0 0 0 0 412 0.792 20.933 7.582 1 T 5.497e+02 0.00e+00 a 0 0 0 0 0 413 4.213 65.483 3.728 1 T 2.802e+03 0.00e+00 a 0 0 0 0 0 414 4.212 65.429 2.302 1 T 7.879e+03 0.00e+00 a 0 0 0 0 0 415 4.213 65.483 2.021 1 T 3.414e+03 0.00e+00 a 0 0 0 0 0 416 4.212 65.499 1.783 1 T 5.118e+03 0.00e+00 a 0 0 0 0 0 417 4.217 65.403 0.775 1 T 8.232e+02 0.00e+00 a 0 0 0 0 0 418 4.212 65.494 7.269 1 T 1.365e+03 0.00e+00 a 0 0 0 0 0 419 4.213 65.483 8.347 1 T 1.003e+03 0.00e+00 a 0 0 0 0 0 420 1.783 31.579 3.736 1 T 1.388e+03 0.00e+00 a 0 0 0 0 0 421 2.305 31.594 4.209 1 T 3.853e+03 0.00e+00 a 0 322 321 0 0 422 2.305 31.580 3.726 1 T 1.329e+03 0.00e+00 a 0 0 0 0 0 423 2.303 31.580 2.021 1 T 2.573e+03 0.00e+00 a 0 0 0 0 0 424 2.305 31.556 1.782 1 T 7.145e+03 0.00e+00 a 0 0 0 0 0 425 2.020 27.785 3.726 1 T 2.374e+03 0.00e+00 a 0 0 0 0 0 426 1.899 27.785 4.205 1 T 2.993e+03 0.00e+00 a 0 327 325 0 0 427 2.019 27.765 4.416 1 T 7.690e+02 0.00e+00 a 0 0 0 0 0 428 2.019 27.785 4.210 1 T 1.196e+03 0.00e+00 a 0 326 325 0 0 429 1.900 27.718 4.368 1 T 4.865e+02 0.00e+00 a 0 0 0 0 0 430 3.672 50.613 4.215 1 T 4.575e+02 0.00e+00 a 0 0 0 0 0 431 3.727 50.613 4.211 1 T 3.703e+02 0.00e+00 a 0 0 0 0 0 432 3.727 50.595 4.425 1 T 2.410e+03 0.00e+00 a 0 329 318 0 0 433 3.673 50.595 4.425 1 T 1.939e+03 0.00e+00 a 0 330 318 0 0 434 3.725 50.613 2.303 1 T 4.714e+02 0.00e+00 a 0 0 0 0 0 435 3.672 50.613 2.299 1 T 4.373e+02 0.00e+00 a 0 0 0 0 0 436 3.724 50.623 0.820 1 T 2.611e+03 0.00e+00 a 0 0 0 0 0 437 3.673 50.594 0.816 1 T 2.022e+03 0.00e+00 a 0 0 0 0 0 438 3.670 50.607 1.533 1 T 1.074e+03 0.00e+00 a 0 0 0 0 0 439 3.724 50.607 1.530 1 T 1.381e+03 0.00e+00 a 0 0 0 0 0 440 4.213 65.483 3.673 1 T 2.471e+03 0.00e+00 a 0 0 0 0 0 441 2.305 31.580 3.669 1 T 1.087e+03 0.00e+00 a 0 0 0 0 0 442 2.020 27.785 3.671 1 T 1.997e+03 0.00e+00 a 0 0 0 0 0 443 2.020 27.785 2.292 1 T 1.754e+03 0.00e+00 a 0 0 0 0 0 444 2.020 27.785 0.858 1 T 6.286e+02 0.00e+00 a 0 0 0 0 0 445 3.726 50.613 9.065 1 T 3.940e+02 0.00e+00 a 0 0 0 0 0 447 1.782 31.579 2.307 1 T 2.711e+03 0.00e+00 a 0 0 0 0 0 448 1.781 31.579 3.666 1 T 8.719e+02 0.00e+00 a 0 0 0 0 0 449 1.782 31.579 4.438 1 T 8.676e+02 0.00e+00 a 0 0 0 0 0 450 2.306 31.580 4.434 1 T 4.005e+02 0.00e+00 a 0 0 0 0 0 451 1.784 31.579 0.796 1 T 3.939e+02 0.00e+00 a 0 0 0 0 0 452 1.898 27.811 2.301 1 T 5.782e+03 0.00e+00 a 0 0 0 0 0 453 1.898 27.785 3.726 1 T 2.030e+03 0.00e+00 a 0 0 0 0 0 454 1.898 27.785 3.664 1 T 1.780e+03 0.00e+00 a 0 0 0 0 0 455 1.898 27.992 8.385 1 T 1.290e+03 0.00e+00 a 0 0 0 0 0 456 1.896 27.992 0.838 1 T 7.184e+02 0.00e+00 a 0 0 0 0 0 457 2.673 37.144 4.446 1 T 2.555e+03 0.00e+00 a 0 0 0 0 0 458 2.670 37.144 3.121 1 T 4.921e+03 0.00e+00 a 0 0 0 0 0 459 4.446 52.723 2.678 1 T 5.710e+03 0.00e+00 a 0 0 0 0 0 460 4.446 52.653 3.127 1 T 6.803e+03 0.00e+00 a 0 336 335 338 0 461 4.446 52.667 3.437 1 T 5.047e+02 0.00e+00 a 0 0 0 0 0 462 4.446 52.667 3.733 1 T 5.684e+02 0.00e+00 a 0 0 0 0 0 463 2.674 37.144 7.226 1 T 1.161e+03 0.00e+00 a 0 339 337 0 0 464 4.445 52.667 7.286 1 T 2.295e+03 0.00e+00 a 0 0 0 0 0 465 4.446 52.667 8.343 1 T 8.311e+02 0.00e+00 a 0 0 0 0 0 467 3.128 37.136 4.440 1 T 2.890e+03 0.00e+00 a 0 0 0 0 0 468 3.127 37.144 2.676 1 T 5.032e+03 0.00e+00 a 0 0 0 0 0 469 3.127 37.144 6.571 1 T 1.078e+03 0.00e+00 a 0 0 0 0 0 470 2.674 37.144 6.560 1 T 5.161e+02 0.00e+00 a 0 0 0 0 0 471 3.127 37.144 7.219 1 T 1.314e+03 0.00e+00 a 0 338 337 0 0 472 4.445 52.667 7.223 1 T 1.725e+03 0.00e+00 a 0 0 0 0 0 474 4.290 54.406 7.765 1 T 3.105e+03 0.00e+00 a 0 358 357 0 0 475 4.292 54.415 8.455 1 T 9.488e+03 0.00e+00 a 0 0 0 0 0 476 4.290 54.386 8.693 1 T 1.248e+03 0.00e+00 a 0 0 0 0 0 478 4.294 54.459 4.017 1 T 6.147e+02 0.00e+00 a 0 0 0 0 0 480 2.032 29.649 4.300 1 T 1.957e+03 0.00e+00 a 0 360 359 358 0 481 1.940 29.673 4.293 1 T 2.224e+03 0.00e+00 a 0 361 359 358 0 482 2.032 29.690 7.761 1 T 8.869e+02 0.00e+00 a 0 360 359 0 0 483 1.941 29.680 7.764 1 T 9.371e+02 0.00e+00 a 0 361 359 0 0 484 1.942 29.680 8.452 1 T 1.308e+03 0.00e+00 a 0 0 0 0 0 485 2.031 29.690 8.449 1 T 7.975e+02 0.00e+00 a 0 0 0 0 0 486 1.941 29.680 0.814 1 T 4.146e+02 0.00e+00 a 0 0 0 0 0 487 2.032 29.690 0.817 1 T 5.797e+02 0.00e+00 a 0 0 0 0 0 488 4.295 54.386 0.819 1 T 5.666e+02 0.00e+00 a 0 0 0 0 0 489 2.149 33.778 4.289 1 T 3.036e+03 0.00e+00 a 0 366 363 358 0 490 2.147 33.825 7.758 1 T 2.405e+03 0.00e+00 a 0 0 0 0 0 491 2.149 33.761 8.446 1 T 9.376e+02 0.00e+00 a 0 0 0 0 0 492 2.148 33.783 7.197 1 T 7.590e+02 0.00e+00 a 0 0 0 0 0 493 2.147 33.798 6.514 1 T 1.004e+03 0.00e+00 a 0 0 0 0 0 495 4.296 54.386 1.939 1 T 2.958e+03 0.00e+00 a 0 358 357 361 0 496 4.295 54.386 2.031 1 T 5.676e+03 0.00e+00 a 0 358 357 360 0 497 4.296 54.386 2.147 1 T 4.482e+03 0.00e+00 a 0 0 0 0 0 498 1.601 42.574 8.421 1 T 1.336e+03 0.00e+00 a 0 0 0 0 0 499 1.362 42.516 8.404 1 T 1.216e+03 0.00e+00 a 0 0 0 0 0 500 1.365 42.514 4.364 1 T 1.406e+03 0.00e+00 a 0 380 378 377 0 501 1.600 42.561 4.354 1 T 1.243e+03 0.00e+00 a 0 379 378 377 0 502 1.600 42.566 1.365 1 T 2.947e+03 0.00e+00 a 0 0 0 0 0 503 1.363 42.566 1.605 1 T 6.941e+03 0.00e+00 a 0 0 0 0 0 504 1.362 42.566 0.766 1 T 1.629e+03 0.00e+00 a 0 0 0 0 0 505 1.183 25.680 8.394 1 T 8.337e+02 0.00e+00 a 0 0 0 0 0 506 2.980 40.955 4.460 1 T 2.091e+03 0.00e+00 a 0 402 400 0 0 507 4.481 55.109 2.977 1 T 1.816e+03 0.00e+00 a 0 0 0 0 0 508 4.479 55.144 3.209 1 T 2.152e+03 0.00e+00 a 0 0 0 0 0 509 2.982 40.846 0.848 1 T 1.451e+03 0.00e+00 a 0 0 0 0 0 510 4.480 55.105 0.847 1 T 2.363e+03 0.00e+00 a 0 0 0 0 0 511 2.978 40.904 3.213 1 T 3.086e+03 0.00e+00 a 0 0 0 0 0 512 2.981 40.907 8.355 1 T 9.345e+02 0.00e+00 a 0 402 400 0 0 513 2.978 40.904 9.041 1 T 5.403e+02 0.00e+00 a 0 0 0 0 0 514 4.478 55.105 9.034 1 T 1.756e+03 0.00e+00 a 0 0 0 0 0 515 4.480 55.105 8.360 1 T 1.543e+03 0.00e+00 a 0 399 398 0 0 516 3.193 40.904 8.354 1 T 8.125e+02 0.00e+00 a 0 401 400 397 0 517 3.194 40.916 9.051 1 T 5.181e+02 0.00e+00 a 0 0 0 0 0 518 3.192 40.916 4.462 1 T 2.238e+03 0.00e+00 a 0 401 400 0 0 519 3.195 40.916 2.984 1 T 3.221e+03 0.00e+00 a 0 0 0 0 0 520 3.192 40.916 0.846 1 T 1.287e+03 0.00e+00 a 0 0 0 0 0 521 4.361 55.991 9.031 1 T 8.687e+02 0.00e+00 a 0 0 0 0 0 522 4.361 55.985 8.687 1 T 3.646e+03 0.00e+00 a 0 0 0 0 0 523 4.362 55.991 2.938 1 T 1.340e+03 0.00e+00 a 0 0 0 0 0 525 4.362 55.991 1.860 1 T 4.723e+03 0.00e+00 a 0 0 0 0 0 526 1.860 35.181 9.025 1 T 6.612e+02 0.00e+00 a 0 0 0 0 0 527 1.813 35.181 9.027 1 T 8.302e+02 0.00e+00 a 0 0 0 0 0 528 1.812 35.089 4.366 1 T 7.324e+02 0.00e+00 a 0 0 0 0 0 529 1.861 35.181 4.361 1 T 5.630e+02 0.00e+00 a 0 0 0 0 0 530 1.860 35.181 2.936 1 T 7.540e+02 0.00e+00 a 0 413 411 0 0 531 1.812 35.181 2.936 1 T 1.014e+03 0.00e+00 a 0 412 411 0 0 532 1.812 35.179 1.416 1 T 1.181e+03 0.00e+00 a 0 0 0 0 0 533 1.861 35.179 1.418 1 T 8.698e+02 0.00e+00 a 0 0 0 0 0 534 1.859 35.181 1.593 1 T 4.573e+02 0.00e+00 a 0 0 0 0 0 535 1.812 35.181 1.597 1 T 6.747e+02 0.00e+00 a 0 0 0 0 0 536 4.361 55.991 1.815 1 T 4.106e+03 0.00e+00 a 0 0 0 0 0 537 1.596 25.738 2.938 1 T 9.044e+02 0.00e+00 a 0 416 415 0 0 538 1.417 25.738 2.931 1 T 1.874e+03 0.00e+00 a 0 417 415 0 0 539 1.599 25.712 4.358 1 T 4.712e+02 0.00e+00 a 0 0 0 0 0 540 1.418 25.746 4.308 1 T 6.304e+02 0.00e+00 a 0 0 0 0 0 541 2.948 47.679 4.806 1 T 1.590e+03 0.00e+00 a 0 501 499 498 0 542 3.108 47.666 4.807 1 T 1.928e+03 0.00e+00 a 0 500 499 498 0 544 2.950 47.611 7.781 1 T 1.208e+03 0.00e+00 a 0 0 0 0 0 545 3.108 47.611 7.786 1 T 1.269e+03 0.00e+00 a 0 0 0 0 0 546 3.106 47.611 9.482 1 T 8.386e+02 0.00e+00 a 0 500 499 0 0 547 2.948 47.611 9.485 1 T 8.986e+02 0.00e+00 a 0 501 499 0 0 548 4.815 53.492 9.487 1 T 4.512e+02 0.00e+00 a 0 498 497 0 0 549 3.106 47.634 2.918 1 T 3.066e+03 0.00e+00 a 0 500 499 0 0 551 3.108 47.679 2.484 1 T 4.885e+02 0.00e+00 a 0 0 0 0 0 552 3.109 47.679 2.178 1 T 5.254e+02 0.00e+00 a 0 0 0 0 0 553 3.107 47.618 1.862 1 T 6.526e+02 0.00e+00 a 0 0 0 0 0 554 2.950 47.672 1.865 1 T 3.803e+02 0.00e+00 a 0 0 0 0 0 555 2.950 47.672 2.182 1 T 4.494e+02 0.00e+00 a 0 0 0 0 0 556 2.950 47.672 2.469 1 T 4.480e+02 0.00e+00 a 0 0 0 0 0 557 2.951 47.672 3.109 1 T 2.742e+03 0.00e+00 a 0 501 499 0 0 558 3.389 37.743 2.406 1 T 2.266e+03 0.00e+00 a 0 603 602 0 0 559 2.408 37.665 3.378 1 T 1.911e+03 0.00e+00 a 0 604 602 0 0 560 3.391 37.693 7.367 1 T 1.181e+03 0.00e+00 a 0 603 602 0 0 561 2.413 37.688 7.378 1 T 1.436e+03 0.00e+00 a 0 604 602 0 0 562 3.386 37.688 3.615 1 T 3.322e+02 0.00e+00 a 0 0 0 0 0 563 2.411 37.688 3.609 1 T 4.251e+02 0.00e+00 a 0 0 0 0 0 564 4.767 54.848 4.769 1 T 4.374e+02 0.00e+00 a 0 601 600 0 0 565 4.970 54.766 8.305 1 T 1.244e+03 0.00e+00 a 0 0 0 0 0 566 4.969 54.688 8.678 1 T 5.407e+03 0.00e+00 a 0 0 0 0 0 567 4.969 54.749 6.749 1 T 5.383e+02 0.00e+00 a 0 0 0 0 0 568 4.967 54.749 5.371 1 T 1.316e+03 0.00e+00 a 0 0 0 0 0 569 4.970 54.764 3.636 1 T 5.260e+02 0.00e+00 a 0 795 794 0 0 571 4.970 54.749 2.561 1 T 2.395e+03 0.00e+00 a 0 0 0 0 0 572 4.969 54.749 1.403 1 T 1.021e+03 0.00e+00 a 0 0 0 0 0 573 2.563 42.438 3.631 1 T 1.370e+03 0.00e+00 a 0 797 796 0 0 574 2.495 42.463 3.633 1 T 1.165e+03 0.00e+00 a 0 798 796 0 0 575 2.562 42.463 4.996 1 T 7.105e+02 0.00e+00 a 0 0 0 0 0 576 2.495 42.463 4.996 1 T 6.371e+02 0.00e+00 a 0 0 0 0 0 577 2.564 42.463 8.314 1 T 6.183e+02 0.00e+00 a 0 0 0 0 0 578 2.494 42.463 8.318 1 T 6.257e+02 0.00e+00 a 0 0 0 0 0 581 4.969 54.749 2.495 1 T 2.163e+03 0.00e+00 a 0 0 0 0 0 582 3.099 38.425 8.344 1 T 7.728e+02 0.00e+00 a 0 0 0 0 0 583 5.374 54.933 8.337 1 T 1.894e+03 0.00e+00 a 0 0 0 0 0 584 5.373 54.910 8.607 1 T 5.313e+03 0.00e+00 a 0 0 0 0 0 585 5.373 54.935 7.357 1 T 5.439e+02 0.00e+00 a 0 0 0 0 0 586 5.372 55.033 6.764 1 T 7.945e+02 0.00e+00 a 0 0 0 0 0 587 5.373 54.797 4.960 1 T 3.046e+03 0.00e+00 a 0 0 0 0 0 588 5.373 54.823 3.683 1 T 7.516e+02 0.00e+00 a 0 0 0 0 0 589 5.373 55.035 3.397 1 T 5.122e+02 0.00e+00 a 0 0 0 0 0 590 5.374 54.865 3.093 1 T 2.472e+03 0.00e+00 a 0 0 0 0 0 591 5.374 54.959 2.799 1 T 1.555e+03 0.00e+00 a 0 0 0 0 0 592 5.374 54.906 2.533 1 T 1.122e+03 0.00e+00 a 0 0 0 0 0 593 3.101 38.425 5.380 1 T 7.327e+02 0.00e+00 a 0 1029 1028 0 0 594 3.099 38.425 2.799 1 T 1.139e+03 0.00e+00 a 0 1029 1028 0 0 595 2.797 38.425 5.385 1 T 5.649e+02 0.00e+00 a 0 1030 1028 0 0 596 2.800 38.425 8.369 1 T 7.965e+02 0.00e+00 a 0 0 0 0 0 597 3.034 45.154 9.087 1 T 8.716e+02 0.00e+00 a 0 0 0 0 0 598 3.036 45.154 9.197 1 T 7.126e+02 0.00e+00 a 0 1087 1084 0 0 599 4.966 53.886 9.090 1 T 3.523e+03 0.00e+00 a 0 0 0 0 0 600 4.966 53.886 9.200 1 T 9.616e+02 0.00e+00 a 0 1083 1082 0 0 601 3.035 45.208 6.745 1 T 9.423e+02 0.00e+00 a 0 0 0 0 0 603 4.966 53.886 3.033 1 T 3.798e+03 0.00e+00 a 0 0 0 0 0 604 3.037 45.225 2.781 1 T 1.002e+03 0.00e+00 a 0 1087 1084 0 0 605 4.392 56.321 7.750 1 T 1.279e+03 0.00e+00 a 0 0 0 0 0 610 2.770 41.352 4.395 1 T 1.081e+03 0.00e+00 a 0 1182 1180 0 0 612 2.769 41.352 7.715 1 T 4.089e+02 0.00e+00 a 0 0 0 0 0 613 2.906 41.332 7.757 1 T 5.890e+02 0.00e+00 a 0 0 0 0 0 614 2.910 41.295 4.390 1 T 1.495e+03 0.00e+00 a 0 1181 1180 0 0 615 4.394 56.283 2.769 1 T 2.340e+03 0.00e+00 a 0 0 0 0 0 616 4.394 56.283 2.911 1 T 2.024e+03 0.00e+00 a 0 1179 1178 0 0 617 4.442 55.280 8.015 1 T 1.543e+03 0.00e+00 a 0 1160 1159 0 0 618 4.442 55.238 7.738 1 T 2.998e+03 0.00e+00 a 0 0 0 0 0 619 4.443 55.293 2.476 1 T 1.616e+03 0.00e+00 a 0 0 0 0 0 620 4.445 55.293 2.071 1 T 3.648e+03 0.00e+00 a 0 0 0 0 0 621 4.442 55.293 1.821 1 T 2.950e+03 0.00e+00 a 0 0 0 0 0 623 2.068 32.804 4.439 1 T 8.079e+02 0.00e+00 a 0 1162 1161 0 0 624 2.069 32.851 2.481 1 T 8.116e+02 0.00e+00 a 0 0 0 0 0 626 2.070 32.851 8.016 1 T 3.799e+02 0.00e+00 a 0 0 0 0 0 628 1.823 32.810 4.441 1 T 6.219e+02 0.00e+00 a 0 1163 1161 0 0 629 1.823 32.851 2.476 1 T 1.892e+03 0.00e+00 a 0 0 0 0 0 630 1.907 31.508 7.368 1 T 9.054e+02 0.00e+00 a 0 0 0 0 0 631 2.205 31.508 7.370 1 T 9.930e+02 0.00e+00 a 0 0 0 0 0 632 1.875 32.081 4.066 1 T 1.411e+03 0.00e+00 a 0 896 895 0 0 633 1.818 32.081 4.063 1 T 1.026e+03 0.00e+00 a 0 897 895 0 0 634 1.886 31.962 7.346 1 T 3.880e+02 0.00e+00 a 0 0 0 0 0 635 1.884 31.962 8.126 1 T 2.673e+03 0.00e+00 a 0 0 0 0 0 636 1.883 31.962 8.374 1 T 1.633e+03 0.00e+00 a 0 0 0 0 0 637 1.820 32.081 2.402 1 T 4.494e+03 0.00e+00 a 0 0 0 0 0 638 1.819 32.081 2.473 1 T 2.722e+03 0.00e+00 a 0 0 0 0 0 639 1.873 32.081 2.404 1 T 3.130e+03 0.00e+00 a 0 0 0 0 0 640 1.874 32.081 2.476 1 T 2.023e+03 0.00e+00 a 0 0 0 0 0 641 4.065 57.766 1.813 1 T 7.546e+03 0.00e+00 a 0 0 0 0 0 642 2.881 39.282 7.591 1 T 7.482e+02 0.00e+00 a 0 0 0 0 0 643 2.825 39.217 7.593 1 T 7.403e+02 0.00e+00 a 0 0 0 0 0 644 3.791 58.666 8.039 1 T 9.424e+02 0.00e+00 a 0 0 0 0 0 645 3.792 58.600 8.444 1 T 2.463e+03 0.00e+00 a 0 29 28 27 0 646 1.460 29.266 3.794 1 T 9.182e+02 0.00e+00 a 0 32 30 0 0 647 1.389 29.274 3.792 1 T 1.030e+03 0.00e+00 a 0 31 30 0 0 648 3.385 28.463 8.038 1 T 8.671e+02 0.00e+00 a 0 0 0 0 0 649 3.254 28.438 8.030 1 T 7.728e+02 0.00e+00 a 0 0 0 0 0 650 4.349 60.103 7.639 1 T 1.494e+03 0.00e+00 a 0 0 0 0 0 651 2.935 38.427 4.650 1 T 1.647e+03 0.00e+00 a 0 82 81 0 0 652 2.787 38.429 4.651 1 T 1.790e+03 0.00e+00 a 0 83 81 0 0 653 3.670 46.281 4.699 1 T 2.638e+03 0.00e+00 a 0 117 116 118 0 654 3.332 51.498 3.989 1 T 4.564e+03 0.00e+00 a 0 185 174 186 0 655 3.591 45.073 3.825 1 T 4.105e+03 0.00e+00 a 0 0 0 0 0 656 3.337 62.154 6.323 1 T 1.379e+03 0.00e+00 a 0 0 0 0 0 657 3.334 61.930 7.681 1 T 8.921e+02 0.00e+00 a 0 124 123 122 0 658 2.512 39.446 7.681 1 T 8.702e+02 0.00e+00 a 0 0 0 0 0 660 2.512 39.607 3.340 1 T 6.576e+02 0.00e+00 a 0 128 125 124 0 661 2.511 39.607 6.325 1 T 6.285e+02 0.00e+00 a 0 0 0 0 0 662 0.716 27.658 1.150 1 T 2.470e+03 0.00e+00 a 0 0 0 0 0 663 3.937 58.757 1.166 1 T 1.472e+03 0.00e+00 a 0 0 0 0 0 664 1.602 37.302 -0.133 1 T 2.925e+03 0.00e+00 a 0 0 0 0 0 665 -0.128 15.459 1.172 1 T 3.117e+03 0.00e+00 a 0 0 0 0 0 666 1.153 27.852 3.944 1 T 8.248e+02 0.00e+00 a 0 164 163 155 0 668 0.509 12.668 3.678 1 T 1.924e+03 0.00e+00 a 0 167 168 0 0 669 -0.128 15.470 3.980 1 T 3.170e+03 0.00e+00 a 0 158 159 155 0 671 0.706 22.950 7.309 1 T 7.339e+02 0.00e+00 a 0 102 104 0 0 672 1.536 27.333 4.442 1 T 2.120e+03 0.00e+00 a 0 0 0 0 0 673 4.456 59.272 7.294 1 T 5.318e+02 0.00e+00 a 0 0 0 0 0 676 4.002 51.386 3.333 1 T 2.278e+03 0.00e+00 a 0 186 174 185 0 677 4.003 51.426 2.045 1 T 1.173e+03 0.00e+00 a 0 0 0 0 0 678 4.003 51.426 1.855 1 T 9.968e+02 0.00e+00 a 0 0 0 0 0 679 3.332 51.480 1.851 1 T 1.233e+03 0.00e+00 a 0 0 0 0 0 680 3.331 51.426 2.130 1 T 1.572e+03 0.00e+00 a 0 0 0 0 0 682 3.333 51.542 -0.132 1 T 1.523e+03 0.00e+00 a 0 0 0 0 0 683 4.000 51.582 -0.134 1 T 9.419e+02 0.00e+00 a 0 0 0 0 0 685 1.855 27.617 4.007 1 T 1.541e+03 0.00e+00 a 0 0 0 0 0 686 1.853 27.590 3.324 1 T 1.009e+03 0.00e+00 a 0 0 0 0 0 687 2.045 27.592 3.324 1 T 1.723e+03 0.00e+00 a 0 0 0 0 0 688 2.132 31.972 3.342 1 T 4.714e+02 0.00e+00 a 0 0 0 0 0 689 1.762 32.094 3.328 1 T 4.508e+02 0.00e+00 a 0 0 0 0 0 690 2.132 31.949 4.092 1 T 1.524e+03 0.00e+00 a 0 179 177 176 0 692 4.032 51.790 4.727 1 T 3.556e+03 0.00e+00 a 0 0 0 0 0 693 1.781 31.552 1.895 1 T 3.643e+03 0.00e+00 a 0 0 0 0 0 694 2.304 31.580 1.895 1 T 1.995e+03 0.00e+00 a 0 0 0 0 0 695 1.781 31.552 2.026 1 T 2.106e+03 0.00e+00 a 0 0 0 0 0 696 4.212 65.499 1.898 1 T 2.951e+03 0.00e+00 a 0 0 0 0 0 697 1.895 27.787 2.029 1 T 6.766e+03 0.00e+00 a 0 0 0 0 0 698 1.895 27.787 1.786 1 T 2.485e+03 0.00e+00 a 0 0 0 0 0 699 2.022 27.785 1.901 1 T 3.004e+03 0.00e+00 a 0 0 0 0 0 700 2.024 27.785 1.783 1 T 1.813e+03 0.00e+00 a 0 0 0 0 0 701 3.726 50.607 2.026 1 T 1.743e+03 0.00e+00 a 0 0 0 0 0 702 3.670 50.607 2.026 1 T 1.718e+03 0.00e+00 a 0 0 0 0 0 703 3.671 50.607 1.895 1 T 1.846e+03 0.00e+00 a 0 0 0 0 0 704 3.670 50.607 1.783 1 T 6.709e+02 0.00e+00 a 0 0 0 0 0 705 3.726 50.607 1.786 1 T 4.228e+02 0.00e+00 a 0 0 0 0 0 706 3.723 50.607 1.895 1 T 1.781e+03 0.00e+00 a 0 0 0 0 0 708 4.422 59.905 2.002 1 T 4.767e+03 0.00e+00 a 0 0 0 0 0 709 4.421 60.075 0.646 1 T 4.237e+03 0.00e+00 a 0 0 0 0 0 710 4.303 57.005 9.042 1 T 5.163e+03 0.00e+00 a 0 0 0 0 0 711 4.305 57.027 1.562 1 T 6.815e+03 0.00e+00 a 0 0 0 0 0 712 1.185 25.621 4.312 1 T 1.195e+03 0.00e+00 a 0 279 277 272 0 713 1.562 33.211 9.041 1 T 1.218e+03 0.00e+00 a 0 0 0 0 0 714 1.563 33.388 8.344 1 T 3.017e+03 0.00e+00 a 0 276 273 270 0 715 1.184 25.770 2.856 1 T 1.546e+03 0.00e+00 a 0 0 0 0 0 716 1.299 25.636 4.307 1 T 1.403e+03 0.00e+00 a 0 278 277 272 0 717 1.297 25.636 2.860 1 T 1.242e+03 0.00e+00 a 0 0 0 0 0 719 1.466 29.099 4.312 1 T 8.091e+02 0.00e+00 a 0 282 281 272 0 720 1.463 28.971 8.716 1 T 5.881e+02 0.00e+00 a 0 0 0 0 0 721 2.857 42.062 8.346 1 T 8.695e+02 0.00e+00 a 0 0 0 0 0 722 2.856 41.976 7.454 1 T 1.401e+03 0.00e+00 a 0 0 0 0 0 723 4.302 56.911 8.349 1 T 3.135e+03 0.00e+00 a 0 272 271 270 0 724 2.076 35.364 4.458 1 T 6.283e+03 0.00e+00 a 0 256 255 254 0 725 2.078 35.548 7.245 1 T 1.231e+03 0.00e+00 a 0 0 0 0 0 726 2.076 35.379 8.347 1 T 5.863e+03 0.00e+00 a 0 256 255 270 0 727 0.764 21.583 4.460 1 T 6.779e+03 0.00e+00 a 0 257 259 254 0 728 0.684 18.658 4.454 1 T 5.439e+03 0.00e+00 a 0 258 263 254 0 729 0.765 21.541 2.085 1 T 8.225e+03 0.00e+00 a 0 0 0 0 0 730 0.684 18.593 2.078 1 T 9.677e+03 0.00e+00 a 0 0 0 0 0 731 2.076 35.368 0.763 1 T 7.028e+03 0.00e+00 a 0 0 0 0 0 732 2.074 35.368 0.680 1 T 8.821e+03 0.00e+00 a 0 0 0 0 0 733 2.074 35.237 1.537 1 T 1.468e+03 0.00e+00 a 0 0 0 0 0 735 0.682 18.644 1.535 1 T 2.435e+03 0.00e+00 a 0 0 0 0 0 736 0.685 18.572 2.977 1 T 9.624e+02 0.00e+00 a 0 0 0 0 0 737 0.764 21.594 7.267 1 T 1.869e+03 0.00e+00 a 0 0 0 0 0 738 0.684 18.612 7.255 1 T 5.682e+03 0.00e+00 a 0 0 0 0 0 739 0.684 18.595 8.354 1 T 3.214e+03 0.00e+00 a 0 0 0 0 0 740 0.765 21.612 8.354 1 T 2.569e+03 0.00e+00 a 0 0 0 0 0 741 2.006 28.999 8.711 1 T 1.919e+03 0.00e+00 a 0 0 0 0 0 743 2.009 29.075 0.699 1 T 7.565e+02 0.00e+00 a 0 0 0 0 0 744 1.797 29.069 0.688 1 T 9.439e+02 0.00e+00 a 0 0 0 0 0 745 2.003 28.994 4.478 1 T 1.484e+03 0.00e+00 a 0 0 0 0 0 746 1.792 28.972 4.468 1 T 1.592e+03 0.00e+00 a 0 0 0 0 0 747 1.794 28.972 7.268 1 T 7.464e+02 0.00e+00 a 0 0 0 0 0 748 2.003 29.031 7.257 1 T 5.055e+02 0.00e+00 a 0 0 0 0 0 749 4.469 56.195 7.260 1 T 5.719e+03 0.00e+00 a 0 0 0 0 0 758 4.296 55.067 8.702 1 T 1.590e+04 0.00e+00 a 0 0 0 0 0 759 1.577 34.435 0.741 1 T 2.257e+03 0.00e+00 a 0 0 0 0 0 760 0.728 21.447 8.719 1 T 7.160e+02 0.00e+00 a 0 0 0 0 0 761 1.536 29.047 8.706 1 T 7.115e+02 0.00e+00 a 0 0 0 0 0 762 4.090 64.428 2.127 1 T 4.710e+03 0.00e+00 a 0 0 0 0 0 763 4.093 64.454 1.769 1 T 2.565e+03 0.00e+00 a 0 0 0 0 0 764 4.092 64.455 8.209 1 T 8.399e+03 0.00e+00 a 0 0 0 0 0 765 4.092 64.375 3.340 1 T 1.292e+03 0.00e+00 a 0 0 0 0 0 766 1.763 31.901 2.131 1 T 3.224e+03 0.00e+00 a 0 0 0 0 0 768 4.001 51.426 1.766 1 T 5.542e+02 0.00e+00 a 0 0 0 0 0 769 4.001 51.426 2.130 1 T 7.486e+02 0.00e+00 a 0 0 0 0 0 770 3.330 51.492 2.046 1 T 1.348e+03 0.00e+00 a 0 0 0 0 0 771 3.332 51.426 1.762 1 T 4.550e+02 0.00e+00 a 0 0 0 0 0 772 2.045 27.620 4.001 1 T 1.820e+03 0.00e+00 a 0 0 0 0 0 773 2.043 27.620 4.087 1 T 1.061e+03 0.00e+00 a 0 182 181 176 0 774 1.852 27.620 4.084 1 T 7.647e+02 0.00e+00 a 0 183 181 176 0 775 2.133 31.949 3.998 1 T 9.368e+02 0.00e+00 a 0 0 0 0 0 776 1.763 31.901 4.003 1 T 8.638e+02 0.00e+00 a 0 0 0 0 0 777 1.764 31.901 4.092 1 T 5.920e+02 0.00e+00 a 0 178 177 176 0 778 1.763 32.141 2.591 1 T 7.817e+02 0.00e+00 a 0 0 0 0 0 779 2.131 31.949 1.763 1 T 3.676e+03 0.00e+00 a 0 0 0 0 0 780 4.091 64.454 1.860 1 T 1.782e+03 0.00e+00 a 0 0 0 0 0 781 4.156 57.308 8.843 1 T 1.030e+03 0.00e+00 a 0 0 0 0 0 782 4.163 57.008 7.368 1 T 4.087e+03 0.00e+00 a 0 0 0 0 0 783 4.161 57.236 3.893 1 T 8.032e+03 0.00e+00 a 0 0 0 0 0 784 4.157 57.192 4.752 1 T 8.607e+02 0.00e+00 a 0 0 0 0 0 785 4.164 56.972 0.822 1 T 9.614e+03 0.00e+00 a 0 0 0 0 0 786 2.881 39.247 4.767 1 T 9.616e+02 0.00e+00 a 0 0 0 0 0 787 2.826 39.174 4.768 1 T 9.497e+02 0.00e+00 a 0 0 0 0 0 788 3.791 58.675 1.228 1 T 9.294e+02 0.00e+00 a 0 0 0 0 0 789 3.792 58.702 0.537 1 T 8.515e+02 0.00e+00 a 0 0 0 0 0 790 3.791 58.495 0.778 1 T 1.564e+03 0.00e+00 a 0 0 0 0 0 791 3.793 58.600 1.459 1 T 6.690e+03 0.00e+00 a 0 0 0 0 0 792 3.792 58.396 2.079 1 T 7.071e+02 0.00e+00 a 0 0 0 0 0 793 3.789 58.719 2.832 1 T 6.573e+02 0.00e+00 a 0 0 0 0 0 795 3.792 58.542 4.079 1 T 9.936e+02 0.00e+00 a 0 0 0 0 0 796 1.395 29.273 8.442 1 T 4.376e+02 0.00e+00 a 0 0 0 0 0 797 1.461 29.273 8.444 1 T 5.178e+02 0.00e+00 a 0 0 0 0 0 801 1.466 29.234 2.323 1 T 7.068e+02 0.00e+00 a 0 0 0 0 0 802 3.793 58.600 1.391 1 T 4.753e+03 0.00e+00 a 0 0 0 0 0 803 3.384 28.247 4.355 1 T 1.479e+03 0.00e+00 a 0 58 57 0 0 804 3.252 28.247 4.359 1 T 1.151e+03 0.00e+00 a 0 59 57 0 0 805 3.384 28.317 7.252 1 T 6.316e+02 0.00e+00 a 0 0 0 0 0 806 3.255 28.297 7.257 1 T 6.568e+02 0.00e+00 a 0 0 0 0 0 807 3.385 28.439 7.629 1 T 7.289e+02 0.00e+00 a 0 0 0 0 0 808 3.253 28.424 7.647 1 T 6.959e+02 0.00e+00 a 0 0 0 0 0 809 4.349 60.088 8.030 1 T 6.411e+02 0.00e+00 a 0 0 0 0 0 810 4.350 60.088 3.378 1 T 1.500e+03 0.00e+00 a 0 56 55 0 0 811 4.347 60.088 3.252 1 T 6.081e+02 0.00e+00 a 0 0 0 0 0 812 4.353 60.201 2.520 1 T 1.032e+03 0.00e+00 a 0 0 0 0 0 813 4.348 60.284 1.828 1 T 6.353e+02 0.00e+00 a 0 0 0 0 0 816 2.789 38.423 8.143 1 T 1.101e+03 0.00e+00 a 0 0 0 0 0 817 2.935 38.423 7.693 1 T 5.784e+02 0.00e+00 a 0 0 0 0 0 818 2.790 38.423 7.689 1 T 5.599e+02 0.00e+00 a 0 0 0 0 0 821 1.463 42.014 4.383 1 T 6.494e+02 0.00e+00 a 0 0 0 0 0 822 2.072 42.024 4.382 1 T 5.321e+02 0.00e+00 a 0 0 0 0 0 823 2.071 42.014 1.472 1 T 1.314e+03 0.00e+00 a 0 97 96 98 0 824 2.072 41.868 0.760 1 T 1.142e+03 0.00e+00 a 0 0 0 0 0 825 0.760 25.016 4.391 1 T 2.236e+03 0.00e+00 a 0 0 0 0 0 826 0.761 24.999 8.453 1 T 2.070e+03 0.00e+00 a 0 0 0 0 0 827 0.764 25.209 7.843 1 T 6.675e+02 0.00e+00 a 0 0 0 0 0 828 0.763 24.987 6.862 1 T 7.232e+02 0.00e+00 a 0 0 0 0 0 829 0.765 25.098 9.016 1 T 6.389e+02 0.00e+00 a 0 0 0 0 0 831 0.763 25.017 2.798 1 T 6.760e+02 0.00e+00 a 0 0 0 0 0 833 0.617 23.055 4.394 1 T 7.297e+03 0.00e+00 a 0 384 386 377 0 834 0.618 23.120 2.077 1 T 2.027e+03 0.00e+00 a 0 0 0 0 0 835 0.613 23.049 1.646 1 T 1.162e+04 0.00e+00 a 0 0 0 0 0 836 0.616 22.936 0.760 1 T 1.038e+04 0.00e+00 a 0 0 0 0 0 837 0.616 23.019 2.844 1 T 1.538e+03 0.00e+00 a 0 0 0 0 0 838 0.617 23.006 2.321 1 T 1.014e+03 0.00e+00 a 0 0 0 0 0 839 0.613 23.049 1.369 1 T 4.333e+03 0.00e+00 a 0 0 0 0 0 840 0.614 23.055 8.451 1 T 3.441e+03 0.00e+00 a 0 0 0 0 0 841 0.617 22.936 9.020 1 T 1.179e+03 0.00e+00 a 0 0 0 0 0 842 0.619 23.002 7.877 1 T 5.451e+02 0.00e+00 a 0 0 0 0 0 843 0.617 22.936 7.336 1 T 6.108e+02 0.00e+00 a 0 0 0 0 0 844 0.761 25.016 1.598 1 T 1.239e+04 0.00e+00 a 0 0 0 0 0 845 0.761 24.999 1.365 1 T 4.766e+03 0.00e+00 a 0 385 390 380 0 846 1.651 26.988 4.388 1 T 1.291e+03 0.00e+00 a 0 383 382 377 0 847 1.650 26.911 0.762 1 T 2.505e+03 0.00e+00 a 0 0 0 0 0 848 1.648 26.911 0.612 1 T 3.496e+03 0.00e+00 a 0 0 0 0 0 849 1.649 26.915 1.359 1 T 1.025e+03 0.00e+00 a 0 0 0 0 0 850 1.649 26.939 8.435 1 T 2.592e+03 0.00e+00 a 0 0 0 0 0 851 4.394 55.111 9.009 1 T 6.812e+02 0.00e+00 a 0 0 0 0 0 852 4.387 55.116 8.444 1 T 2.546e+03 0.00e+00 a 0 0 0 0 0 853 4.391 55.100 2.069 1 T 7.091e+02 0.00e+00 a 0 0 0 0 0 854 4.389 55.096 0.765 1 T 8.841e+02 0.00e+00 a 0 0 0 0 0 855 4.386 55.100 0.623 1 T 3.382e+03 0.00e+00 a 0 0 0 0 0 856 4.388 55.116 1.600 1 T 1.763e+03 0.00e+00 a 0 0 0 0 0 857 4.388 55.100 1.360 1 T 1.232e+03 0.00e+00 a 0 377 376 380 0 858 3.669 46.238 0.514 1 T 9.851e+02 0.00e+00 a 0 0 0 0 0 859 3.669 46.283 1.410 1 T 7.891e+02 0.00e+00 a 0 0 0 0 0 860 3.669 46.389 7.600 1 T 1.820e+03 0.00e+00 a 0 0 0 0 0 861 3.334 62.005 1.268 1 T 2.573e+03 0.00e+00 a 0 0 0 0 0 862 3.336 62.169 3.018 1 T 7.631e+02 0.00e+00 a 0 0 0 0 0 863 3.333 62.179 2.496 1 T 9.585e+02 0.00e+00 a 0 0 0 0 0 864 3.335 62.133 2.228 1 T 5.873e+02 0.00e+00 a 0 0 0 0 0 865 3.333 62.096 1.838 1 T 6.936e+02 0.00e+00 a 0 0 0 0 0 866 3.335 62.211 1.483 1 T 1.088e+03 0.00e+00 a 0 0 0 0 0 867 3.336 62.075 8.201 1 T 5.718e+02 0.00e+00 a 0 0 0 0 0 868 2.513 39.616 1.863 1 T 1.051e+03 0.00e+00 a 0 0 0 0 0 869 2.510 39.780 1.427 1 T 5.835e+02 0.00e+00 a 0 0 0 0 0 870 2.511 39.594 1.250 1 T 5.250e+02 0.00e+00 a 0 0 0 0 0 871 3.339 61.850 0.077 1 T 4.050e+02 0.00e+00 a 0 0 0 0 0 872 3.594 45.174 8.771 1 T 1.864e+03 0.00e+00 a 0 0 0 0 0 873 3.823 45.220 8.767 1 T 1.733e+03 0.00e+00 a 0 0 0 0 0 874 3.824 44.887 7.589 1 T 8.468e+02 0.00e+00 a 0 0 0 0 0 875 3.591 44.880 7.589 1 T 8.309e+02 0.00e+00 a 0 0 0 0 0 876 3.592 45.160 7.083 1 T 6.655e+02 0.00e+00 a 0 0 0 0 0 877 3.823 45.160 7.088 1 T 6.522e+02 0.00e+00 a 0 0 0 0 0 878 3.936 58.751 3.334 1 T 3.336e+03 0.00e+00 a 0 0 0 0 0 879 1.603 37.323 7.555 1 T 2.468e+03 0.00e+00 a 0 157 156 153 0 880 3.936 58.758 7.553 1 T 1.151e+03 0.00e+00 a 0 155 154 153 0 882 1.603 37.213 8.765 1 T 5.576e+02 0.00e+00 a 0 0 0 0 0 883 0.508 12.691 7.553 1 T 2.098e+03 0.00e+00 a 0 167 168 153 0 886 -0.128 15.474 7.551 1 T 1.325e+03 0.00e+00 a 0 0 0 0 0 887 -0.127 15.463 6.777 1 T 9.295e+02 0.00e+00 a 0 0 0 0 0 888 -0.130 15.343 7.044 1 T 8.177e+02 0.00e+00 a 0 0 0 0 0 889 -0.127 15.457 3.333 1 T 1.671e+03 0.00e+00 a 0 0 0 0 0 890 -0.130 15.270 4.705 1 T 6.946e+02 0.00e+00 a 0 0 0 0 0 891 -0.127 15.471 1.595 1 T 2.315e+03 0.00e+00 a 0 0 0 0 0 892 -0.127 15.180 1.785 1 T 6.297e+02 0.00e+00 a 0 0 0 0 0 895 1.152 27.838 0.515 1 T 1.715e+03 0.00e+00 a 0 0 0 0 0 896 1.152 27.812 0.728 1 T 2.751e+03 0.00e+00 a 0 0 0 0 0 897 1.150 27.701 1.590 1 T 6.757e+02 0.00e+00 a 0 0 0 0 0 898 1.153 27.924 -0.153 1 T 8.868e+02 0.00e+00 a 0 0 0 0 0 899 0.508 12.681 1.161 1 T 4.098e+03 0.00e+00 a 0 0 0 0 0 900 0.510 12.761 1.611 1 T 2.538e+03 0.00e+00 a 0 0 0 0 0 901 0.509 12.789 1.399 1 T 1.214e+03 0.00e+00 a 0 0 0 0 0 903 0.505 12.691 1.870 1 T 6.188e+02 0.00e+00 a 0 0 0 0 0 904 0.507 12.691 0.731 1 T 3.529e+03 0.00e+00 a 0 0 0 0 0 905 0.508 12.748 -0.125 1 T 5.237e+03 0.00e+00 a 0 0 0 0 0 908 0.507 12.585 3.030 1 T 5.746e+02 0.00e+00 a 0 0 0 0 0 909 0.509 12.695 3.925 1 T 1.351e+03 0.00e+00 a 0 0 0 0 0 910 0.509 12.623 4.699 1 T 2.171e+03 0.00e+00 a 0 0 0 0 0 911 0.509 12.820 7.043 1 T 1.060e+03 0.00e+00 a 0 0 0 0 0 912 0.509 12.696 6.772 1 T 1.718e+03 0.00e+00 a 0 0 0 0 0 913 0.505 12.671 8.177 1 T 4.230e+02 0.00e+00 a 0 0 0 0 0 914 0.717 27.641 0.525 1 T 1.293e+03 0.00e+00 a 0 0 0 0 0 915 0.714 27.723 -0.159 1 T 6.216e+02 0.00e+00 a 0 0 0 0 0 916 0.713 27.799 1.589 1 T 5.343e+02 0.00e+00 a 0 0 0 0 0 917 0.715 27.723 3.027 1 T 4.384e+02 0.00e+00 a 0 0 0 0 0 919 1.148 27.796 4.707 1 T 5.217e+02 0.00e+00 a 0 0 0 0 0 920 0.718 27.709 3.958 1 T 6.469e+02 0.00e+00 a 0 165 163 0 0 921 1.154 27.790 7.557 1 T 9.281e+02 0.00e+00 a 0 0 0 0 0 922 0.717 27.790 7.567 1 T 5.937e+02 0.00e+00 a 0 0 0 0 0 923 1.602 37.332 1.167 1 T 1.137e+03 0.00e+00 a 0 0 0 0 0 924 1.599 37.213 0.720 1 T 1.328e+03 0.00e+00 a 0 0 0 0 0 925 1.601 37.232 0.518 1 T 1.712e+03 0.00e+00 a 0 157 156 0 0 926 1.606 37.330 0.013 1 T 7.147e+02 0.00e+00 a 0 0 0 0 0 927 3.937 58.679 -0.127 1 T 3.518e+03 0.00e+00 a 0 0 0 0 0 928 3.937 58.649 0.496 1 T 1.678e+03 0.00e+00 a 0 0 0 0 0 929 3.942 58.486 0.705 1 T 1.841e+03 0.00e+00 a 0 0 0 0 0 930 3.934 58.612 1.872 1 T 1.182e+03 0.00e+00 a 0 0 0 0 0 931 3.937 58.513 1.604 1 T 9.693e+02 0.00e+00 a 0 0 0 0 0 932 3.935 58.679 2.065 1 T 1.146e+03 0.00e+00 a 0 0 0 0 0 933 2.646 30.542 4.716 1 T 1.176e+03 0.00e+00 a 0 195 193 192 0 934 2.724 30.542 4.716 1 T 7.799e+02 0.00e+00 a 0 194 193 192 0 935 2.723 30.542 4.030 1 T 8.105e+02 0.00e+00 a 0 0 0 0 0 936 2.648 30.542 4.035 1 T 6.291e+02 0.00e+00 a 0 0 0 0 0 937 2.724 30.680 8.300 1 T 5.047e+02 0.00e+00 a 0 0 0 0 0 938 2.651 30.639 8.286 1 T 6.510e+02 0.00e+00 a 0 0 0 0 0 939 2.726 30.519 0.061 1 T 1.895e+03 0.00e+00 a 0 0 0 0 0 940 2.647 30.542 0.055 1 T 9.578e+02 0.00e+00 a 0 0 0 0 0 941 4.292 55.013 1.567 1 T 1.085e+04 0.00e+00 a 0 0 0 0 0 944 4.297 55.077 8.354 1 T 2.036e+03 0.00e+00 a 0 0 0 0 0 945 1.573 35.121 4.298 1 T 7.130e+02 0.00e+00 a 0 0 0 0 0 946 4.290 55.077 2.044 1 T 2.421e+03 0.00e+00 a 0 0 0 0 0 947 4.291 55.077 0.729 1 T 1.049e+03 0.00e+00 a 0 0 0 0 0 948 4.292 55.015 1.307 1 T 3.090e+03 0.00e+00 a 0 0 0 0 0 949 1.571 34.547 8.678 1 T 1.665e+03 0.00e+00 a 0 0 0 0 0 950 1.571 34.254 8.670 1 T 1.128e+03 0.00e+00 a 0 0 0 0 0 951 1.572 35.121 8.703 1 T 7.152e+02 0.00e+00 a 0 0 0 0 0 953 1.569 34.358 1.738 1 T 4.323e+03 0.00e+00 a 0 0 0 0 0 954 2.007 29.001 4.292 1 T 6.749e+02 0.00e+00 a 0 0 0 0 0 955 1.794 29.001 4.292 1 T 4.932e+02 0.00e+00 a 0 0 0 0 0 956 1.802 29.049 8.273 1 T 1.128e+03 0.00e+00 a 0 686 684 0 0 957 1.801 29.079 8.034 1 T 4.556e+02 0.00e+00 a 0 0 0 0 0 958 2.005 29.058 8.347 1 T 4.449e+02 0.00e+00 a 0 0 0 0 0 959 2.007 29.095 2.338 1 T 1.929e+03 0.00e+00 a 0 0 0 0 0 960 1.798 29.095 2.341 1 T 5.278e+03 0.00e+00 a 0 0 0 0 0 961 4.469 56.208 8.707 1 T 6.551e+02 0.00e+00 a 0 0 0 0 0 962 4.469 56.206 2.331 1 T 8.916e+02 0.00e+00 a 0 0 0 0 0 963 4.467 56.206 2.007 1 T 1.307e+03 0.00e+00 a 0 0 0 0 0 964 4.469 56.206 1.799 1 T 1.671e+03 0.00e+00 a 0 0 0 0 0 966 2.339 34.777 7.857 1 T 1.418e+03 0.00e+00 a 0 0 0 0 0 967 2.338 34.777 6.846 1 T 6.292e+02 0.00e+00 a 0 242 240 247 0 969 2.123 34.712 8.708 1 T 7.793e+02 0.00e+00 a 0 0 0 0 0 972 2.122 34.676 6.862 1 T 6.827e+02 0.00e+00 a 0 0 0 0 0 973 2.337 34.819 4.466 1 T 1.017e+03 0.00e+00 a 0 0 0 0 0 981 2.121 34.790 4.476 1 T 5.288e+02 0.00e+00 a 0 0 0 0 0 982 2.121 34.751 7.857 1 T 7.539e+02 0.00e+00 a 0 241 240 248 0 983 4.468 56.206 2.112 1 T 9.904e+02 0.00e+00 a 0 0 0 0 0 984 2.339 34.777 1.806 1 T 1.118e+03 0.00e+00 a 0 0 0 0 0 985 2.124 34.777 1.802 1 T 1.423e+03 0.00e+00 a 0 0 0 0 0 986 2.122 34.766 2.342 1 T 8.505e+03 0.00e+00 a 0 0 0 0 0 987 2.339 34.777 2.125 1 T 8.032e+03 0.00e+00 a 0 0 0 0 0 988 2.008 29.095 1.801 1 T 8.352e+03 0.00e+00 a 0 0 0 0 0 989 1.797 29.095 2.006 1 T 7.067e+03 0.00e+00 a 0 0 0 0 0 990 4.460 59.095 0.678 1 T 1.935e+03 0.00e+00 a 0 0 0 0 0 994 1.563 33.605 4.427 1 T 8.243e+02 0.00e+00 a 0 0 0 0 0 995 4.304 56.984 0.615 1 T 3.573e+03 0.00e+00 a 0 0 0 0 0 996 4.304 56.729 0.806 1 T 1.434e+03 0.00e+00 a 0 0 0 0 0 997 4.303 56.732 1.277 1 T 1.626e+03 0.00e+00 a 0 0 0 0 0 998 4.303 56.732 1.565 1 T 5.334e+03 0.00e+00 a 0 0 0 0 0 1000 1.183 25.593 1.560 1 T 4.645e+03 0.00e+00 a 0 0 0 0 0 1001 1.298 25.593 1.560 1 T 6.530e+03 0.00e+00 a 0 0 0 0 0 1002 1.183 25.593 1.467 1 T 9.924e+02 0.00e+00 a 0 0 0 0 0 1003 1.299 25.593 1.470 1 T 2.769e+03 0.00e+00 a 0 0 0 0 0 1004 1.292 25.532 0.654 1 T 8.742e+02 0.00e+00 a 0 0 0 0 0 1005 1.183 25.893 0.579 1 T 1.430e+03 0.00e+00 a 0 0 0 0 0 1007 1.469 28.903 2.831 1 T 1.241e+03 0.00e+00 a 0 0 0 0 0 1008 2.854 41.995 4.312 1 T 1.016e+03 0.00e+00 a 0 288 285 272 0 1009 1.954 40.092 3.671 1 T 1.160e+03 0.00e+00 a 0 301 299 0 0 1010 1.427 40.092 3.671 1 T 1.697e+03 0.00e+00 a 0 300 299 0 0 1011 1.955 40.092 1.426 1 T 1.539e+03 0.00e+00 a 0 0 0 0 0 1012 1.423 40.092 1.971 1 T 1.102e+03 0.00e+00 a 0 0 0 0 0 1013 1.422 40.092 4.461 1 T 6.490e+02 0.00e+00 a 0 0 0 0 0 1014 1.954 40.085 4.456 1 T 4.937e+02 0.00e+00 a 0 0 0 0 0 1015 1.960 40.266 7.274 1 T 6.504e+02 0.00e+00 a 0 0 0 0 0 1016 1.423 40.155 7.271 1 T 5.368e+02 0.00e+00 a 0 0 0 0 0 1017 1.425 39.995 9.011 1 T 5.316e+02 0.00e+00 a 0 0 0 0 0 1018 1.955 40.038 9.013 1 T 7.512e+02 0.00e+00 a 0 0 0 0 0 1019 1.956 40.092 0.827 1 T 2.739e+03 0.00e+00 a 0 0 0 0 0 1020 1.426 40.190 0.827 1 T 2.503e+03 0.00e+00 a 0 0 0 0 0 1021 0.825 25.816 4.427 1 T 2.633e+03 0.00e+00 a 0 0 0 0 0 1022 0.827 25.875 4.192 1 T 2.127e+03 0.00e+00 a 0 0 0 0 0 1023 0.827 25.498 3.713 1 T 8.613e+02 0.00e+00 a 0 0 0 0 0 1024 0.827 25.816 3.725 1 T 6.991e+02 0.00e+00 a 0 0 0 0 0 1025 0.827 25.852 3.150 1 T 1.207e+03 0.00e+00 a 0 0 0 0 0 1026 0.827 25.849 2.952 1 T 1.381e+03 0.00e+00 a 0 0 0 0 0 1029 0.824 25.816 1.971 1 T 3.472e+03 0.00e+00 a 0 305 307 301 0 1030 0.826 25.829 2.162 1 T 1.118e+03 0.00e+00 a 0 0 0 0 0 1031 0.826 25.816 1.532 1 T 4.177e+03 0.00e+00 a 0 0 0 0 0 1032 0.826 25.982 7.264 1 T 7.953e+02 0.00e+00 a 0 0 0 0 0 1033 0.827 25.677 6.536 1 T 5.059e+02 0.00e+00 a 0 0 0 0 0 1035 0.827 25.607 9.046 1 T 1.827e+03 0.00e+00 a 0 0 0 0 0 1036 1.536 27.397 0.821 1 T 5.511e+03 0.00e+00 a 0 0 0 0 0 1037 1.533 27.397 1.974 1 T 1.716e+03 0.00e+00 a 0 304 303 301 0 1038 1.537 27.397 3.725 1 T 6.544e+02 0.00e+00 a 0 0 0 0 0 1039 1.539 27.348 9.027 1 T 1.917e+03 0.00e+00 a 0 0 0 0 0 1040 1.538 27.269 8.356 1 T 1.165e+03 0.00e+00 a 0 0 0 0 0 1042 0.822 22.274 9.033 1 T 1.290e+03 0.00e+00 a 0 0 0 0 0 1043 0.824 22.443 8.362 1 T 7.902e+02 0.00e+00 a 0 0 0 0 0 1044 0.822 22.499 7.300 1 T 7.329e+02 0.00e+00 a 0 0 0 0 0 1045 0.823 22.332 4.427 1 T 6.715e+03 0.00e+00 a 0 0 0 0 0 1046 0.822 22.370 4.173 1 T 1.187e+03 0.00e+00 a 0 0 0 0 0 1047 0.824 22.332 3.727 1 T 4.075e+03 0.00e+00 a 0 0 0 0 0 1048 0.824 22.340 2.961 1 T 1.538e+03 0.00e+00 a 0 0 0 0 0 1049 0.824 22.149 3.208 1 T 9.306e+02 0.00e+00 a 0 0 0 0 0 1050 0.822 22.332 1.962 1 T 2.023e+03 0.00e+00 a 0 306 311 301 0 1051 0.821 22.292 1.532 1 T 4.426e+03 0.00e+00 a 0 0 0 0 0 1052 0.823 22.332 1.423 1 T 2.230e+03 0.00e+00 a 0 0 0 0 0 1053 0.827 25.816 1.423 1 T 2.621e+03 0.00e+00 a 0 0 0 0 0 1054 1.954 40.092 1.532 1 T 7.579e+02 0.00e+00 a 0 0 0 0 0 1055 1.424 40.092 1.532 1 T 4.678e+02 0.00e+00 a 0 0 0 0 0 1056 1.954 40.092 3.731 1 T 8.720e+02 0.00e+00 a 0 0 0 0 0 1057 1.425 40.092 3.727 1 T 1.240e+03 0.00e+00 a 0 0 0 0 0 1058 1.537 27.397 3.673 1 T 5.300e+02 0.00e+00 a 0 0 0 0 0 1059 0.827 25.816 3.673 1 T 6.085e+02 0.00e+00 a 0 0 0 0 0 1060 0.822 22.332 3.673 1 T 3.381e+03 0.00e+00 a 0 0 0 0 0 1061 4.425 53.557 0.823 1 T 4.911e+03 0.00e+00 a 0 0 0 0 0 1062 4.424 53.577 1.978 1 T 1.667e+03 0.00e+00 a 0 298 297 301 0 1063 4.425 53.461 9.037 1 T 6.977e+02 0.00e+00 a 0 0 0 0 0 1064 4.425 53.561 3.673 1 T 2.702e+03 0.00e+00 a 0 0 0 0 0 1065 4.426 53.561 3.734 1 T 4.126e+03 0.00e+00 a 0 0 0 0 0 1066 4.426 53.561 1.422 1 T 9.761e+02 0.00e+00 a 0 0 0 0 0 1067 4.426 53.561 1.535 1 T 9.244e+02 0.00e+00 a 0 0 0 0 0 1068 3.724 50.607 1.422 1 T 1.366e+03 0.00e+00 a 0 0 0 0 0 1069 3.671 50.607 1.417 1 T 8.924e+02 0.00e+00 a 0 0 0 0 0 1070 3.724 50.607 1.962 1 T 2.570e+03 0.00e+00 a 0 0 0 0 0 1071 3.671 50.607 1.962 1 T 2.259e+03 0.00e+00 a 0 0 0 0 0 1072 2.151 33.790 0.806 1 T 6.204e+02 0.00e+00 a 0 0 0 0 0 1073 4.387 55.116 8.349 1 T 2.686e+03 0.00e+00 a 0 0 0 0 0 1076 1.363 42.566 1.648 1 T 5.727e+03 0.00e+00 a 0 0 0 0 0 1077 1.647 26.915 1.602 1 T 1.040e+04 0.00e+00 a 0 383 382 0 0 1078 4.388 55.116 1.645 1 T 2.398e+03 0.00e+00 a 0 0 0 0 0 1081 1.599 42.566 0.763 1 T 1.289e+03 0.00e+00 a 0 0 0 0 0 1082 0.761 24.999 8.359 1 T 1.434e+03 0.00e+00 a 0 0 0 0 0 1083 0.613 23.049 8.355 1 T 3.165e+03 0.00e+00 a 0 0 0 0 0 1085 0.612 23.049 1.597 1 T 1.052e+04 0.00e+00 a 0 0 0 0 0 1088 0.704 22.862 8.138 1 T 5.305e+02 0.00e+00 a 0 0 0 0 0 1092 0.763 24.989 1.812 1 T 1.212e+03 0.00e+00 a 0 0 0 0 0 1093 0.761 25.045 2.341 1 T 5.033e+02 0.00e+00 a 0 0 0 0 0 1095 2.071 41.868 0.704 1 T 7.581e+02 0.00e+00 a 0 0 0 0 0 1096 1.462 41.919 0.707 1 T 2.116e+03 0.00e+00 a 0 0 0 0 0 1108 2.559 36.011 3.988 1 T 7.663e+02 0.00e+00 a 0 0 0 0 0 1109 2.094 35.990 3.991 1 T 6.745e+02 0.00e+00 a 0 0 0 0 0 1110 2.557 36.099 2.099 1 T 2.795e+03 0.00e+00 a 0 442 441 443 0 1111 4.005 54.501 2.554 1 T 1.118e+03 0.00e+00 a 0 0 0 0 0 1112 4.006 54.628 3.034 1 T 4.484e+03 0.00e+00 a 0 0 0 0 0 1113 4.006 54.595 2.097 1 T 1.076e+03 0.00e+00 a 0 0 0 0 0 1114 2.554 36.023 1.746 1 T 1.054e+03 0.00e+00 a 0 0 0 0 0 1115 4.006 54.595 1.746 1 T 9.576e+02 0.00e+00 a 0 0 0 0 0 1116 2.092 36.014 1.741 1 T 6.732e+02 0.00e+00 a 0 0 0 0 0 1117 4.005 54.562 1.252 1 T 7.866e+02 0.00e+00 a 0 0 0 0 0 1118 4.006 54.585 1.906 1 T 1.321e+03 0.00e+00 a 0 0 0 0 0 1119 2.094 36.014 1.461 1 T 5.008e+02 0.00e+00 a 0 0 0 0 0 1120 4.006 54.595 1.470 1 T 5.013e+02 0.00e+00 a 0 0 0 0 0 1121 4.009 54.511 8.680 1 T 1.338e+03 0.00e+00 a 0 436 435 0 0 1122 1.748 29.530 8.705 1 T 2.173e+03 0.00e+00 a 0 0 0 0 0 1123 1.745 29.712 3.994 1 T 6.355e+02 0.00e+00 a 0 0 0 0 0 1124 1.746 29.610 3.016 1 T 7.839e+02 0.00e+00 a 0 0 0 0 0 1125 1.747 29.530 2.554 1 T 8.582e+02 0.00e+00 a 0 438 437 0 0 1126 2.560 41.273 4.611 1 T 1.296e+03 0.00e+00 a 0 478 476 0 0 1128 2.559 41.245 2.910 1 T 3.420e+03 0.00e+00 a 0 0 0 0 0 1129 2.911 41.268 2.558 1 T 3.105e+03 0.00e+00 a 0 0 0 0 0 1130 2.911 41.270 1.844 1 T 1.909e+03 0.00e+00 a 0 0 0 0 0 1131 2.561 41.188 1.841 1 T 1.882e+03 0.00e+00 a 0 0 0 0 0 1132 2.910 41.494 1.429 1 T 4.977e+02 0.00e+00 a 0 0 0 0 0 1133 2.561 41.245 1.431 1 T 5.705e+02 0.00e+00 a 0 0 0 0 0 1134 2.562 41.543 8.357 1 T 1.152e+03 0.00e+00 a 0 0 0 0 0 1135 2.910 41.270 8.300 1 T 1.229e+03 0.00e+00 a 0 0 0 0 0 1136 2.911 41.268 8.683 1 T 6.448e+02 0.00e+00 a 0 0 0 0 0 1137 2.562 41.245 8.301 1 T 1.022e+03 0.00e+00 a 0 0 0 0 0 1138 2.561 41.245 8.694 1 T 4.986e+02 0.00e+00 a 0 0 0 0 0 1139 2.911 41.270 8.414 1 T 1.060e+03 0.00e+00 a 0 0 0 0 0 1140 2.561 41.245 8.411 1 T 9.052e+02 0.00e+00 a 0 0 0 0 0 1141 1.950 35.850 8.887 1 T 5.739e+02 0.00e+00 a 0 522 521 0 0 1142 1.649 35.850 8.887 1 T 6.591e+02 0.00e+00 a 0 523 521 0 0 1143 1.653 35.754 4.562 1 T 6.634e+02 0.00e+00 a 0 0 0 0 0 1144 1.945 35.910 4.547 1 T 8.184e+02 0.00e+00 a 0 0 0 0 0 1145 4.571 54.726 8.903 1 T 5.343e+02 0.00e+00 a 0 520 519 0 0 1146 1.651 35.861 1.940 1 T 5.185e+03 0.00e+00 a 0 0 0 0 0 1147 1.946 35.864 1.658 1 T 4.771e+03 0.00e+00 a 0 0 0 0 0 1148 1.946 35.888 1.277 1 T 1.324e+03 0.00e+00 a 0 0 0 0 0 1149 1.652 35.853 1.264 1 T 1.190e+03 0.00e+00 a 0 0 0 0 0 1153 1.571 28.970 4.547 1 T 1.300e+03 0.00e+00 a 0 0 0 0 0 1157 1.262 24.831 3.734 1 T 5.197e+02 0.00e+00 a 0 0 0 0 0 1159 2.886 42.067 1.584 1 T 5.429e+03 0.00e+00 a 0 0 0 0 0 1163 2.886 42.051 1.268 1 T 1.672e+03 0.00e+00 a 0 718 715 0 0 1164 3.631 60.063 2.524 1 T 5.427e+03 0.00e+00 a 0 546 545 0 0 1165 3.631 60.158 1.922 1 T 2.828e+03 0.00e+00 a 0 0 0 0 0 1166 3.632 60.158 1.783 1 T 1.871e+03 0.00e+00 a 0 0 0 0 0 1167 3.629 60.136 2.206 1 T 6.182e+02 0.00e+00 a 0 0 0 0 0 1168 3.630 59.925 3.158 1 T 9.534e+02 0.00e+00 a 0 0 0 0 0 1169 3.632 60.083 4.974 1 T 4.889e+02 0.00e+00 a 0 0 0 0 0 1170 3.632 60.325 4.564 1 T 5.602e+02 0.00e+00 a 0 0 0 0 0 1171 3.628 60.200 5.458 1 T 4.698e+02 0.00e+00 a 0 0 0 0 0 1173 3.631 60.094 8.891 1 T 2.658e+03 0.00e+00 a 0 0 0 0 0 1174 3.631 60.066 8.329 1 T 1.575e+03 0.00e+00 a 0 0 0 0 0 1175 3.631 59.985 7.330 1 T 9.100e+02 0.00e+00 a 0 0 0 0 0 1176 1.923 29.909 3.634 1 T 6.480e+02 0.00e+00 a 0 548 547 0 0 1177 1.783 29.885 3.637 1 T 7.467e+02 0.00e+00 a 0 549 547 0 0 1178 1.923 29.885 3.174 1 T 5.032e+02 0.00e+00 a 0 0 0 0 0 1179 1.783 29.885 3.174 1 T 6.319e+02 0.00e+00 a 0 0 0 0 0 1180 1.923 29.874 1.493 1 T 6.000e+02 0.00e+00 a 0 0 0 0 0 1182 1.910 29.530 2.549 1 T 9.149e+02 0.00e+00 a 0 439 437 442 0 1185 1.492 26.754 7.318 1 T 5.125e+02 0.00e+00 a 0 0 0 0 0 1186 1.488 26.694 8.112 1 T 4.774e+02 0.00e+00 a 0 0 0 0 0 1187 3.187 43.655 1.782 1 T 1.334e+03 0.00e+00 a 0 0 0 0 0 1188 3.188 43.655 1.948 1 T 9.621e+02 0.00e+00 a 0 0 0 0 0 1189 1.489 26.694 1.985 1 T 1.631e+03 0.00e+00 a 0 0 0 0 0 1191 2.673 39.452 4.287 1 T 2.235e+03 0.00e+00 a 0 575 574 573 0 1192 2.553 39.393 4.280 1 T 3.201e+03 0.00e+00 a 0 576 574 573 0 1193 4.285 55.578 2.562 1 T 5.410e+03 0.00e+00 a 0 0 0 0 0 1194 4.285 55.578 2.676 1 T 7.137e+03 0.00e+00 a 0 0 0 0 0 1197 4.284 55.508 7.349 1 T 2.259e+03 0.00e+00 a 0 573 572 0 0 1198 4.283 55.741 8.419 1 T 3.495e+03 0.00e+00 a 0 0 0 0 0 1200 2.676 39.469 7.322 1 T 8.683e+02 0.00e+00 a 0 0 0 0 0 1201 2.673 39.527 8.423 1 T 9.556e+02 0.00e+00 a 0 0 0 0 0 1202 2.553 39.467 8.432 1 T 1.230e+03 0.00e+00 a 0 0 0 0 0 1203 1.907 31.501 4.164 1 T 1.656e+03 0.00e+00 a 0 588 586 0 0 1204 2.205 31.501 4.164 1 T 6.999e+02 0.00e+00 a 0 587 586 0 0 1205 2.208 31.441 3.715 1 T 6.570e+02 0.00e+00 a 0 0 0 0 0 1206 1.907 31.501 1.450 1 T 6.015e+02 0.00e+00 a 0 0 0 0 0 1209 4.166 57.040 1.904 1 T 6.825e+03 0.00e+00 a 0 0 0 0 0 1210 4.166 57.040 2.207 1 T 2.885e+03 0.00e+00 a 0 585 584 0 0 1211 4.163 57.040 2.387 1 T 3.356e+03 0.00e+00 a 0 0 0 0 0 1213 2.205 31.659 2.979 1 T 5.373e+02 0.00e+00 a 0 0 0 0 0 1214 2.315 33.921 4.174 1 T 1.781e+03 0.00e+00 a 0 0 0 0 0 1216 2.348 28.972 4.593 1 T 1.460e+03 0.00e+00 a 0 685 684 683 0 1217 2.345 29.039 1.810 1 T 5.949e+03 0.00e+00 a 0 0 0 0 0 1218 2.347 28.997 8.278 1 T 9.888e+02 0.00e+00 a 0 685 684 0 0 1219 1.805 29.093 4.814 1 T 5.954e+02 0.00e+00 a 0 0 0 0 0 1220 2.509 35.297 1.824 1 T 2.831e+03 0.00e+00 a 0 0 0 0 0 1221 2.388 35.187 1.814 1 T 2.282e+03 0.00e+00 a 0 0 0 0 0 1222 2.508 35.126 4.603 1 T 1.215e+03 0.00e+00 a 0 689 688 0 0 1223 2.384 35.065 4.598 1 T 1.192e+03 0.00e+00 a 0 690 688 0 0 1224 2.507 35.047 7.728 1 T 8.269e+02 0.00e+00 a 0 0 0 0 0 1225 2.387 35.113 7.707 1 T 6.612e+02 0.00e+00 a 0 0 0 0 0 1226 2.389 35.299 8.267 1 T 1.480e+03 0.00e+00 a 0 0 0 0 0 1227 2.508 35.156 8.266 1 T 1.216e+03 0.00e+00 a 0 0 0 0 0 1228 4.246 63.178 8.435 1 T 5.878e+03 0.00e+00 a 0 0 0 0 0 1229 3.895 63.331 4.163 1 T 2.912e+03 0.00e+00 a 0 7 4 0 0 1230 3.898 63.299 0.753 1 T 9.824e+02 0.00e+00 a 0 0 0 0 0 1233 2.879 39.261 7.028 1 T 4.176e+02 0.00e+00 a 0 0 0 0 0 1234 2.826 39.269 7.027 1 T 5.539e+02 0.00e+00 a 0 0 0 0 0 1236 4.389 55.096 0.708 1 T 1.134e+03 0.00e+00 a 0 0 0 0 0 1240 0.792 26.723 2.067 1 T 1.194e+03 0.00e+00 a 0 0 0 0 0 1241 0.794 26.563 2.844 1 T 7.117e+02 0.00e+00 a 0 0 0 0 0 1242 0.794 26.653 4.113 1 T 7.592e+02 0.00e+00 a 0 0 0 0 0 1243 0.792 26.839 3.800 1 T 7.493e+02 0.00e+00 a 0 0 0 0 0 1244 0.793 26.708 3.532 1 T 9.394e+02 0.00e+00 a 0 0 0 0 0 1245 0.794 26.662 7.301 1 T 6.454e+02 0.00e+00 a 0 101 100 0 0 1246 1.257 28.640 3.026 1 T 1.949e+03 0.00e+00 a 0 991 989 0 0 1247 1.258 28.842 4.658 1 T 5.649e+02 0.00e+00 a 0 0 0 0 0 1248 1.261 28.755 8.415 1 T 5.600e+02 0.00e+00 a 0 0 0 0 0 1249 1.257 28.640 1.804 1 T 1.798e+03 0.00e+00 a 0 0 0 0 0 1250 1.484 28.600 3.066 1 T 1.886e+03 0.00e+00 a 0 990 989 0 0 1251 3.066 43.719 1.265 1 T 1.596e+03 0.00e+00 a 0 0 0 0 0 1252 3.031 43.741 1.271 1 T 1.302e+03 0.00e+00 a 0 0 0 0 0 1253 3.065 43.712 1.502 1 T 2.095e+03 0.00e+00 a 0 0 0 0 0 1254 3.030 43.712 1.502 1 T 2.072e+03 0.00e+00 a 0 0 0 0 0 1255 3.066 43.748 1.792 1 T 2.791e+03 0.00e+00 a 0 0 0 0 0 1256 3.032 43.748 1.789 1 T 2.552e+03 0.00e+00 a 0 0 0 0 0 1257 3.065 43.712 2.133 1 T 6.309e+02 0.00e+00 a 0 0 0 0 0 1258 3.029 43.712 2.140 1 T 4.590e+02 0.00e+00 a 0 0 0 0 0 1259 3.066 43.712 4.504 1 T 6.273e+02 0.00e+00 a 0 0 0 0 0 1260 3.030 43.712 4.507 1 T 5.657e+02 0.00e+00 a 0 0 0 0 0 1261 3.067 43.712 6.881 1 T 1.168e+03 0.00e+00 a 0 994 993 0 0 1262 3.031 43.712 6.879 1 T 1.109e+03 0.00e+00 a 0 995 993 0 0 1264 1.563 33.449 4.295 1 T 2.278e+03 0.00e+00 a 0 276 273 272 0 1265 1.561 33.449 0.638 1 T 6.730e+02 0.00e+00 a 0 0 0 0 0 1266 1.566 33.572 1.272 1 T 2.628e+03 0.00e+00 a 0 0 0 0 0 1267 1.566 33.639 2.839 1 T 4.496e+02 0.00e+00 a 0 0 0 0 0 1269 1.576 34.443 4.292 1 T 1.517e+03 0.00e+00 a 0 0 0 0 0 1270 1.575 34.456 5.222 1 T 6.984e+02 0.00e+00 a 0 0 0 0 0 1272 1.579 34.556 2.755 1 T 5.592e+02 0.00e+00 a 0 0 0 0 0 1273 1.576 34.380 8.343 1 T 1.209e+03 0.00e+00 a 0 213 210 207 0 1274 5.215 54.113 8.419 1 T 4.506e+03 0.00e+00 a 0 1011 1010 0 0 1275 5.215 54.104 7.794 1 T 2.312e+03 0.00e+00 a 0 0 0 0 0 1276 5.213 54.075 3.811 1 T 9.037e+02 0.00e+00 a 0 0 0 0 0 1277 5.216 54.060 4.740 1 T 2.212e+03 0.00e+00 a 0 0 0 0 0 1278 5.213 54.080 2.046 1 T 3.401e+03 0.00e+00 a 0 0 0 0 0 1279 5.214 54.113 1.580 1 T 1.977e+03 0.00e+00 a 0 0 0 0 0 1280 5.216 54.113 1.722 1 T 1.170e+03 0.00e+00 a 0 0 0 0 0 1281 1.719 34.335 5.235 1 T 5.029e+02 0.00e+00 a 0 0 0 0 0 1282 1.719 34.675 8.408 1 T 4.893e+02 0.00e+00 a 0 1013 1012 1009 0 1283 1.720 34.672 2.053 1 T 1.010e+03 0.00e+00 a 0 0 0 0 0 1284 1.578 34.672 2.046 1 T 1.098e+03 0.00e+00 a 0 0 0 0 0 1286 5.215 54.113 8.357 1 T 3.742e+03 0.00e+00 a 0 1011 1010 1025 0 1287 1.578 34.669 8.416 1 T 5.434e+02 0.00e+00 a 0 1014 1012 1009 0 1288 1.578 34.669 8.360 1 T 8.788e+02 0.00e+00 a 0 1014 1012 1025 0 1292 1.363 42.566 0.704 1 T 1.603e+03 0.00e+00 a 0 0 0 0 0 1293 1.597 42.570 0.707 1 T 1.364e+03 0.00e+00 a 0 0 0 0 0 1294 0.760 25.016 1.656 1 T 9.491e+03 0.00e+00 a 0 0 0 0 0 1295 0.760 25.268 2.070 1 T 1.258e+03 0.00e+00 a 0 0 0 0 0 1299 0.792 26.680 1.516 1 T 3.959e+03 0.00e+00 a 0 0 0 0 0 1300 0.792 26.668 4.408 1 T 5.093e+02 0.00e+00 a 0 0 0 0 0 1305 0.722 21.524 4.435 1 T 5.158e+03 0.00e+00 a 0 0 0 0 0 1306 0.722 21.476 3.809 1 T 7.467e+02 0.00e+00 a 0 0 0 0 0 1307 0.721 21.518 3.481 1 T 2.204e+03 0.00e+00 a 0 0 0 0 0 1309 0.648 19.490 4.441 1 T 2.893e+03 0.00e+00 a 0 0 0 0 0 1310 0.648 19.530 3.481 1 T 4.256e+03 0.00e+00 a 0 0 0 0 0 1311 0.647 19.482 1.987 1 T 6.514e+03 0.00e+00 a 0 969 971 0 0 1312 1.600 25.753 1.843 1 T 2.207e+03 0.00e+00 a 0 0 0 0 0 1313 1.421 25.779 1.822 1 T 2.958e+03 0.00e+00 a 0 0 0 0 0 1314 2.952 42.893 1.838 1 T 4.812e+03 0.00e+00 a 0 0 0 0 0 1316 2.951 42.898 4.376 1 T 4.939e+02 0.00e+00 a 0 0 0 0 0 1317 2.954 42.898 4.793 1 T 5.921e+02 0.00e+00 a 0 0 0 0 0 1318 2.953 42.837 7.390 1 T 6.719e+02 0.00e+00 a 0 0 0 0 0 1319 1.809 29.317 2.956 1 T 2.374e+03 0.00e+00 a 0 421 419 426 0 1320 1.808 29.516 1.450 1 T 3.294e+03 0.00e+00 a 0 0 0 0 0 1321 1.451 29.275 2.952 1 T 1.299e+03 0.00e+00 a 0 420 419 426 0 1322 2.555 35.938 8.673 1 T 5.186e+02 0.00e+00 a 0 0 0 0 0 1323 2.098 36.089 2.560 1 T 3.710e+03 0.00e+00 a 0 443 441 0 0 1324 1.909 29.217 8.705 1 T 6.812e+02 0.00e+00 a 0 0 0 0 0 1325 1.911 29.530 4.016 1 T 5.768e+02 0.00e+00 a 0 0 0 0 0 1328 2.205 31.554 9.052 1 T 6.047e+02 0.00e+00 a 0 0 0 0 0 1329 2.911 41.270 4.618 1 T 7.287e+02 0.00e+00 a 0 477 476 0 0 1330 4.616 53.576 4.614 1 T 3.625e+02 0.00e+00 a 0 475 474 475 0 1332 4.815 53.506 7.785 1 T 6.521e+02 0.00e+00 a 0 0 0 0 0 1333 4.816 53.506 7.843 1 T 5.482e+02 0.00e+00 a 0 0 0 0 0 1334 3.107 47.611 7.837 1 T 1.128e+03 0.00e+00 a 0 0 0 0 0 1335 2.949 47.611 7.834 1 T 9.650e+02 0.00e+00 a 0 0 0 0 0 1336 3.789 65.061 7.784 1 T 4.231e+02 0.00e+00 a 0 0 0 0 0 1337 3.723 65.061 7.785 1 T 1.262e+03 0.00e+00 a 0 0 0 0 0 1338 3.723 65.061 7.849 1 T 1.055e+03 0.00e+00 a 0 0 0 0 0 1339 3.790 65.061 7.843 1 T 6.006e+02 0.00e+00 a 0 0 0 0 0 1343 1.248 24.403 1.946 1 T 1.364e+03 0.00e+00 a 0 0 0 0 0 1344 1.251 24.551 4.537 1 T 9.354e+02 0.00e+00 a 0 528 525 520 0 1346 1.767 29.854 7.150 1 T 6.950e+02 0.00e+00 a 0 0 0 0 0 1347 4.163 57.008 7.308 1 T 3.400e+03 0.00e+00 a 0 0 0 0 0 1348 2.205 31.508 7.304 1 T 8.918e+02 0.00e+00 a 0 0 0 0 0 1349 1.908 31.508 7.306 1 T 8.013e+02 0.00e+00 a 0 0 0 0 0 1350 2.377 36.490 7.299 1 T 8.878e+02 0.00e+00 a 0 0 0 0 0 1351 2.134 36.355 7.297 1 T 8.675e+02 0.00e+00 a 0 0 0 0 0 1352 2.376 36.355 4.162 1 T 1.291e+03 0.00e+00 a 0 591 590 0 0 1353 2.134 36.244 4.166 1 T 8.688e+02 0.00e+00 a 0 592 590 0 0 1354 2.376 36.334 0.830 1 T 7.814e+02 0.00e+00 a 0 0 0 0 0 1355 2.136 36.417 0.843 1 T 4.157e+02 0.00e+00 a 0 0 0 0 0 1356 2.130 36.502 1.566 1 T 5.556e+02 0.00e+00 a 0 0 0 0 0 1357 2.375 36.417 1.576 1 T 4.049e+02 0.00e+00 a 0 0 0 0 0 1358 2.377 36.417 1.912 1 T 2.451e+03 0.00e+00 a 0 0 0 0 0 1359 2.133 36.417 1.908 1 T 1.356e+03 0.00e+00 a 0 0 0 0 0 1361 4.457 55.038 8.648 1 T 3.841e+03 0.00e+00 a 0 0 0 0 0 1362 4.446 54.933 3.237 1 T 2.258e+03 0.00e+00 a 0 612 611 0 0 1363 4.447 55.120 2.978 1 T 7.879e+02 0.00e+00 a 0 0 0 0 0 1364 4.443 54.933 2.719 1 T 6.929e+02 0.00e+00 a 0 0 0 0 0 1365 4.442 54.933 10.027 1 T 4.429e+02 0.00e+00 a 0 0 0 0 0 1366 4.445 54.933 8.661 1 T 4.259e+03 0.00e+00 a 0 0 0 0 0 1367 1.766 34.549 8.666 1 T 6.359e+02 0.00e+00 a 0 625 624 0 0 1368 1.765 34.506 8.495 1 T 6.990e+02 0.00e+00 a 0 0 0 0 0 1369 1.767 34.578 4.289 1 T 5.351e+02 0.00e+00 a 0 0 0 0 0 1370 1.766 34.540 1.589 1 T 5.340e+03 0.00e+00 a 0 0 0 0 0 1371 1.765 34.568 1.363 1 T 1.189e+03 0.00e+00 a 0 0 0 0 0 1372 1.588 34.543 1.765 1 T 2.192e+03 0.00e+00 a 0 0 0 0 0 1373 1.589 34.504 8.666 1 T 9.730e+02 0.00e+00 a 0 0 0 0 0 1374 1.589 34.543 4.295 1 T 1.365e+03 0.00e+00 a 0 0 0 0 0 1375 1.408 25.717 8.655 1 T 6.386e+02 0.00e+00 a 0 629 628 0 0 1376 1.321 25.716 8.656 1 T 6.229e+02 0.00e+00 a 0 630 628 0 0 1377 4.033 51.836 8.512 1 T 1.840e+03 0.00e+00 a 0 649 648 0 0 1378 4.034 51.800 8.293 1 T 8.825e+02 0.00e+00 a 0 0 0 0 0 1379 4.031 51.775 8.027 1 T 4.158e+03 0.00e+00 a 0 0 0 0 0 1380 4.034 51.721 0.073 1 T 1.567e+03 0.00e+00 a 0 0 0 0 0 1381 4.034 51.935 1.352 1 T 5.424e+02 0.00e+00 a 0 0 0 0 0 1382 4.033 51.712 1.202 1 T 6.244e+03 0.00e+00 a 0 0 0 0 0 1383 4.036 51.762 1.556 1 T 7.212e+02 0.00e+00 a 0 0 0 0 0 1384 4.034 51.836 2.684 1 T 4.325e+03 0.00e+00 a 0 0 0 0 0 1385 1.203 20.444 4.031 1 T 4.524e+03 0.00e+00 a 0 0 0 0 0 1386 1.204 20.395 0.067 1 T 1.598e+03 0.00e+00 a 0 0 0 0 0 1387 1.202 20.471 -0.142 1 T 2.413e+03 0.00e+00 a 0 0 0 0 0 1388 4.030 51.836 -0.133 1 T 5.322e+02 0.00e+00 a 0 0 0 0 0 1389 1.203 20.547 0.628 1 T 4.788e+03 0.00e+00 a 0 0 0 0 0 1390 1.203 20.463 1.790 1 T 8.841e+02 0.00e+00 a 0 0 0 0 0 1391 4.032 51.836 1.797 1 T 4.310e+02 0.00e+00 a 0 0 0 0 0 1393 1.203 20.457 2.538 1 T 3.985e+03 0.00e+00 a 0 0 0 0 0 1394 1.203 20.457 2.691 1 T 3.280e+03 0.00e+00 a 0 0 0 0 0 1395 4.032 51.836 2.555 1 T 1.456e+03 0.00e+00 a 0 0 0 0 0 1396 1.203 20.457 4.273 1 T 1.046e+03 0.00e+00 a 0 0 0 0 0 1397 4.032 51.836 4.273 1 T 8.239e+02 0.00e+00 a 0 0 0 0 0 1398 1.204 20.457 4.728 1 T 1.293e+03 0.00e+00 a 0 0 0 0 0 1399 1.202 20.509 5.194 1 T 7.269e+02 0.00e+00 a 0 0 0 0 0 1401 1.203 20.507 6.781 1 T 5.041e+02 0.00e+00 a 0 0 0 0 0 1402 1.202 20.398 7.046 1 T 2.195e+03 0.00e+00 a 0 0 0 0 0 1403 1.204 20.530 7.563 1 T 1.042e+03 0.00e+00 a 0 0 0 0 0 1405 1.202 20.385 8.020 1 T 2.044e+03 0.00e+00 a 0 650 651 0 0 1407 1.203 20.500 8.511 1 T 5.982e+03 0.00e+00 a 0 0 0 0 0 1408 1.203 20.302 9.174 1 T 5.124e+02 0.00e+00 a 0 0 0 0 0 1409 4.244 56.599 8.023 1 T 3.316e+03 0.00e+00 a 0 659 658 0 0 1410 4.239 56.471 8.487 1 T 1.634e+03 0.00e+00 a 0 0 0 0 0 1411 4.247 56.628 2.623 1 T 9.079e+03 0.00e+00 a 0 0 0 0 0 1412 2.622 38.523 4.246 1 T 1.370e+03 0.00e+00 a 0 0 0 0 0 1413 2.548 38.513 4.247 1 T 1.260e+03 0.00e+00 a 0 0 0 0 0 1414 2.622 38.513 8.011 1 T 1.144e+03 0.00e+00 a 0 662 660 0 0 1415 2.550 38.513 8.022 1 T 8.967e+02 0.00e+00 a 0 661 660 0 0 1418 4.245 56.628 2.547 1 T 6.254e+03 0.00e+00 a 0 0 0 0 0 1420 4.822 51.741 8.499 1 T 5.393e+02 0.00e+00 a 0 0 0 0 0 1422 3.092 39.450 4.820 1 T 6.661e+02 0.00e+00 a 0 0 0 0 0 1423 2.613 39.443 4.817 1 T 1.189e+03 0.00e+00 a 0 0 0 0 0 1425 3.090 39.408 2.607 1 T 3.213e+03 0.00e+00 a 0 673 672 0 0 1426 2.616 39.372 3.091 1 T 3.246e+03 0.00e+00 a 0 674 672 0 0 1428 4.826 51.757 2.612 1 T 5.604e+02 0.00e+00 a 0 671 670 0 0 1429 4.823 51.757 8.282 1 T 7.045e+02 0.00e+00 a 0 0 0 0 0 1430 3.089 39.339 7.056 1 T 6.060e+02 0.00e+00 a 0 0 0 0 0 1431 3.087 39.440 6.782 1 T 4.770e+02 0.00e+00 a 0 0 0 0 0 1432 2.617 39.326 7.038 1 T 7.651e+02 0.00e+00 a 0 0 0 0 0 1434 3.094 39.450 8.510 1 T 8.233e+02 0.00e+00 a 0 0 0 0 0 1435 2.615 39.443 8.506 1 T 9.250e+02 0.00e+00 a 0 0 0 0 0 1436 1.793 29.192 8.713 1 T 2.851e+03 0.00e+00 a 0 0 0 0 0 1437 1.800 29.049 4.594 1 T 9.489e+02 0.00e+00 a 0 0 0 0 0 1438 4.594 56.797 1.802 1 T 5.277e+02 0.00e+00 a 0 683 682 0 0 1439 4.203 57.685 8.046 1 T 3.426e+03 0.00e+00 a 0 702 701 0 0 1440 4.204 57.663 7.252 1 T 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1 T 5.469e+02 0.00e+00 a 0 0 0 0 0 1667 5.333 56.010 6.741 1 T 1.413e+03 0.00e+00 a 0 1038 1037 0 0 1668 5.335 56.187 6.493 1 T 7.022e+02 0.00e+00 a 0 0 0 0 0 1669 5.333 56.036 8.542 1 T 4.225e+03 0.00e+00 a 0 0 0 0 0 1670 5.334 55.890 9.005 1 T 7.309e+02 0.00e+00 a 0 0 0 0 0 1671 5.334 56.124 3.672 1 T 6.199e+02 0.00e+00 a 0 0 0 0 0 1672 5.332 56.041 2.901 1 T 4.473e+03 0.00e+00 a 0 0 0 0 0 1673 5.334 56.031 2.084 1 T 1.598e+03 0.00e+00 a 0 0 0 0 0 1674 5.334 56.031 2.234 1 T 5.911e+02 0.00e+00 a 0 0 0 0 0 1675 5.334 56.123 1.457 1 T 2.004e+03 0.00e+00 a 0 0 0 0 0 1676 5.334 56.004 0.751 1 T 2.196e+03 0.00e+00 a 0 0 0 0 0 1677 5.332 56.073 1.278 1 T 7.131e+02 0.00e+00 a 0 0 0 0 0 1678 2.896 42.496 6.752 1 T 1.094e+03 0.00e+00 a 0 1040 1039 0 0 1679 2.805 42.521 6.756 1 T 7.724e+02 0.00e+00 a 0 1041 1039 0 0 1680 2.895 42.496 5.341 1 T 9.924e+02 0.00e+00 a 0 0 0 0 0 1681 2.804 42.496 5.343 1 T 7.533e+02 0.00e+00 a 0 0 0 0 0 1682 2.805 42.521 8.549 1 T 4.168e+02 0.00e+00 a 0 0 0 0 0 1683 2.895 42.521 8.546 1 T 3.477e+02 0.00e+00 a 0 0 0 0 0 1684 2.805 42.521 0.707 1 T 9.015e+02 0.00e+00 a 0 0 0 0 0 1685 2.895 42.521 0.704 1 T 1.059e+03 0.00e+00 a 0 0 0 0 0 1686 1.415 41.106 8.519 1 T 6.944e+02 0.00e+00 a 0 0 0 0 0 1687 1.413 41.103 4.690 1 T 1.232e+03 0.00e+00 a 0 1064 1063 0 0 1688 1.411 41.103 3.643 1 T 8.922e+02 0.00e+00 a 0 0 0 0 0 1690 1.414 41.103 0.064 1 T 2.113e+03 0.00e+00 a 0 0 0 0 0 1691 1.413 41.103 0.554 1 T 1.539e+03 0.00e+00 a 0 0 0 0 0 1692 1.412 41.103 0.672 1 T 1.913e+03 0.00e+00 a 0 0 0 0 0 1693 1.410 41.122 2.789 1 T 3.760e+02 0.00e+00 a 0 0 0 0 0 1695 4.694 61.651 4.694 1 T -5.560e+01 0.00e+00 a 0 1062 1061 0 0 1697 0.059 12.635 1.886 1 T 5.188e+02 0.00e+00 a 0 0 0 0 0 1698 0.058 12.786 2.687 1 T 1.775e+03 0.00e+00 a 0 0 0 0 0 1699 0.058 12.586 3.021 1 T 1.001e+03 0.00e+00 a 0 0 0 0 0 1700 0.058 12.804 3.652 1 T 8.383e+02 0.00e+00 a 0 0 0 0 0 1701 0.059 12.594 4.016 1 T 9.896e+02 0.00e+00 a 0 0 0 0 0 1703 0.056 12.811 4.689 1 T 1.965e+03 0.00e+00 a 0 1074 1075 0 0 1704 0.058 12.725 7.584 1 T 4.297e+02 0.00e+00 a 0 0 0 0 0 1705 0.058 12.811 8.503 1 T 7.506e+02 0.00e+00 a 0 0 0 0 0 1706 0.060 12.775 0.639 1 T 4.453e+03 0.00e+00 a 0 0 0 0 0 1707 0.058 12.811 1.414 1 T 1.883e+03 0.00e+00 a 0 0 0 0 0 1708 0.058 12.811 1.281 1 T 2.904e+03 0.00e+00 a 0 0 0 0 0 1709 0.057 12.811 1.574 1 T 1.190e+03 0.00e+00 a 0 0 0 0 0 1710 0.629 19.706 8.523 1 T 1.263e+03 0.00e+00 a 0 0 0 0 0 1711 0.630 19.684 9.179 1 T 1.686e+03 0.00e+00 a 0 0 0 0 0 1713 0.611 20.095 7.535 1 T 5.848e+02 0.00e+00 a 0 0 0 0 0 1715 0.629 19.619 -0.110 1 T 3.206e+03 0.00e+00 a 0 0 0 0 0 1716 0.629 19.719 0.064 1 T 4.220e+03 0.00e+00 a 0 0 0 0 0 1717 0.628 19.696 1.183 1 T 3.639e+03 0.00e+00 a 0 0 0 0 0 1718 0.629 19.719 1.409 1 T 2.705e+03 0.00e+00 a 0 0 0 0 0 1719 0.629 19.719 1.577 1 T 1.106e+03 0.00e+00 a 0 0 0 0 0 1720 0.628 19.719 2.683 1 T 1.944e+03 0.00e+00 a 0 0 0 0 0 1721 0.629 19.719 2.531 1 T 1.075e+03 0.00e+00 a 0 0 0 0 0 1722 0.627 19.719 3.657 1 T 8.512e+02 0.00e+00 a 0 0 0 0 0 1723 0.630 19.719 3.998 1 T 9.509e+02 0.00e+00 a 0 0 0 0 0 1724 0.628 19.719 4.697 1 T 3.126e+03 0.00e+00 a 0 1065 1066 0 0 1725 0.632 19.788 5.225 1 T 1.090e+03 0.00e+00 a 0 0 0 0 0 1726 0.632 19.744 6.815 1 T 8.591e+02 0.00e+00 a 0 0 0 0 0 1727 0.628 19.719 7.038 1 T 1.686e+03 0.00e+00 a 0 0 0 0 0 1728 0.630 19.719 7.564 1 T 8.776e+02 0.00e+00 a 0 0 0 0 0 1729 1.339 28.007 0.063 1 T 9.847e+02 0.00e+00 a 0 0 0 0 0 1731 1.339 28.006 4.696 1 T 3.805e+02 0.00e+00 a 0 1071 1070 0 0 1732 1.342 28.006 8.529 1 T 3.657e+02 0.00e+00 a 0 0 0 0 0 1733 0.740 27.951 4.702 1 T 8.824e+02 0.00e+00 a 0 1072 163 0 0 1734 0.740 27.932 0.065 1 T 6.109e+02 0.00e+00 a 0 0 0 0 0 1735 0.739 27.951 1.335 1 T 5.831e+02 0.00e+00 a 0 0 0 0 0 1736 0.739 27.951 1.416 1 T 8.020e+02 0.00e+00 a 0 0 0 0 0 1737 1.339 28.006 0.739 1 T 7.002e+02 0.00e+00 a 0 0 0 0 0 1738 0.064 12.811 0.742 1 T 1.423e+03 0.00e+00 a 0 0 0 0 0 1745 4.576 52.344 4.576 1 T -3.809e+01 0.00e+00 a 0 1094 1093 1094 0 1746 1.371 18.493 3.018 1 T 9.959e+02 0.00e+00 a 0 0 0 0 0 1747 1.374 18.513 2.758 1 T 7.781e+02 0.00e+00 a 0 0 0 0 0 1748 1.372 18.510 2.312 1 T 1.310e+03 0.00e+00 a 0 0 0 0 0 1751 1.373 18.305 4.586 1 T 3.885e+03 0.00e+00 a 0 1095 1096 0 0 1752 1.374 18.335 5.216 1 T 1.374e+03 0.00e+00 a 0 0 0 0 0 1753 1.374 18.246 4.975 1 T 1.094e+03 0.00e+00 a 0 0 0 0 0 1754 1.373 18.302 3.927 1 T 2.513e+03 0.00e+00 a 0 0 0 0 0 1755 1.373 18.483 3.702 1 T 6.295e+02 0.00e+00 a 0 0 0 0 0 1756 1.373 18.359 6.781 1 T 2.930e+03 0.00e+00 a 0 0 0 0 0 1757 1.373 18.215 7.049 1 T 1.503e+03 0.00e+00 a 0 0 0 0 0 1758 1.373 18.259 7.809 1 T 8.022e+02 0.00e+00 a 0 0 0 0 0 1759 1.374 18.320 8.117 1 T 2.764e+03 0.00e+00 a 0 0 0 0 0 1760 1.374 18.374 8.354 1 T 1.192e+03 0.00e+00 a 0 0 0 0 0 1761 1.373 18.310 9.097 1 T 6.239e+03 0.00e+00 a 0 0 0 0 0 1762 1.373 18.177 0.369 1 T 1.343e+03 0.00e+00 a 0 0 0 0 0 1763 1.372 18.354 0.787 1 T 2.061e+03 0.00e+00 a 0 0 0 0 0 1764 3.739 64.856 1.883 1 T 7.128e+03 0.00e+00 a 0 0 0 0 0 1765 1.885 31.909 3.732 1 T 5.102e+03 0.00e+00 a 0 1106 1105 0 0 1766 3.739 64.874 0.804 1 T 1.522e+04 0.00e+00 a 0 0 0 0 0 1768 1.883 31.964 0.805 1 T 1.468e+04 0.00e+00 a 0 0 0 0 0 1769 1.883 31.962 1.403 1 T 5.728e+02 0.00e+00 a 0 0 0 0 0 1770 3.738 64.853 1.376 1 T 7.048e+02 0.00e+00 a 0 0 0 0 0 1771 3.738 64.853 8.121 1 T 2.648e+03 0.00e+00 a 0 0 0 0 0 1772 3.738 64.804 8.382 1 T 4.680e+03 0.00e+00 a 0 1104 1103 0 0 1773 0.798 21.227 3.727 1 T 1.335e+04 0.00e+00 a 0 0 0 0 0 1774 0.799 21.175 2.287 1 T 2.684e+03 0.00e+00 a 0 0 0 0 0 1775 0.797 21.244 1.893 1 T 1.379e+04 0.00e+00 a 0 0 0 0 0 1776 0.796 21.295 5.183 1 T 1.847e+03 0.00e+00 a 0 0 0 0 0 1777 0.793 21.083 4.585 1 T 1.173e+03 0.00e+00 a 0 0 0 0 0 1780 0.799 21.230 7.828 1 T 5.783e+02 0.00e+00 a 0 0 0 0 0 1781 0.795 21.244 7.049 1 T 4.092e+02 0.00e+00 a 0 0 0 0 0 1782 0.796 21.244 7.554 1 T 4.444e+02 0.00e+00 a 0 0 0 0 0 1783 0.796 21.244 8.123 1 T 4.734e+03 0.00e+00 a 0 0 0 0 0 1784 0.797 21.244 8.379 1 T 2.163e+03 0.00e+00 a 0 0 0 0 0 1785 0.797 21.235 9.054 1 T 1.861e+03 0.00e+00 a 0 0 0 0 0 1786 2.061 28.057 4.180 1 T 2.245e+03 0.00e+00 a 0 0 0 0 0 1787 2.060 28.023 8.385 1 T 1.154e+03 0.00e+00 a 0 0 0 0 0 1788 4.180 56.546 8.390 1 T 7.030e+03 0.00e+00 a 0 0 0 0 0 1789 1.896 27.992 4.179 1 T 2.829e+03 0.00e+00 a 0 0 0 0 0 1790 4.179 56.546 2.062 1 T 5.738e+03 0.00e+00 a 0 0 0 0 0 1791 4.177 56.546 1.898 1 T 7.600e+03 0.00e+00 a 0 0 0 0 0 1792 4.174 56.608 2.315 1 T 6.313e+03 0.00e+00 a 0 0 0 0 0 1794 4.178 56.546 0.842 1 T 3.809e+03 0.00e+00 a 0 0 0 0 0 1795 2.310 33.940 0.805 1 T 1.974e+03 0.00e+00 a 0 0 0 0 0 1796 2.307 33.827 1.368 1 T 1.114e+03 0.00e+00 a 0 0 0 0 0 1797 2.307 33.866 1.909 1 T 4.699e+03 0.00e+00 a 0 0 0 0 0 1798 2.314 33.875 8.381 1 T 1.524e+03 0.00e+00 a 0 1130 1127 0 0 1799 1.823 32.851 2.399 1 T 1.586e+03 0.00e+00 a 0 0 0 0 0 1800 4.445 55.293 2.394 1 T 1.412e+03 0.00e+00 a 0 0 0 0 0 1801 2.070 32.851 2.394 1 T 6.360e+02 0.00e+00 a 0 0 0 0 0 1802 2.478 32.279 4.443 1 T 9.617e+02 0.00e+00 a 0 1166 1165 1160 0 1803 2.391 32.279 4.443 1 T 9.674e+02 0.00e+00 a 0 1167 1165 0 0 1805 2.473 32.133 4.083 1 T 8.587e+02 0.00e+00 a 0 0 0 0 0 1807 -0.130 15.649 2.090 1 T 5.376e+02 0.00e+00 a 0 0 0 0 0 1808 -0.127 15.746 2.650 1 T 7.294e+02 0.00e+00 a 0 0 0 0 0 1809 -0.129 15.471 0.712 1 T 2.634e+03 0.00e+00 a 0 0 0 0 0 1810 -0.132 15.471 0.510 1 T 3.749e+03 0.00e+00 a 0 0 0 0 0 1811 1.603 37.357 3.918 1 T 6.405e+02 0.00e+00 a 0 0 0 0 0 1812 1.603 37.213 3.652 1 T 4.524e+02 0.00e+00 a 0 0 0 0 0 1813 1.599 37.373 4.680 1 T 4.108e+02 0.00e+00 a 0 0 0 0 0 1819 1.248 31.236 3.327 1 T 3.381e+02 0.00e+00 a 0 0 0 0 0 1821 3.692 63.854 1.830 1 T 1.618e+03 0.00e+00 a 0 0 0 0 0 1823 2.208 31.440 0.800 1 T 4.426e+02 0.00e+00 a 0 0 0 0 0 1824 3.695 63.893 0.101 1 T 5.870e+02 0.00e+00 a 0 0 0 0 0 1826 3.697 63.925 2.522 1 T 4.412e+02 0.00e+00 a 0 0 0 0 0 1827 3.693 63.854 7.263 1 T 2.339e+03 0.00e+00 a 0 0 0 0 0 1828 3.694 63.854 7.576 1 T 1.078e+03 0.00e+00 a 0 0 0 0 0 1829 3.693 63.854 8.084 1 T 7.265e+02 0.00e+00 a 0 0 0 0 0 1830 5.334 56.041 2.805 1 T 3.152e+03 0.00e+00 a 0 0 0 0 0 1833 2.730 30.525 6.321 1 T 4.279e+02 0.00e+00 a 0 0 0 0 0 1834 2.643 30.525 6.327 1 T 5.626e+02 0.00e+00 a 0 0 0 0 0 1838 0.706 23.141 2.073 1 T 7.795e+02 0.00e+00 a 0 0 0 0 0 1839 0.707 23.141 1.467 1 T 2.324e+03 0.00e+00 a 0 0 0 0 0 1840 0.705 22.905 2.826 1 T 1.229e+03 0.00e+00 a 0 0 0 0 0 1841 0.707 23.096 4.389 1 T 9.188e+02 0.00e+00 a 0 0 0 0 0 1842 0.708 23.184 4.648 1 T 5.612e+02 0.00e+00 a 0 0 0 0 0 1846 1.464 42.024 2.121 1 T 1.038e+03 0.00e+00 a 0 0 0 0 0 1847 0.795 26.723 2.034 1 T 1.194e+03 0.00e+00 a 0 0 0 0 0 1848 0.795 26.723 1.469 1 T 2.018e+03 0.00e+00 a 0 0 0 0 0 1854 0.616 22.936 7.220 1 T 6.444e+02 0.00e+00 a 0 0 0 0 0 1855 4.122 55.503 7.930 1 T 8.640e+02 0.00e+00 a 0 0 0 0 0 1856 4.122 55.457 8.810 1 T 4.954e+02 0.00e+00 a 0 0 0 0 0 1857 4.304 56.902 1.966 1 T 1.233e+03 0.00e+00 a 0 0 0 0 0 ; 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-aliphatic . . 14 ppm . . . 4.771 . . 30352 1 2 . . C 13 C-aliphatic . . 76 ppm . . . 42 . . 30352 1 3 . . H 1 H . . 14 ppm . . . 4.771 . . 30352 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 30352 _Spectral_peak_list.ID 2 _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 7 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aromatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 # FORMAT xeasy3D # INAME 1 HC # INAME 2 C # INAME 3 H # SPECTRUM C13NOESY HC C H 1 126.831 9.944 6.664 1 T 2.982e+05 0.00e+00 a 0 0 0 0 0 2 126.659 10.537 6.665 1 T 5.651e+04 0.00e+00 a 0 0 0 0 0 3 126.669 8.715 6.666 1 T 6.360e+04 0.00e+00 a 0 0 0 0 0 4 126.872 2.948 6.664 1 T 1.322e+05 0.00e+00 a 0 0 0 0 0 5 126.690 2.810 6.663 1 T 1.272e+05 0.00e+00 a 0 0 0 0 0 6 126.699 1.408 6.666 1 T 9.974e+04 0.00e+00 a 0 0 0 0 0 7 126.749 3.832 6.664 1 T 5.733e+04 0.00e+00 a 0 0 0 0 0 10 115.014 10.177 7.448 1 T 6.471e+04 0.00e+00 a 0 0 0 0 0 11 114.031 9.963 7.184 1 T 7.465e+04 0.00e+00 a 0 0 0 0 0 12 133.886 8.550 6.746 1 T 8.755e+04 0.00e+00 a 0 0 0 0 0 13 133.924 6.487 6.746 1 T 3.027e+05 0.00e+00 a 0 0 0 0 0 14 133.753 5.328 6.746 1 T 6.968e+04 0.00e+00 a 0 0 0 0 0 15 133.579 5.028 6.746 1 T 4.246e+04 0.00e+00 a 0 0 0 0 0 16 133.736 4.705 6.747 1 T 5.418e+04 0.00e+00 a 0 0 0 0 0 17 134.084 4.445 6.751 1 T 5.097e+04 0.00e+00 a 0 0 0 0 0 20 133.616 4.346 6.747 1 T 3.113e+04 0.00e+00 a 0 0 0 0 0 21 133.949 1.398 6.746 1 T 1.444e+05 0.00e+00 a 0 0 0 0 0 22 133.886 2.808 6.751 1 T 1.933e+05 0.00e+00 a 0 0 0 0 0 23 133.886 2.901 6.751 1 T 1.940e+05 0.00e+00 a 0 0 0 0 0 24 133.916 0.658 6.743 1 T 7.160e+04 0.00e+00 a 0 0 0 0 0 25 133.886 8.671 6.748 1 T 7.470e+04 0.00e+00 a 0 0 0 0 0 26 117.466 6.734 6.497 1 T 3.069e+05 0.00e+00 a 0 0 0 0 0 28 117.433 5.269 6.498 1 T 4.847e+04 0.00e+00 a 0 0 0 0 0 29 117.318 4.715 6.499 1 T 9.569e+04 0.00e+00 a 0 0 0 0 0 30 117.581 3.660 6.499 1 T 4.960e+04 0.00e+00 a 0 0 0 0 0 31 117.482 3.032 6.501 1 T 8.030e+04 0.00e+00 a 0 0 0 0 0 32 117.509 2.834 6.502 1 T 6.429e+04 0.00e+00 a 0 0 0 0 0 33 117.448 1.400 6.498 1 T 2.127e+05 0.00e+00 a 0 0 0 0 0 34 117.474 8.282 6.497 1 T 5.117e+04 0.00e+00 a 0 0 0 0 0 35 131.999 7.395 7.137 1 T 2.266e+05 0.00e+00 a 0 0 0 0 0 36 131.898 2.746 7.137 1 T 1.032e+05 0.00e+00 a 0 0 0 0 0 37 131.787 3.996 7.136 1 T 4.216e+04 0.00e+00 a 0 0 0 0 0 38 131.796 10.554 7.138 1 T 4.248e+04 0.00e+00 a 0 0 0 0 0 ; 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-aromatic . . 14 ppm . . . 4.771 . . 30352 2 2 . . C 13 C-aromatic . . 30 ppm . . . 125 . . 30352 2 3 . . H 1 H . . 14 ppm . . . 4.771 . . 30352 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 30352 _Spectral_peak_list.ID 3 _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 6 _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 # FORMAT xeasy3D # INAME 1 HN # INAME 2 N # INAME 3 H # SPECTRUM N15NOESY HN N H 3 9.203 122.630 4.966 1 T 1.263e+03 0.00e+00 a 0 1081 1080 1083 0 4 8.599 117.992 5.339 1 T 5.979e+03 0.00e+00 a 0 1036 1035 1038 0 5 8.599 117.992 2.803 1 T 2.825e+03 0.00e+00 a 0 1036 1035 1041 0 6 7.720 109.081 3.385 1 T 6.676e+03 0.00e+00 a 0 927 926 930 0 9 9.483 113.477 3.810 1 T 1.774e+03 0.00e+00 a 0 507 506 511 0 10 8.021 120.133 4.239 1 T 2.103e+03 0.00e+00 a 0 657 656 659 0 11 10.027 124.838 3.231 1 T 2.024e+03 0.00e+00 a 0 610 609 614 0 12 7.785 117.131 2.932 1 T 6.711e+02 0.00e+00 a 0 496 495 501 0 13 8.743 126.770 2.769 1 T 2.064e+03 0.00e+00 a 0 847 846 852 0 15 8.357 120.918 2.797 1 T 1.881e+03 0.00e+00 a 0 1025 1024 1030 0 17 7.784 117.131 4.801 1 T 2.642e+03 0.00e+00 a 0 496 495 498 0 20 8.304 118.665 2.562 1 T 2.543e+03 0.00e+00 a 0 793 792 797 0 21 7.340 115.227 4.135 1 T 2.535e+03 0.00e+00 a 0 911 910 913 0 22 7.339 115.227 1.906 1 T 4.245e+03 0.00e+00 a 0 911 910 915 0 23 8.673 120.793 4.276 1 T 9.051e+02 0.00e+00 a 0 621 620 623 0 24 9.031 119.924 4.371 1 T 1.452e+03 0.00e+00 a 0 408 407 410 0 25 8.745 126.770 2.953 1 T 2.850e+03 0.00e+00 a 0 847 846 851 0 26 8.402 117.735 3.915 1 T 6.155e+03 0.00e+00 a 0 1147 1146 1151 0 27 8.042 118.691 4.208 1 T 4.202e+03 0.00e+00 a 0 700 699 702 0 29 7.374 118.074 4.783 1 T 9.465e+02 0.00e+00 a 0 599 598 601 0 30 8.695 128.692 4.760 1 T 7.301e+02 0.00e+00 a 0 804 803 806 0 32 8.415 116.147 3.808 1 T 1.330e+04 0.00e+00 a 0 485 484 489 0 34 8.452 120.758 4.391 1 T 2.569e+03 0.00e+00 a 0 375 374 377 0 35 10.026 124.838 2.054 1 T 1.813e+03 0.00e+00 a 0 610 609 615 0 41 8.117 123.243 3.737 1 T 3.775e+03 0.00e+00 a 0 1102 1101 1104 0 42 8.529 120.631 8.530 1 T 6.797e+03 0.00e+00 a 0 1060 1059 1060 0 43 7.374 118.024 3.389 1 T 2.361e+03 0.00e+00 a 0 599 598 603 0 44 8.026 119.359 4.423 1 T 4.289e+03 0.00e+00 a 0 1158 1157 1160 0 45 8.512 121.872 4.038 1 T 5.331e+02 0.00e+00 a 0 647 646 649 0 46 8.267 121.347 2.344 1 T 3.686e+03 0.00e+00 a 0 681 680 685 0 47 8.300 121.241 4.618 1 T 1.156e+03 0.00e+00 a 0 473 472 475 0 49 8.416 121.728 5.208 1 T 6.108e+02 0.00e+00 a 0 1009 1008 1011 0 50 7.305 116.096 7.304 1 T 1.975e+04 0.00e+00 a 0 583 582 583 0 54 7.243 114.812 3.196 1 T 2.729e+03 0.00e+00 a 0 726 725 730 0 55 8.528 120.652 4.692 1 T 1.199e+03 0.00e+00 a 0 1060 1059 1062 0 56 9.002 111.515 3.525 1 T 1.940e+03 0.00e+00 a 0 466 465 469 0 57 8.049 115.991 2.474 1 T 1.980e+03 0.00e+00 a 0 892 891 0 0 59 7.801 120.057 1.645 1 T 1.622e+03 0.00e+00 a 0 518 517 523 0 61 8.508 117.575 3.096 1 T 4.279e+03 0.00e+00 a 0 669 668 673 0 63 8.301 121.241 2.576 1 T 2.884e+03 0.00e+00 a 0 473 472 478 0 64 8.402 117.735 3.860 1 T 3.594e+03 0.00e+00 a 0 1147 1146 1152 0 65 7.305 116.104 1.907 1 T 1.616e+03 0.00e+00 a 0 583 582 588 0 66 8.413 124.181 1.798 1 T 2.896e+03 0.00e+00 a 0 982 981 986 0 67 8.388 117.724 4.177 1 T 4.422e+03 0.00e+00 a 0 1120 1119 1122 0 68 8.119 123.239 1.880 1 T 2.907e+03 0.00e+00 a 0 1102 1101 1106 0 71 8.042 118.691 1.832 1 T 1.241e+04 0.00e+00 a 0 700 699 704 0 72 8.507 117.552 2.614 1 T 7.866e+03 0.00e+00 a 0 669 668 674 0 73 8.416 121.728 1.738 1 T 1.607e+03 0.00e+00 a 0 1009 1008 1013 0 76 8.529 120.652 1.422 1 T 1.697e+03 0.00e+00 a 0 1060 1059 1064 0 77 9.093 120.172 3.960 1 T 1.054e+03 0.00e+00 a 0 833 832 837 0 82 7.282 111.698 4.440 1 T 4.540e+03 0.00e+00 a 0 334 333 336 0 83 7.762 119.340 1.942 1 T 7.072e+03 0.00e+00 a 0 356 355 361 0 84 8.964 119.323 1.995 1 T 9.979e+02 0.00e+00 a 0 964 963 968 0 85 7.553 118.851 2.545 1 T 2.110e+03 0.00e+00 a 0 740 739 745 0 86 8.345 117.315 2.966 1 T 3.122e+03 0.00e+00 a 0 397 396 402 0 92 8.267 121.347 4.609 1 T 7.227e+02 0.00e+00 a 0 681 680 683 0 93 9.065 116.016 3.730 1 T 4.731e+03 0.00e+00 a 0 764 763 768 0 94 8.673 131.808 3.833 1 T 1.221e+03 0.00e+00 a 0 882 881 884 0 95 8.695 128.716 1.394 1 T 2.466e+03 0.00e+00 a 0 804 803 807 0 96 7.816 114.459 3.933 1 T 8.513e+03 0.00e+00 a 0 1136 1135 1142 0 97 8.388 117.724 1.881 1 T 6.060e+03 0.00e+00 a 0 1120 1119 1125 0 98 9.065 116.015 4.738 1 T 7.409e+02 0.00e+00 a 0 764 763 766 0 99 6.490 105.224 3.029 1 T 2.366e+03 0.00e+00 a 0 934 933 937 0 100 8.417 121.728 1.564 1 T 6.975e+02 0.00e+00 a 0 1009 1008 1014 0 101 9.482 113.477 4.470 1 T 1.680e+03 0.00e+00 a 0 507 506 509 0 102 7.282 111.690 2.680 1 T 3.261e+03 0.00e+00 a 0 334 333 339 0 103 8.416 124.154 4.687 1 T 1.181e+03 0.00e+00 a 0 982 981 984 0 106 7.553 118.851 2.701 1 T 1.367e+03 0.00e+00 a 0 740 739 744 0 107 8.059 115.743 3.597 1 T 2.096e+03 0.00e+00 a 0 775 774 779 0 109 7.306 107.061 3.552 1 T 1.562e+03 0.00e+00 a 0 786 785 789 0 112 8.722 120.879 4.601 1 T 9.521e+02 0.00e+00 a 0 814 813 816 0 114 9.027 119.896 1.816 1 T 4.640e+03 0.00e+00 a 0 408 407 412 0 115 8.345 117.355 4.484 1 T 2.534e+03 0.00e+00 a 0 397 396 399 0 116 8.963 119.320 4.420 1 T 1.141e+03 0.00e+00 a 0 964 963 966 0 118 7.759 119.340 4.299 1 T 4.251e+03 0.00e+00 a 0 356 355 358 0 119 7.305 116.104 2.201 1 T 1.327e+03 0.00e+00 a 0 583 582 587 0 120 7.374 118.012 2.407 1 T 3.041e+03 0.00e+00 a 0 599 598 604 0 122 7.341 115.209 1.428 1 T 5.853e+03 0.00e+00 a 0 911 910 916 0 124 8.357 108.470 3.470 1 T 7.106e+03 0.00e+00 a 0 349 348 352 0 125 8.507 117.552 4.829 1 T 1.788e+03 0.00e+00 a 0 669 668 671 0 126 8.357 120.918 3.103 1 T 1.703e+03 0.00e+00 a 0 1025 1024 1029 0 128 8.453 120.725 1.366 1 T 2.695e+03 0.00e+00 a 0 375 374 380 0 129 8.301 121.268 8.300 1 T 2.258e+04 0.00e+00 a 0 473 472 473 0 132 7.784 117.131 3.127 1 T 6.594e+02 0.00e+00 a 0 496 495 500 0 133 9.099 126.892 1.375 1 T 6.323e+03 0.00e+00 a 0 1092 1091 1095 0 134 8.452 120.717 1.623 1 T 1.193e+04 0.00e+00 a 0 375 374 379 0 135 6.489 105.224 3.479 1 T 5.075e+03 0.00e+00 a 0 934 933 936 0 136 8.049 115.998 4.061 1 T 5.127e+03 0.00e+00 a 0 892 891 894 0 138 8.887 121.050 3.650 1 T 9.949e+02 0.00e+00 a 0 544 543 546 0 140 10.026 124.754 4.457 1 T 1.776e+03 0.00e+00 a 0 610 609 612 0 144 9.095 120.192 4.702 1 T 1.677e+03 0.00e+00 a 0 833 832 835 0 145 7.801 120.057 4.574 1 T 1.215e+03 0.00e+00 a 0 518 517 520 0 146 8.388 117.724 2.079 1 T 2.452e+03 0.00e+00 a 0 1120 1119 1124 0 151 8.670 120.795 1.567 1 T 3.221e+03 0.00e+00 a 0 621 620 0 0 155 7.242 114.858 3.697 1 T 3.419e+03 0.00e+00 a 0 726 725 728 0 157 7.816 114.503 4.384 1 T 4.117e+03 0.00e+00 a 0 1136 1135 1138 0 158 7.802 120.057 1.975 1 T 7.545e+02 0.00e+00 a 0 518 517 522 0 159 8.372 118.274 4.785 1 T 1.829e+03 0.00e+00 a 0 941 940 943 0 161 8.402 117.735 4.319 1 T 6.198e+03 0.00e+00 a 0 1147 1146 1149 0 163 8.345 117.331 8.344 1 T 1.619e+04 0.00e+00 a 0 397 396 397 0 164 8.267 121.347 1.806 1 T 5.230e+03 0.00e+00 a 0 681 680 686 0 165 7.554 118.824 5.185 1 T 1.660e+03 0.00e+00 a 0 740 739 742 0 167 8.300 121.241 2.923 1 T 3.362e+03 0.00e+00 a 0 473 472 477 0 169 8.680 131.816 1.414 1 T 5.145e+03 0.00e+00 a 0 882 881 885 0 171 9.096 126.893 4.574 1 T 6.410e+02 0.00e+00 a 0 1092 1091 1094 0 173 8.723 120.839 1.762 1 T 5.366e+03 0.00e+00 a 0 814 813 818 0 175 8.051 115.991 1.876 1 T 1.053e+04 0.00e+00 a 0 892 891 0 0 176 7.720 109.081 3.730 1 T 4.981e+03 0.00e+00 a 0 927 926 929 0 177 8.062 115.747 5.236 1 T 2.343e+03 0.00e+00 a 0 775 774 777 0 179 7.678 122.453 3.480 1 T 6.022e+03 0.00e+00 a 0 871 870 875 0 180 8.027 119.395 2.092 1 T 2.029e+03 0.00e+00 a 0 1158 1157 1162 0 181 8.354 108.481 4.242 1 T 6.808e+03 0.00e+00 a 0 349 348 351 0 182 8.599 117.992 2.894 1 T 6.885e+02 0.00e+00 a 0 1036 1035 1040 0 187 7.678 122.465 4.480 1 T 1.824e+03 0.00e+00 a 0 871 870 873 0 189 7.281 111.674 3.120 1 T 2.088e+03 0.00e+00 a 0 334 333 338 0 192 8.511 121.877 1.212 1 T 3.779e+03 0.00e+00 a 0 647 646 650 0 195 8.358 120.947 5.381 1 T 8.996e+02 0.00e+00 a 0 1025 1024 1027 0 198 9.482 113.477 3.723 1 T 1.916e+03 0.00e+00 a 0 507 506 512 0 200 7.761 119.340 2.035 1 T 3.524e+03 0.00e+00 a 0 356 355 360 0 202 8.346 117.299 3.189 1 T 1.525e+03 0.00e+00 a 0 397 396 401 0 204 8.670 120.779 1.808 1 T 2.777e+03 0.00e+00 a 0 621 620 0 0 205 8.424 115.741 4.292 1 T 4.366e+03 0.00e+00 a 0 571 570 573 0 208 7.306 107.061 3.728 1 T 6.279e+02 0.00e+00 a 0 786 785 788 0 209 8.415 116.156 4.766 1 T 1.056e+03 0.00e+00 a 0 485 484 487 0 211 8.303 118.631 4.968 1 T 1.004e+03 0.00e+00 a 0 793 792 795 0 213 8.745 126.749 3.961 1 T 3.455e+03 0.00e+00 a 0 847 846 849 0 214 9.000 111.514 4.112 1 T 2.542e+03 0.00e+00 a 0 466 465 468 0 216 9.204 122.560 3.033 1 T 1.981e+03 0.00e+00 a 0 1081 1080 1085 0 218 8.021 120.157 2.550 1 T 6.173e+03 0.00e+00 a 0 657 656 661 0 221 7.305 116.104 4.162 1 T 1.610e+03 0.00e+00 a 0 583 582 585 0 224 9.031 119.924 9.031 1 T 7.893e+03 0.00e+00 a 0 408 407 408 0 226 7.282 111.700 7.280 1 T 3.094e+04 0.00e+00 a 0 334 333 334 0 227 8.371 118.274 2.727 1 T 7.858e+03 0.00e+00 a 0 941 940 945 0 228 8.027 119.395 1.818 1 T 2.386e+03 0.00e+00 a 0 1158 1157 1163 0 235 8.266 121.382 7.764 1 T 7.255e+02 0.00e+00 a 0 0 0 0 0 288 8.441 118.879 1.459 1 T 2.971e+03 0.00e+00 a 0 0 0 0 0 289 8.443 118.885 1.213 1 T 1.330e+03 0.00e+00 a 0 0 0 0 0 290 8.441 118.924 1.825 1 T 4.327e+02 0.00e+00 a 0 0 0 0 0 291 8.437 118.887 2.117 1 T 6.013e+02 0.00e+00 a 0 0 0 0 0 305 7.282 111.706 8.349 1 T 4.442e+03 0.00e+00 a 0 0 0 0 0 306 7.282 111.727 9.067 1 T 4.360e+02 0.00e+00 a 0 0 0 0 0 307 7.759 119.290 9.051 1 T 8.782e+02 0.00e+00 a 0 0 0 0 0 308 7.759 119.328 8.354 1 T 5.152e+03 0.00e+00 a 0 356 355 349 0 309 8.354 108.430 7.763 1 T 5.511e+03 0.00e+00 a 0 349 348 356 0 310 7.283 111.712 7.767 1 T 8.148e+02 0.00e+00 a 0 0 0 0 0 311 7.282 111.727 6.702 1 T 7.397e+02 0.00e+00 a 0 0 0 0 0 313 7.282 111.725 4.223 1 T 2.264e+03 0.00e+00 a 0 334 333 320 0 314 7.282 111.703 3.715 1 T 2.136e+03 0.00e+00 a 0 0 0 0 0 315 7.282 111.666 3.427 1 T 8.190e+02 0.00e+00 a 0 0 0 0 0 316 7.282 111.751 0.822 1 T 2.094e+03 0.00e+00 a 0 0 0 0 0 317 7.282 111.716 1.461 1 T 2.206e+03 0.00e+00 a 0 0 0 0 0 318 7.281 111.708 1.779 1 T 1.321e+03 0.00e+00 a 0 0 0 0 0 319 7.282 111.676 1.980 1 T 3.089e+03 0.00e+00 a 0 0 0 0 0 320 7.281 111.740 2.265 1 T 1.128e+03 0.00e+00 a 0 0 0 0 0 321 7.282 111.727 2.385 1 T 4.304e+02 0.00e+00 a 0 0 0 0 0 322 8.353 108.590 0.812 1 T 5.613e+02 0.00e+00 a 0 0 0 0 0 323 8.352 108.457 0.822 1 T 4.680e+02 0.00e+00 a 0 0 0 0 0 324 8.352 108.418 1.326 1 T 5.948e+02 0.00e+00 a 0 0 0 0 0 325 8.354 108.449 1.519 1 T 1.887e+03 0.00e+00 a 0 0 0 0 0 326 8.354 108.430 1.973 1 T 1.543e+03 0.00e+00 a 0 0 0 0 0 327 8.354 108.398 2.169 1 T 8.216e+02 0.00e+00 a 0 0 0 0 0 328 8.353 108.496 2.657 1 T 6.888e+02 0.00e+00 a 0 0 0 0 0 329 8.352 108.457 3.145 1 T 7.193e+02 0.00e+00 a 0 0 0 0 0 330 7.760 119.312 0.824 1 T 1.770e+03 0.00e+00 a 0 0 0 0 0 331 8.353 108.475 7.275 1 T 4.291e+03 0.00e+00 a 0 0 0 0 0 333 8.354 108.445 3.738 1 T 5.495e+02 0.00e+00 a 0 0 0 0 0 334 7.759 119.376 2.683 1 T 4.793e+02 0.00e+00 a 0 0 0 0 0 335 7.760 119.340 3.135 1 T 3.505e+02 0.00e+00 a 0 0 0 0 0 336 7.759 119.344 3.457 1 T 2.069e+03 0.00e+00 a 0 0 0 0 0 337 7.760 119.340 2.149 1 T 7.908e+03 0.00e+00 a 0 0 0 0 0 338 7.761 119.352 1.508 1 T 1.175e+03 0.00e+00 a 0 0 0 0 0 340 7.759 119.406 7.270 1 T 1.152e+03 0.00e+00 a 0 0 0 0 0 341 8.452 120.737 7.751 1 T 5.764e+02 0.00e+00 a 0 375 374 356 0 342 8.346 117.340 9.035 1 T 1.865e+03 0.00e+00 a 0 0 0 0 0 343 7.759 119.340 4.245 1 T 4.831e+03 0.00e+00 a 0 0 0 0 0 344 7.758 119.340 4.389 1 T 9.846e+02 0.00e+00 a 0 0 0 0 0 345 7.758 119.340 4.441 1 T 8.189e+02 0.00e+00 a 0 0 0 0 0 346 8.355 108.457 4.441 1 T 1.113e+03 0.00e+00 a 0 0 0 0 0 347 8.451 120.758 4.441 1 T 9.483e+02 0.00e+00 a 0 0 0 0 0 348 8.452 120.729 4.302 1 T 1.006e+04 0.00e+00 a 0 0 0 0 0 349 8.453 120.758 4.239 1 T 4.751e+03 0.00e+00 a 0 0 0 0 0 352 8.452 120.758 1.948 1 T 2.584e+03 0.00e+00 a 0 0 0 0 0 353 8.453 120.758 2.055 1 T 3.599e+03 0.00e+00 a 0 0 0 0 0 354 8.453 120.758 2.142 1 T 2.717e+03 0.00e+00 a 0 0 0 0 0 355 8.452 120.736 0.640 1 T 1.936e+03 0.00e+00 a 0 0 0 0 0 356 8.452 120.681 0.776 1 T 1.871e+03 0.00e+00 a 0 0 0 0 0 357 8.346 117.335 0.800 1 T 2.262e+03 0.00e+00 a 0 0 0 0 0 358 8.345 117.353 0.623 1 T 2.702e+03 0.00e+00 a 0 0 0 0 0 359 9.028 119.921 0.806 1 T 2.033e+03 0.00e+00 a 0 0 0 0 0 360 8.346 117.387 1.373 1 T 1.859e+03 0.00e+00 a 0 0 0 0 0 361 8.346 117.348 1.588 1 T 3.437e+03 0.00e+00 a 0 0 0 0 0 362 8.687 123.192 1.459 1 T 1.340e+03 0.00e+00 a 0 0 0 0 0 363 9.028 119.906 1.498 1 T 2.230e+03 0.00e+00 a 0 0 0 0 0 364 9.028 119.896 1.593 1 T 1.808e+03 0.00e+00 a 0 0 0 0 0 365 9.029 119.896 1.418 1 T 1.185e+03 0.00e+00 a 0 0 0 0 0 366 8.344 117.305 1.825 1 T 3.727e+02 0.00e+00 a 0 0 0 0 0 367 8.345 117.355 2.052 1 T 7.775e+02 0.00e+00 a 0 0 0 0 0 368 9.028 119.896 2.066 1 T 4.697e+02 0.00e+00 a 0 0 0 0 0 369 9.029 119.959 2.962 1 T 3.298e+03 0.00e+00 a 0 0 0 0 0 370 9.028 119.827 3.183 1 T 2.138e+03 0.00e+00 a 0 0 0 0 0 371 9.030 119.971 3.480 1 T 3.731e+02 0.00e+00 a 0 0 0 0 0 372 9.028 119.896 2.562 1 T 3.331e+02 0.00e+00 a 0 0 0 0 0 373 8.345 117.355 4.370 1 T 8.042e+03 0.00e+00 a 0 0 0 0 0 374 8.345 117.355 4.393 1 T 8.042e+03 0.00e+00 a 0 0 0 0 0 375 8.345 117.355 4.303 1 T 2.265e+03 0.00e+00 a 0 0 0 0 0 376 9.029 119.896 4.487 1 T 4.504e+03 0.00e+00 a 0 0 0 0 0 377 8.686 123.286 4.363 1 T 5.674e+03 0.00e+00 a 0 434 433 0 0 378 8.685 123.290 4.035 1 T 1.158e+03 0.00e+00 a 0 434 433 0 0 379 8.346 117.355 7.272 1 T 1.323e+03 0.00e+00 a 0 0 0 0 0 380 8.342 117.339 8.064 1 T 4.273e+02 0.00e+00 a 0 0 0 0 0 381 9.027 119.997 10.033 1 T 1.643e+03 0.00e+00 a 0 0 0 0 0 382 9.027 119.896 8.693 1 T 3.842e+02 0.00e+00 a 0 0 0 0 0 383 9.029 119.969 8.377 1 T 5.352e+02 0.00e+00 a 0 0 0 0 0 384 8.685 123.306 8.310 1 T 4.190e+02 0.00e+00 a 0 0 0 0 0 385 8.686 123.226 9.029 1 T 3.613e+02 0.00e+00 a 0 0 0 0 0 387 9.027 119.911 7.355 1 T 8.953e+02 0.00e+00 a 0 0 0 0 0 389 9.028 119.913 4.759 1 T 1.329e+03 0.00e+00 a 0 0 0 0 0 391 8.685 123.249 2.950 1 T 1.640e+03 0.00e+00 a 0 0 0 0 0 392 8.685 123.216 2.557 1 T 3.381e+03 0.00e+00 a 0 0 0 0 0 394 8.686 123.295 2.119 1 T 2.219e+03 0.00e+00 a 0 0 0 0 0 395 8.686 123.220 1.818 1 T 3.928e+03 0.00e+00 a 0 0 0 0 0 396 8.686 123.226 1.724 1 T 2.324e+03 0.00e+00 a 0 0 0 0 0 399 9.000 111.529 8.303 1 T 1.708e+03 0.00e+00 a 0 0 0 0 0 400 8.999 111.580 9.933 1 T 3.807e+02 0.00e+00 a 0 0 0 0 0 401 8.300 121.256 9.003 1 T 3.361e+03 0.00e+00 a 0 0 0 0 0 402 9.000 111.514 7.295 1 T 4.948e+02 0.00e+00 a 0 0 0 0 0 403 8.301 121.288 6.357 1 T 5.095e+02 0.00e+00 a 0 0 0 0 0 404 9.000 111.514 5.374 1 T 7.329e+02 0.00e+00 a 0 0 0 0 0 406 8.412 116.156 5.286 1 T 6.065e+02 0.00e+00 a 0 0 0 0 0 407 8.301 121.241 4.365 1 T 5.643e+02 0.00e+00 a 0 0 0 0 0 408 8.300 121.264 4.100 1 T 1.411e+03 0.00e+00 a 0 0 0 0 0 409 8.300 121.282 3.510 1 T 8.725e+02 0.00e+00 a 0 0 0 0 0 410 8.300 121.164 3.691 1 T 8.930e+02 0.00e+00 a 0 0 0 0 0 411 9.000 111.501 3.717 1 T 3.022e+03 0.00e+00 a 0 0 0 0 0 412 9.000 111.507 2.822 1 T 1.523e+03 0.00e+00 a 0 0 0 0 0 413 9.000 111.443 3.074 1 T 7.974e+02 0.00e+00 a 0 0 0 0 0 415 8.300 121.241 2.822 1 T 2.756e+03 0.00e+00 a 0 0 0 0 0 416 8.415 116.156 2.922 1 T 2.434e+03 0.00e+00 a 0 0 0 0 0 417 9.000 111.514 2.021 1 T 5.732e+02 0.00e+00 a 0 0 0 0 0 418 9.000 111.514 2.191 1 T 7.139e+02 0.00e+00 a 0 0 0 0 0 419 9.000 111.526 1.729 1 T 4.950e+02 0.00e+00 a 0 0 0 0 0 420 9.001 111.533 1.490 1 T 1.365e+03 0.00e+00 a 0 0 0 0 0 421 9.000 111.514 1.270 1 T 9.833e+02 0.00e+00 a 0 0 0 0 0 422 9.001 111.557 0.771 1 T 1.864e+03 0.00e+00 a 0 0 0 0 0 423 8.999 111.451 0.540 1 T 3.175e+02 0.00e+00 a 0 0 0 0 0 424 8.300 121.352 0.769 1 T 6.785e+02 0.00e+00 a 0 0 0 0 0 427 8.300 121.241 1.496 1 T 1.061e+03 0.00e+00 a 0 0 0 0 0 428 8.301 121.214 1.821 1 T 1.699e+03 0.00e+00 a 0 0 0 0 0 429 8.415 116.148 7.789 1 T 1.498e+03 0.00e+00 a 0 485 484 496 0 430 7.783 117.078 8.395 1 T 1.983e+03 0.00e+00 a 0 0 0 0 0 431 7.785 117.131 9.488 1 T 3.938e+02 0.00e+00 a 0 0 0 0 0 432 7.785 117.054 5.212 1 T 2.392e+03 0.00e+00 a 0 0 0 0 0 433 7.785 117.131 4.760 1 T 5.189e+03 0.00e+00 a 0 0 0 0 0 434 8.414 116.156 4.835 1 T 9.787e+02 0.00e+00 a 0 0 0 0 0 435 8.415 116.149 4.618 1 T 8.216e+03 0.00e+00 a 0 0 0 0 0 436 7.785 117.131 4.525 1 T 3.675e+02 0.00e+00 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2.293e+03 0.00e+00 a 0 0 0 0 0 459 9.481 113.430 4.799 1 T 3.565e+03 0.00e+00 a 0 0 0 0 0 460 8.886 121.091 4.572 1 T 1.305e+03 0.00e+00 a 0 544 543 0 0 461 7.801 120.057 4.468 1 T 1.177e+03 0.00e+00 a 0 0 0 0 0 462 7.801 120.057 3.814 1 T 2.871e+03 0.00e+00 a 0 0 0 0 0 463 7.801 120.057 3.723 1 T 2.199e+03 0.00e+00 a 0 0 0 0 0 464 7.802 120.057 3.122 1 T 1.082e+03 0.00e+00 a 0 0 0 0 0 465 7.801 120.015 2.933 1 T 2.238e+03 0.00e+00 a 0 0 0 0 0 466 9.482 113.477 3.126 1 T 1.248e+03 0.00e+00 a 0 0 0 0 0 467 9.483 113.477 2.934 1 T 2.073e+03 0.00e+00 a 0 0 0 0 0 468 8.889 121.143 3.174 1 T 2.683e+02 0.00e+00 a 0 0 0 0 0 469 8.887 121.248 2.590 1 T 6.275e+02 0.00e+00 a 0 0 0 0 0 470 7.804 120.110 2.459 1 T 6.133e+02 0.00e+00 a 0 0 0 0 0 471 7.801 120.159 2.149 1 T 9.759e+02 0.00e+00 a 0 0 0 0 0 473 9.482 113.477 2.184 1 T 5.533e+02 0.00e+00 a 0 0 0 0 0 475 9.482 113.338 1.906 1 T 5.657e+02 0.00e+00 a 0 0 0 0 0 476 9.483 113.477 1.917 1 T 4.841e+02 0.00e+00 a 0 0 0 0 0 477 7.802 120.077 1.904 1 T 2.159e+03 0.00e+00 a 0 0 0 0 0 478 9.482 113.400 1.644 1 T 4.860e+02 0.00e+00 a 0 0 0 0 0 479 7.802 120.057 1.516 1 T 7.941e+02 0.00e+00 a 0 0 0 0 0 481 9.483 113.480 1.239 1 T 4.360e+02 0.00e+00 a 0 0 0 0 0 482 7.802 120.056 1.272 1 T 1.957e+03 0.00e+00 a 0 0 0 0 0 484 8.423 115.778 8.896 1 T 1.883e+03 0.00e+00 a 0 571 570 544 0 485 8.888 121.143 8.428 1 T 3.189e+02 0.00e+00 a 0 0 0 0 0 486 8.426 115.752 7.317 1 T 3.363e+03 0.00e+00 a 0 0 0 0 0 488 8.423 115.759 4.574 1 T 1.228e+03 0.00e+00 a 0 0 0 0 0 489 8.426 115.759 3.629 1 T 9.317e+02 0.00e+00 a 0 0 0 0 0 490 8.424 115.759 3.174 1 T 4.963e+02 0.00e+00 a 0 0 0 0 0 491 8.423 115.810 2.214 1 T 6.962e+02 0.00e+00 a 0 0 0 0 0 492 8.424 115.759 1.786 1 T 1.714e+03 0.00e+00 a 0 0 0 0 0 495 8.424 115.759 1.263 1 T 1.623e+03 0.00e+00 a 0 0 0 0 0 496 8.888 121.143 1.506 1 T 1.025e+03 0.00e+00 a 0 0 0 0 0 497 8.424 115.759 1.510 1 T 2.264e+03 0.00e+00 a 0 0 0 0 0 498 8.424 115.759 1.647 1 T 1.121e+03 0.00e+00 a 0 0 0 0 0 499 7.305 116.147 1.261 1 T 9.109e+02 0.00e+00 a 0 0 0 0 0 500 7.305 116.117 1.638 1 T 7.668e+02 0.00e+00 a 0 0 0 0 0 501 7.305 116.102 8.427 1 T 2.602e+03 0.00e+00 a 0 0 0 0 0 502 7.303 116.118 7.813 1 T 3.403e+02 0.00e+00 a 0 0 0 0 0 505 7.372 118.046 8.384 1 T 3.799e+02 0.00e+00 a 0 0 0 0 0 506 7.373 118.017 4.581 1 T 3.868e+02 0.00e+00 a 0 0 0 0 0 507 7.306 116.104 4.288 1 T 1.159e+03 0.00e+00 a 0 0 0 0 0 508 7.304 116.101 3.616 1 T 6.180e+02 0.00e+00 a 0 0 0 0 0 509 7.374 118.064 3.640 1 T 5.466e+02 0.00e+00 a 0 0 0 0 0 510 7.305 116.019 3.374 1 T 3.141e+02 0.00e+00 a 0 0 0 0 0 511 7.374 117.971 3.116 1 T 4.808e+02 0.00e+00 a 0 0 0 0 0 512 7.304 116.108 2.972 1 T 6.180e+02 0.00e+00 a 0 0 0 0 0 513 7.305 116.002 2.640 1 T 8.337e+02 0.00e+00 a 0 0 0 0 0 514 7.374 118.012 2.189 1 T 1.531e+03 0.00e+00 a 0 0 0 0 0 516 7.306 116.104 2.402 1 T 2.120e+03 0.00e+00 a 0 0 0 0 0 517 7.374 118.027 1.896 1 T 9.372e+02 0.00e+00 a 0 0 0 0 0 518 7.375 118.075 1.500 1 T 3.556e+02 0.00e+00 a 0 0 0 0 0 519 7.304 116.123 0.816 1 T 9.219e+02 0.00e+00 a 0 0 0 0 0 520 7.373 117.981 0.811 1 T 4.840e+02 0.00e+00 a 0 0 0 0 0 521 10.026 124.972 0.762 1 T 2.883e+02 0.00e+00 a 0 0 0 0 0 522 10.026 124.838 1.894 1 T 1.335e+03 0.00e+00 a 0 0 0 0 0 524 10.025 124.838 1.361 1 T 2.779e+02 0.00e+00 a 0 0 0 0 0 525 10.026 124.838 1.568 1 T 5.816e+02 0.00e+00 a 0 0 0 0 0 526 10.026 124.838 2.413 1 T 6.508e+02 0.00e+00 a 0 0 0 0 0 527 8.670 120.762 1.408 1 T 2.667e+03 0.00e+00 a 0 0 0 0 0 528 10.025 124.838 1.805 1 T 1.223e+03 0.00e+00 a 0 0 0 0 0 529 7.375 118.012 1.809 1 T 5.452e+02 0.00e+00 a 0 0 0 0 0 530 8.671 120.795 2.065 1 T 1.274e+03 0.00e+00 a 0 0 0 0 0 531 8.670 120.676 0.665 1 T 4.609e+02 0.00e+00 a 0 0 0 0 0 532 8.668 120.815 2.693 1 T 5.266e+02 0.00e+00 a 0 0 0 0 0 533 8.670 120.651 2.984 1 T 6.846e+02 0.00e+00 a 0 0 0 0 0 534 10.026 124.838 2.970 1 T 8.895e+02 0.00e+00 a 0 0 0 0 0 535 8.670 120.795 2.990 1 T 6.036e+02 0.00e+00 a 0 0 0 0 0 536 8.670 120.788 3.226 1 T 2.789e+03 0.00e+00 a 0 0 0 0 0 537 10.026 124.838 3.377 1 T 6.055e+02 0.00e+00 a 0 0 0 0 0 540 7.374 118.012 4.167 1 T 9.742e+02 0.00e+00 a 0 0 0 0 0 541 7.374 118.012 4.288 1 T 7.917e+02 0.00e+00 a 0 0 0 0 0 542 8.670 120.796 4.458 1 T 6.797e+03 0.00e+00 a 0 0 0 0 0 543 10.026 124.857 4.768 1 T 2.289e+03 0.00e+00 a 0 0 0 0 0 547 8.670 120.795 6.316 1 T 4.140e+02 0.00e+00 a 0 0 0 0 0 548 10.026 124.877 8.695 1 T 6.447e+02 0.00e+00 a 0 0 0 0 0 549 10.026 124.762 9.026 1 T 9.132e+02 0.00e+00 a 0 0 0 0 0 551 8.510 121.872 8.036 1 T 6.414e+02 0.00e+00 a 0 0 0 0 0 552 8.512 121.872 8.667 1 T 4.113e+02 0.00e+00 a 0 0 0 0 0 553 8.511 121.872 8.246 1 T 3.315e+02 0.00e+00 a 0 0 0 0 0 554 10.025 124.838 7.397 1 T 1.000e+03 0.00e+00 a 0 0 0 0 0 555 8.511 121.816 2.642 1 T 4.057e+02 0.00e+00 a 0 0 0 0 0 556 8.512 121.916 2.435 1 T 3.857e+02 0.00e+00 a 0 0 0 0 0 557 8.511 121.895 3.595 1 T 5.512e+02 0.00e+00 a 0 0 0 0 0 558 8.512 121.872 4.103 1 T 1.071e+03 0.00e+00 a 0 0 0 0 0 559 8.021 120.122 4.033 1 T 6.299e+03 0.00e+00 a 0 0 0 0 0 560 8.023 120.280 0.071 1 T 9.555e+02 0.00e+00 a 0 0 0 0 0 561 8.021 120.133 -0.125 1 T 7.058e+02 0.00e+00 a 0 0 0 0 0 562 8.021 120.133 0.066 1 T 6.233e+02 0.00e+00 a 0 0 0 0 0 563 8.511 121.928 0.651 1 T 6.925e+02 0.00e+00 a 0 0 0 0 0 564 8.021 120.248 0.602 1 T 3.241e+02 0.00e+00 a 0 0 0 0 0 565 8.511 121.872 0.060 1 T 2.936e+02 0.00e+00 a 0 0 0 0 0 566 8.021 120.130 1.202 1 T 3.918e+03 0.00e+00 a 0 0 0 0 0 567 8.511 121.872 1.569 1 T 1.916e+03 0.00e+00 a 0 0 0 0 0 568 8.511 121.872 1.495 1 T 1.315e+03 0.00e+00 a 0 0 0 0 0 569 8.512 121.889 1.779 1 T 1.659e+03 0.00e+00 a 0 0 0 0 0 571 8.021 120.133 2.628 1 T 5.680e+03 0.00e+00 a 0 657 656 662 0 572 8.021 120.133 2.699 1 T 2.676e+03 0.00e+00 a 0 0 0 0 0 573 8.511 121.860 4.273 1 T 6.234e+03 0.00e+00 a 0 0 0 0 0 574 8.022 120.075 4.725 1 T 1.873e+03 0.00e+00 a 0 0 0 0 0 575 8.022 120.133 4.613 1 T 1.044e+03 0.00e+00 a 0 0 0 0 0 576 8.022 120.084 8.506 1 T 2.145e+03 0.00e+00 a 0 0 0 0 0 577 8.023 120.133 8.291 1 T 7.113e+02 0.00e+00 a 0 0 0 0 0 579 8.508 117.552 8.015 1 T 3.366e+03 0.00e+00 a 0 0 0 0 0 580 8.266 121.347 8.505 1 T 8.897e+02 0.00e+00 a 0 0 0 0 0 581 8.267 121.347 8.019 1 T 3.451e+03 0.00e+00 a 0 0 0 0 0 582 8.268 121.347 8.078 1 T 3.355e+03 0.00e+00 a 0 0 0 0 0 583 8.267 121.353 7.253 1 T 7.965e+02 0.00e+00 a 0 0 0 0 0 584 8.267 121.347 7.055 1 T 4.085e+02 0.00e+00 a 0 0 0 0 0 585 8.507 117.552 7.039 1 T 1.482e+03 0.00e+00 a 0 0 0 0 0 586 8.508 117.602 6.758 1 T 3.264e+02 0.00e+00 a 0 0 0 0 0 588 8.267 121.362 4.812 1 T 8.622e+03 0.00e+00 a 0 0 0 0 0 589 8.508 117.571 4.611 1 T 3.232e+02 0.00e+00 a 0 0 0 0 0 590 8.509 117.571 4.720 1 T 6.515e+02 0.00e+00 a 0 0 0 0 0 592 8.267 121.341 4.241 1 T 5.066e+02 0.00e+00 a 0 0 0 0 0 593 8.507 117.605 4.244 1 T 1.049e+03 0.00e+00 a 0 0 0 0 0 594 8.506 117.555 4.043 1 T 8.680e+02 0.00e+00 a 0 0 0 0 0 595 8.267 121.347 3.116 1 T 6.165e+02 0.00e+00 a 0 0 0 0 0 596 8.266 121.347 2.507 1 T 3.434e+03 0.00e+00 a 0 0 0 0 0 598 8.507 117.552 2.633 1 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118.714 7.624 1 T 7.674e+02 0.00e+00 a 0 0 0 0 0 623 7.241 114.812 8.288 1 T 4.582e+02 0.00e+00 a 0 0 0 0 0 624 7.239 114.767 9.058 1 T 3.245e+02 0.00e+00 a 0 0 0 0 0 625 7.243 114.878 7.080 1 T 7.735e+02 0.00e+00 a 0 0 0 0 0 629 8.040 118.662 3.693 1 T 6.694e+02 0.00e+00 a 0 0 0 0 0 630 7.242 114.751 4.195 1 T 1.201e+03 0.00e+00 a 0 0 0 0 0 631 8.040 118.714 4.603 1 T 7.650e+02 0.00e+00 a 0 0 0 0 0 632 8.041 118.714 4.818 1 T 2.174e+03 0.00e+00 a 0 0 0 0 0 633 7.243 114.812 4.603 1 T 5.643e+02 0.00e+00 a 0 0 0 0 0 634 7.244 114.812 4.813 1 T 3.999e+02 0.00e+00 a 0 0 0 0 0 635 7.243 114.812 4.667 1 T 5.172e+02 0.00e+00 a 0 0 0 0 0 637 7.242 114.844 3.923 1 T 4.833e+02 0.00e+00 a 0 0 0 0 0 638 8.040 118.714 3.211 1 T 9.381e+02 0.00e+00 a 0 0 0 0 0 639 8.040 118.678 2.627 1 T 7.956e+02 0.00e+00 a 0 0 0 0 0 640 8.040 118.677 2.367 1 T 8.495e+02 0.00e+00 a 0 0 0 0 0 641 7.242 114.825 2.620 1 T 6.165e+02 0.00e+00 a 0 0 0 0 0 642 7.242 114.812 2.331 1 T 3.136e+02 0.00e+00 a 0 0 0 0 0 644 7.243 114.803 1.830 1 T 7.401e+03 0.00e+00 a 0 0 0 0 0 646 7.242 114.812 1.564 1 T 3.541e+02 0.00e+00 a 0 0 0 0 0 647 8.041 118.701 1.556 1 T 5.776e+02 0.00e+00 a 0 0 0 0 0 648 8.041 118.672 1.285 1 T 1.730e+03 0.00e+00 a 0 0 0 0 0 649 7.241 114.812 1.331 1 T 7.961e+02 0.00e+00 a 0 0 0 0 0 651 7.243 114.812 1.416 1 T 4.377e+02 0.00e+00 a 0 0 0 0 0 652 8.041 118.672 1.389 1 T 7.392e+02 0.00e+00 a 0 0 0 0 0 653 7.243 114.812 1.262 1 T 7.167e+02 0.00e+00 a 0 0 0 0 0 654 8.040 118.714 0.353 1 T 7.545e+02 0.00e+00 a 0 0 0 0 0 655 7.242 114.825 0.356 1 T 2.425e+03 0.00e+00 a 0 0 0 0 0 656 7.241 114.812 0.790 1 T 3.456e+02 0.00e+00 a 0 0 0 0 0 658 7.552 118.823 9.067 1 T 9.436e+02 0.00e+00 a 0 0 0 0 0 659 7.553 118.832 7.244 1 T 4.843e+03 0.00e+00 a 0 0 0 0 0 660 7.553 118.801 7.055 1 T 2.385e+03 0.00e+00 a 0 0 0 0 0 661 7.552 118.744 6.785 1 T 6.729e+02 0.00e+00 a 0 0 0 0 0 664 9.065 116.004 8.075 1 T 1.790e+03 0.00e+00 a 0 0 0 0 0 665 9.063 116.058 7.554 1 T 5.475e+02 0.00e+00 a 0 0 0 0 0 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0 0 941 8.530 120.652 2.818 1 T 1.840e+03 0.00e+00 a 0 0 0 0 0 942 8.529 120.652 2.777 1 T 1.333e+03 0.00e+00 a 0 0 0 0 0 943 8.527 120.614 2.147 1 T 8.161e+02 0.00e+00 a 0 0 0 0 0 944 8.530 120.652 1.251 1 T 7.006e+02 0.00e+00 a 0 0 0 0 0 945 8.527 120.652 0.677 1 T 1.184e+03 0.00e+00 a 0 0 0 0 0 946 8.527 120.515 0.083 1 T 9.765e+02 0.00e+00 a 0 0 0 0 0 947 8.528 120.652 0.066 1 T 7.628e+02 0.00e+00 a 0 0 0 0 0 949 8.529 120.652 9.224 1 T 2.828e+02 0.00e+00 a 0 0 0 0 0 950 9.201 122.569 8.526 1 T 4.034e+02 0.00e+00 a 0 0 0 0 0 951 9.204 122.569 9.087 1 T 9.942e+02 0.00e+00 a 0 0 0 0 0 953 9.095 126.893 8.093 1 T 6.608e+02 0.00e+00 a 0 0 0 0 0 954 9.202 122.624 7.018 1 T 5.632e+02 0.00e+00 a 0 0 0 0 0 955 9.204 122.656 6.497 1 T 4.269e+02 0.00e+00 a 0 0 0 0 0 956 9.204 122.553 6.757 1 T 1.269e+03 0.00e+00 a 0 0 0 0 0 958 9.095 126.982 6.789 1 T 8.940e+02 0.00e+00 a 0 0 0 0 0 960 9.095 126.893 7.070 1 T 6.951e+02 0.00e+00 a 0 0 0 0 0 961 9.204 122.491 5.224 1 T 1.719e+03 0.00e+00 a 0 0 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0 0 0 0 982 8.387 117.735 8.094 1 T 1.350e+03 0.00e+00 a 0 0 0 0 0 983 8.386 117.724 7.820 1 T 3.344e+03 0.00e+00 a 0 0 0 0 0 984 8.120 123.374 7.521 1 T 3.408e+02 0.00e+00 a 0 0 0 0 0 985 8.118 123.224 6.779 1 T 5.348e+02 0.00e+00 a 0 0 0 0 0 986 8.119 123.094 7.059 1 T 1.054e+03 0.00e+00 a 0 0 0 0 0 987 8.119 123.215 7.528 1 T 3.184e+02 0.00e+00 a 0 0 0 0 0 988 9.096 126.893 4.630 1 T 7.792e+02 0.00e+00 a 0 0 0 0 0 989 8.119 123.215 4.574 1 T 3.271e+03 0.00e+00 a 0 0 0 0 0 990 8.119 123.215 4.623 1 T 2.370e+03 0.00e+00 a 0 0 0 0 0 992 8.119 123.245 5.203 1 T 2.902e+03 0.00e+00 a 0 0 0 0 0 993 8.386 117.724 3.733 1 T 3.164e+03 0.00e+00 a 0 0 0 0 0 994 8.388 117.724 3.938 1 T 2.518e+03 0.00e+00 a 0 0 0 0 0 995 8.389 117.724 3.036 1 T 2.967e+02 0.00e+00 a 0 0 0 0 0 996 8.388 117.724 2.326 1 T 2.535e+03 0.00e+00 a 0 0 0 0 0 998 8.388 117.716 1.368 1 T 1.392e+03 0.00e+00 a 0 0 0 0 0 999 8.120 123.215 1.374 1 T 2.893e+03 0.00e+00 a 0 0 0 0 0 1000 8.387 117.715 0.804 1 T 4.421e+03 0.00e+00 a 0 0 0 0 0 1001 8.119 123.210 0.804 1 T 1.071e+04 0.00e+00 a 0 0 0 0 0 1002 8.119 123.215 0.391 1 T 7.021e+02 0.00e+00 a 0 0 0 0 0 1003 8.120 123.215 0.344 1 T 6.501e+02 0.00e+00 a 0 0 0 0 0 1004 8.386 117.724 0.341 1 T 4.013e+02 0.00e+00 a 0 0 0 0 0 1006 7.816 114.449 8.392 1 T 5.641e+03 0.00e+00 a 0 0 0 0 0 1008 8.403 117.740 8.024 1 T 2.879e+03 0.00e+00 a 0 0 0 0 0 1009 8.402 117.740 3.937 1 T 6.526e+03 0.00e+00 a 0 0 0 0 0 1010 8.401 117.735 4.385 1 T 1.019e+04 0.00e+00 a 0 0 0 0 0 1011 7.816 114.472 4.188 1 T 2.932e+03 0.00e+00 a 0 0 0 0 0 1012 7.817 114.472 3.732 1 T 1.085e+03 0.00e+00 a 0 0 0 0 0 1013 8.387 117.724 4.620 1 T 4.482e+02 0.00e+00 a 0 0 0 0 0 1014 7.817 114.443 1.881 1 T 1.686e+03 0.00e+00 a 0 0 0 0 0 1015 7.815 114.472 2.076 1 T 1.106e+03 0.00e+00 a 0 0 0 0 0 1016 7.816 114.472 2.325 1 T 7.236e+02 0.00e+00 a 0 0 0 0 0 1017 7.816 114.497 2.984 1 T 4.238e+02 0.00e+00 a 0 0 0 0 0 1018 7.816 114.472 1.380 1 T 1.714e+03 0.00e+00 a 0 0 0 0 0 1019 7.815 114.472 0.795 1 T 6.263e+02 0.00e+00 a 0 0 0 0 0 1020 8.388 117.724 1.676 1 T 1.161e+03 0.00e+00 a 0 0 0 0 0 1022 8.403 117.740 7.815 1 T 1.710e+03 0.00e+00 a 0 0 0 0 0 1023 8.026 119.354 8.395 1 T 2.834e+03 0.00e+00 a 0 0 0 0 0 1024 8.023 119.358 7.731 1 T 3.084e+03 0.00e+00 a 0 0 0 0 0 1025 7.722 123.171 8.015 1 T 3.026e+03 0.00e+00 a 0 0 0 0 0 1026 7.721 123.170 8.398 1 T 4.419e+02 0.00e+00 a 0 0 0 0 0 1027 7.721 123.145 4.393 1 T 4.979e+03 0.00e+00 a 0 1177 1176 1179 0 1028 8.027 119.359 4.320 1 T 3.013e+03 0.00e+00 a 0 0 0 0 0 1029 8.026 119.359 3.902 1 T 3.373e+03 0.00e+00 a 0 0 0 0 0 1030 7.720 123.170 3.935 1 T 4.447e+02 0.00e+00 a 0 0 0 0 0 1031 7.722 123.145 2.917 1 T 1.542e+03 0.00e+00 a 0 1177 1176 0 0 1032 7.721 123.174 2.780 1 T 1.876e+03 0.00e+00 a 0 1177 1176 0 0 1033 7.723 122.989 2.463 1 T 5.113e+02 0.00e+00 a 0 0 0 0 0 1034 7.722 123.170 2.483 1 T 3.500e+02 0.00e+00 a 0 0 0 0 0 1035 7.721 123.183 2.092 1 T 4.972e+02 0.00e+00 a 0 0 0 0 0 1036 7.720 123.123 1.852 1 T 7.641e+02 0.00e+00 a 0 0 0 0 0 1037 8.025 119.359 2.454 1 T 1.639e+03 0.00e+00 a 0 0 0 0 0 1038 8.026 119.359 2.329 1 T 6.960e+02 0.00e+00 a 0 0 0 0 0 1039 8.025 119.359 1.396 1 T 3.804e+02 0.00e+00 a 0 0 0 0 0 1042 7.454 112.185 2.225 1 T 3.521e+02 0.00e+00 a 0 0 0 0 0 1043 7.454 112.212 6.797 1 T 9.804e+03 0.00e+00 a 0 0 0 0 0 1044 7.454 112.212 7.454 1 T 1.319e+04 0.00e+00 a 0 0 0 0 0 1045 6.795 112.190 6.794 1 T 2.010e+04 0.00e+00 a 0 0 0 0 0 1046 6.797 112.224 7.454 1 T 1.290e+04 0.00e+00 a 0 0 0 0 0 1047 6.796 112.224 2.241 1 T 3.616e+02 0.00e+00 a 0 0 0 0 0 1048 7.112 84.374 1.517 1 T 3.030e+02 0.00e+00 a 0 0 0 0 0 1050 7.112 84.363 3.199 1 T 2.544e+02 0.00e+00 a 0 0 0 0 0 1051 7.020 112.870 7.019 1 T 1.806e+04 0.00e+00 a 0 22 21 22 0 1052 7.020 112.921 7.584 1 T 1.662e+04 0.00e+00 a 0 22 21 0 0 1053 7.585 112.921 7.019 1 T 1.604e+04 0.00e+00 a 0 23 21 0 0 1054 7.585 112.858 7.585 1 T 1.833e+04 0.00e+00 a 0 23 21 23 0 1055 7.020 112.896 2.831 1 T 1.911e+03 0.00e+00 a 0 22 21 0 0 1057 6.924 112.972 2.349 1 T 5.529e+02 0.00e+00 a 0 0 0 0 0 1058 6.923 112.972 2.508 1 T 1.208e+03 0.00e+00 a 0 0 0 0 0 1059 7.747 112.903 2.479 1 T 1.887e+03 0.00e+00 a 0 0 0 0 0 1060 7.747 112.959 2.323 1 T 9.143e+02 0.00e+00 a 0 0 0 0 0 1061 7.747 112.959 1.575 1 T 8.185e+02 0.00e+00 a 0 0 0 0 0 1062 6.924 112.939 1.810 1 T 7.842e+02 0.00e+00 a 0 0 0 0 0 1063 6.924 112.960 1.577 1 T 1.115e+03 0.00e+00 a 0 0 0 0 0 1064 7.747 112.959 1.808 1 T 1.160e+03 0.00e+00 a 0 0 0 0 0 1065 7.747 112.925 6.922 1 T 2.566e+04 0.00e+00 a 0 0 0 0 0 1066 6.923 112.932 7.749 1 T 2.374e+04 0.00e+00 a 0 0 0 0 0 1067 6.922 112.960 6.921 1 T 2.867e+04 0.00e+00 a 0 0 0 0 0 1068 7.747 112.959 7.750 1 T 2.671e+04 0.00e+00 a 0 0 0 0 0 1069 7.184 107.483 6.541 1 T 1.045e+04 0.00e+00 a 0 345 343 0 0 1070 7.184 107.489 7.183 1 T 9.606e+03 0.00e+00 a 0 0 0 0 0 1071 6.543 107.528 6.548 1 T 9.549e+03 0.00e+00 a 0 0 0 0 0 1072 6.545 107.496 7.184 1 T 8.602e+03 0.00e+00 a 0 344 343 0 0 1073 6.545 107.477 3.137 1 T 8.337e+02 0.00e+00 a 0 344 343 0 0 1074 6.545 107.475 2.669 1 T 1.126e+03 0.00e+00 a 0 344 343 0 0 1075 6.542 107.528 4.489 1 T 5.078e+02 0.00e+00 a 0 344 343 0 0 1076 7.183 107.524 2.688 1 T 1.560e+03 0.00e+00 a 0 345 343 0 0 1077 7.183 107.524 4.476 1 T 8.048e+02 0.00e+00 a 0 345 343 0 0 1078 7.185 107.524 3.136 1 T 1.276e+03 0.00e+00 a 0 345 343 0 0 1079 6.546 107.528 0.832 1 T 6.140e+02 0.00e+00 a 0 344 343 0 0 1080 7.185 107.524 0.827 1 T 5.101e+02 0.00e+00 a 0 345 343 0 0 1082 8.049 115.991 2.397 1 T 1.539e+03 0.00e+00 a 0 0 0 0 0 1083 7.339 115.227 2.392 1 T 4.469e+02 0.00e+00 a 0 0 0 0 0 1084 10.026 124.838 2.108 1 T 1.327e+03 0.00e+00 a 0 0 0 0 0 1085 9.027 119.896 1.858 1 T 4.234e+03 0.00e+00 a 0 408 407 413 0 1086 8.304 118.631 2.497 1 T 2.801e+03 0.00e+00 a 0 0 0 0 0 1087 8.049 115.991 1.815 1 T 6.310e+03 0.00e+00 a 0 0 0 0 0 1088 7.339 115.227 1.815 1 T 3.030e+03 0.00e+00 a 0 0 0 0 0 1092 8.864 120.390 4.138 1 T 4.015e+02 0.00e+00 a 0 0 0 0 0 1094 8.442 118.914 2.376 1 T 3.739e+02 0.00e+00 a 0 0 0 0 0 1095 8.440 118.800 2.830 1 T 2.329e+03 0.00e+00 a 0 0 0 0 0 1097 8.441 118.805 3.808 1 T 1.066e+03 0.00e+00 a 0 0 0 0 0 1100 8.439 118.782 4.764 1 T 1.609e+03 0.00e+00 a 0 27 26 14 0 1101 8.439 118.796 4.539 1 T 7.145e+02 0.00e+00 a 0 0 0 0 0 1102 8.439 118.661 7.142 1 T 3.207e+02 0.00e+00 a 0 0 0 0 0 1103 8.440 118.890 0.559 1 T 6.859e+02 0.00e+00 a 0 0 0 0 0 1104 8.010 122.083 2.881 1 T 7.631e+02 0.00e+00 a 0 0 0 0 0 1105 8.013 122.176 3.258 1 T 2.921e+03 0.00e+00 a 0 0 0 0 0 1106 8.010 122.134 3.792 1 T 8.668e+02 0.00e+00 a 0 0 0 0 0 1107 8.011 122.159 4.328 1 T 1.367e+03 0.00e+00 a 0 0 0 0 0 1108 8.011 121.951 4.097 1 T 4.936e+02 0.00e+00 a 0 0 0 0 0 1109 8.011 122.080 7.259 1 T 1.882e+03 0.00e+00 a 0 0 0 0 0 1110 8.010 122.119 7.622 1 T 7.725e+02 0.00e+00 a 0 0 0 0 0 1111 8.012 122.043 8.439 1 T 1.476e+03 0.00e+00 a 0 54 53 27 0 1112 8.009 122.067 0.539 1 T 6.603e+02 0.00e+00 a 0 0 0 0 0 1113 8.012 122.119 1.204 1 T 9.737e+02 0.00e+00 a 0 0 0 0 0 1115 8.006 122.059 2.128 1 T 2.809e+02 0.00e+00 a 0 0 0 0 0 1116 8.012 122.176 3.383 1 T 1.966e+03 0.00e+00 a 0 0 0 0 0 1117 8.140 119.596 7.650 1 T 9.694e+02 0.00e+00 a 0 0 0 0 0 1118 8.140 119.553 7.294 1 T 2.598e+03 0.00e+00 a 0 78 77 0 0 1119 8.139 119.590 6.990 1 T 5.855e+02 0.00e+00 a 0 0 0 0 0 1121 8.138 119.558 4.372 1 T 1.205e+03 0.00e+00 a 0 0 0 0 0 1122 8.139 119.551 4.656 1 T 2.056e+03 0.00e+00 a 0 0 0 0 0 1123 8.141 119.538 0.761 1 T 6.696e+02 0.00e+00 a 0 0 0 0 0 1124 8.137 119.510 1.201 1 T 5.587e+02 0.00e+00 a 0 0 0 0 0 1125 8.140 119.579 1.461 1 T 1.083e+03 0.00e+00 a 0 0 0 0 0 1129 8.139 119.551 2.953 1 T 2.317e+03 0.00e+00 a 0 0 0 0 0 1130 8.140 119.551 2.791 1 T 3.419e+03 0.00e+00 a 0 0 0 0 0 1131 8.140 119.526 3.266 1 T 1.423e+03 0.00e+00 a 0 0 0 0 0 1132 8.142 119.564 3.373 1 T 1.220e+03 0.00e+00 a 0 0 0 0 0 1133 8.138 119.621 3.842 1 T 4.872e+02 0.00e+00 a 0 0 0 0 0 1134 8.138 119.564 4.105 1 T 3.977e+02 0.00e+00 a 0 0 0 0 0 1137 7.311 118.239 1.492 1 T 6.475e+02 0.00e+00 a 0 0 0 0 0 1139 7.311 118.239 2.815 1 T 2.447e+02 0.00e+00 a 0 0 0 0 0 1140 7.311 118.196 7.614 1 T 3.742e+02 0.00e+00 a 0 0 0 0 0 1142 7.590 105.001 7.297 1 T 1.665e+03 0.00e+00 a 0 115 114 93 0 1143 7.591 105.156 8.137 1 T 2.615e+02 0.00e+00 a 0 0 0 0 0 1144 7.589 105.064 3.659 1 T 2.496e+03 0.00e+00 a 0 0 0 0 0 1145 7.590 105.060 4.369 1 T 8.295e+02 0.00e+00 a 0 0 0 0 0 1146 7.591 105.106 4.698 1 T 1.740e+03 0.00e+00 a 0 0 0 0 0 1147 7.591 105.112 0.499 1 T 8.894e+02 0.00e+00 a 0 0 0 0 0 1148 7.590 105.126 0.737 1 T 3.961e+02 0.00e+00 a 0 0 0 0 0 1149 7.591 105.089 1.481 1 T 1.006e+03 0.00e+00 a 0 0 0 0 0 1150 7.673 118.080 6.303 1 T 8.699e+02 0.00e+00 a 0 0 0 0 0 1151 7.673 118.146 8.781 1 T 1.057e+03 0.00e+00 a 0 122 121 0 0 1152 7.676 118.121 8.173 1 T 3.004e+02 0.00e+00 a 0 0 0 0 0 1156 7.674 118.042 4.361 1 T 1.416e+03 0.00e+00 a 0 0 0 0 0 1157 7.673 118.088 3.339 1 T 1.252e+03 0.00e+00 a 0 0 0 0 0 1158 7.672 118.073 2.525 1 T 1.351e+03 0.00e+00 a 0 0 0 0 0 1159 7.676 118.097 2.237 1 T 4.784e+02 0.00e+00 a 0 0 0 0 0 1160 7.676 118.097 2.177 1 T 4.004e+02 0.00e+00 a 0 0 0 0 0 1161 7.674 118.056 1.847 1 T 1.265e+03 0.00e+00 a 0 0 0 0 0 1162 7.673 118.174 0.515 1 T 3.882e+02 0.00e+00 a 0 0 0 0 0 1163 7.675 118.131 0.746 1 T 4.003e+02 0.00e+00 a 0 0 0 0 0 1164 7.673 117.958 1.233 1 T 1.071e+03 0.00e+00 a 0 0 0 0 0 1165 7.676 118.097 1.234 1 T 7.950e+02 0.00e+00 a 0 0 0 0 0 1166 7.675 118.097 1.413 1 T 6.429e+02 0.00e+00 a 0 0 0 0 0 1167 7.678 118.097 1.492 1 T 7.562e+02 0.00e+00 a 0 0 0 0 0 1168 7.678 118.097 3.664 1 T 5.969e+02 0.00e+00 a 0 0 0 0 0 1169 7.675 118.097 3.017 1 T 3.240e+02 0.00e+00 a 0 0 0 0 0 1170 8.767 102.445 6.326 1 T 3.708e+02 0.00e+00 a 0 0 0 0 0 1171 8.770 102.342 7.617 1 T 1.102e+03 0.00e+00 a 0 0 0 0 0 1172 8.770 102.363 3.814 1 T 1.180e+03 0.00e+00 a 0 0 0 0 0 1173 8.769 102.422 3.589 1 T 1.656e+03 0.00e+00 a 0 0 0 0 0 1174 8.768 102.492 2.485 1 T 4.862e+02 0.00e+00 a 0 0 0 0 0 1176 8.770 102.277 4.334 1 T 3.697e+02 0.00e+00 a 0 0 0 0 0 1177 7.552 126.281 4.004 1 T 1.743e+03 0.00e+00 a 0 0 0 0 0 1178 7.552 126.347 3.344 1 T 1.093e+03 0.00e+00 a 0 0 0 0 0 1179 7.552 126.305 3.605 1 T 1.272e+03 0.00e+00 a 0 0 0 0 0 1180 7.552 126.350 8.764 1 T 2.134e+03 0.00e+00 a 0 153 152 146 0 1182 7.553 126.331 8.204 1 T 2.764e+02 0.00e+00 a 0 0 0 0 0 1186 7.552 126.263 -0.140 1 T 2.198e+03 0.00e+00 a 0 0 0 0 0 1187 7.552 126.327 0.723 1 T 2.591e+03 0.00e+00 a 0 0 0 0 0 1188 7.552 126.325 0.516 1 T 1.739e+03 0.00e+00 a 0 0 0 0 0 1189 7.552 126.261 1.163 1 T 2.739e+03 0.00e+00 a 0 0 0 0 0 1190 7.552 126.285 1.604 1 T 6.377e+03 0.00e+00 a 0 0 0 0 0 1191 7.551 126.313 1.867 1 T 3.536e+02 0.00e+00 a 0 0 0 0 0 1192 7.554 126.331 1.422 1 T 5.129e+02 0.00e+00 a 0 0 0 0 0 1193 8.208 120.040 1.498 1 T 5.836e+02 0.00e+00 a 0 0 0 0 0 1194 8.206 120.040 1.764 1 T 1.530e+03 0.00e+00 a 0 0 0 0 0 1195 8.208 120.040 1.861 1 T 1.315e+03 0.00e+00 a 0 0 0 0 0 1196 8.207 120.040 2.132 1 T 2.472e+03 0.00e+00 a 0 0 0 0 0 1197 8.206 120.040 2.647 1 T 1.661e+03 0.00e+00 a 0 0 0 0 0 1198 8.207 120.058 4.087 1 T 1.331e+04 0.00e+00 a 0 190 189 176 0 1199 8.207 120.074 4.707 1 T 1.338e+03 0.00e+00 a 0 0 0 0 0 1200 8.206 120.040 4.615 1 T 6.787e+02 0.00e+00 a 0 0 0 0 0 1202 8.344 120.964 6.326 1 T 8.846e+02 0.00e+00 a 0 0 0 0 0 1204 8.346 120.946 4.032 1 T 1.485e+03 0.00e+00 a 0 0 0 0 0 1207 8.347 120.939 4.723 1 T 3.140e+03 0.00e+00 a 0 207 206 192 0 1208 8.347 120.948 2.647 1 T 3.915e+03 0.00e+00 a 0 207 206 195 0 1209 8.356 121.228 2.073 1 T 8.402e+03 0.00e+00 a 0 0 0 0 0 1210 8.353 121.014 1.820 1 T 1.479e+03 0.00e+00 a 0 0 0 0 0 1212 8.705 124.752 2.304 1 T 9.093e+02 0.00e+00 a 0 0 0 0 0 1213 8.703 124.766 2.003 1 T 5.275e+03 0.00e+00 a 0 0 0 0 0 1214 8.705 124.766 1.795 1 T 3.669e+03 0.00e+00 a 0 0 0 0 0 1215 8.705 124.747 1.553 1 T 5.259e+03 0.00e+00 a 0 0 0 0 0 1216 8.704 124.763 1.310 1 T 1.105e+03 0.00e+00 a 0 0 0 0 0 1217 8.703 124.765 0.737 1 T 1.282e+03 0.00e+00 a 0 0 0 0 0 1218 8.705 124.738 4.294 1 T 1.634e+04 0.00e+00 a 0 233 232 209 0 1219 8.705 124.763 4.470 1 T 2.404e+03 0.00e+00 a 0 0 0 0 0 1220 8.705 124.791 7.256 1 T 1.044e+03 0.00e+00 a 0 0 0 0 0 1221 8.707 124.765 8.340 1 T 8.068e+02 0.00e+00 a 0 0 0 0 0 1223 7.261 120.887 4.469 1 T 1.642e+04 0.00e+00 a 0 252 251 235 0 1224 7.262 120.892 0.686 1 T 7.577e+03 0.00e+00 a 0 0 0 0 0 1225 7.261 120.976 2.308 1 T 9.784e+02 0.00e+00 a 0 0 0 0 0 1226 7.262 120.963 2.028 1 T 3.997e+03 0.00e+00 a 0 0 0 0 0 1227 7.261 120.963 1.806 1 T 1.246e+03 0.00e+00 a 0 0 0 0 0 1228 7.261 120.967 1.548 1 T 6.357e+02 0.00e+00 a 0 0 0 0 0 1229 7.260 120.836 1.287 1 T 3.551e+02 0.00e+00 a 0 0 0 0 0 1230 7.257 120.881 2.681 1 T 3.294e+02 0.00e+00 a 0 0 0 0 0 1231 7.261 120.831 3.189 1 T 4.327e+02 0.00e+00 a 0 0 0 0 0 1232 7.261 120.876 8.352 1 T 1.835e+03 0.00e+00 a 0 252 251 270 0 1233 7.261 120.809 8.674 1 T 8.935e+02 0.00e+00 a 0 0 0 0 0 1236 9.037 125.333 7.764 1 T 5.376e+02 0.00e+00 a 0 0 0 0 0 1237 9.037 125.183 7.288 1 T 2.996e+02 0.00e+00 a 0 0 0 0 0 1239 9.038 125.303 4.302 1 T 6.606e+03 0.00e+00 a 0 296 295 272 0 1240 9.039 125.298 4.428 1 T 2.078e+03 0.00e+00 a 0 0 0 0 0 1241 9.036 125.345 4.730 1 T 4.642e+02 0.00e+00 a 0 0 0 0 0 1243 9.037 125.250 3.212 1 T 2.758e+02 0.00e+00 a 0 0 0 0 0 1244 9.038 125.279 2.940 1 T 4.242e+02 0.00e+00 a 0 0 0 0 0 1246 9.039 125.298 1.952 1 T 3.327e+03 0.00e+00 a 0 0 0 0 0 1247 9.038 125.314 1.329 1 T 1.009e+03 0.00e+00 a 0 0 0 0 0 1248 9.039 125.298 1.531 1 T 6.922e+03 0.00e+00 a 0 0 0 0 0 1249 9.038 125.296 0.823 1 T 4.328e+03 0.00e+00 a 0 0 0 0 0 1250 9.037 125.313 0.631 1 T 9.571e+02 0.00e+00 a 0 0 0 0 0 1252 8.866 120.328 2.832 1 T 3.207e+02 0.00e+00 a 0 12 11 17 0 1253 8.866 120.328 2.880 1 T 4.125e+02 0.00e+00 a 0 12 11 16 0 1254 8.440 118.800 2.878 1 T 1.679e+03 0.00e+00 a 0 0 0 0 0 1258 8.012 122.043 8.136 1 T 1.575e+03 0.00e+00 a 0 54 53 78 0 1259 8.442 118.879 1.391 1 T 2.495e+03 0.00e+00 a 0 0 0 0 0 1262 8.207 120.040 2.729 1 T 8.988e+02 0.00e+00 a 0 0 0 0 0 1263 8.347 120.939 2.723 1 T 3.865e+03 0.00e+00 a 0 0 0 0 0 1265 8.344 120.948 0.088 1 T 4.696e+02 0.00e+00 a 0 0 0 0 0 1267 8.351 121.154 1.290 1 T 2.976e+03 0.00e+00 a 0 0 0 0 0 1268 8.347 120.939 4.294 1 T 2.395e+03 0.00e+00 a 0 207 206 209 0 1269 8.358 121.137 4.462 1 T 2.716e+03 0.00e+00 a 0 270 269 254 0 1271 7.261 120.892 1.858 1 T 1.071e+03 0.00e+00 a 0 0 0 0 0 1272 7.261 120.892 2.077 1 T 2.238e+03 0.00e+00 a 0 0 0 0 0 1273 8.705 124.765 1.862 1 T 2.139e+03 0.00e+00 a 0 0 0 0 0 1274 8.704 124.765 2.085 1 T 3.584e+03 0.00e+00 a 0 0 0 0 0 1275 7.854 113.211 0.754 1 T 6.854e+02 0.00e+00 a 0 0 0 0 0 1276 7.854 113.144 1.363 1 T 5.732e+02 0.00e+00 a 0 0 0 0 0 1277 7.853 113.210 1.636 1 T 5.185e+02 0.00e+00 a 0 0 0 0 0 1278 7.853 113.184 1.862 1 T 4.910e+02 0.00e+00 a 0 0 0 0 0 1279 7.854 113.164 2.109 1 T 1.661e+03 0.00e+00 a 0 0 0 0 0 1280 7.854 113.113 2.328 1 T 2.591e+03 0.00e+00 a 0 0 0 0 0 1281 7.854 113.255 4.418 1 T 3.986e+02 0.00e+00 a 0 0 0 0 0 1282 6.859 113.267 4.399 1 T 3.367e+02 0.00e+00 a 0 0 0 0 0 1283 7.854 113.161 6.857 1 T 1.857e+04 0.00e+00 a 0 248 246 247 0 1284 6.858 113.164 7.854 1 T 1.802e+04 0.00e+00 a 0 247 246 248 0 1285 6.858 113.177 0.756 1 T 6.613e+02 0.00e+00 a 0 0 0 0 0 1286 6.857 113.217 1.387 1 T 4.375e+02 0.00e+00 a 0 0 0 0 0 1288 6.858 113.079 1.876 1 T 3.718e+02 0.00e+00 a 0 0 0 0 0 1289 6.858 113.090 2.124 1 T 1.477e+03 0.00e+00 a 0 0 0 0 0 1291 6.862 113.087 2.333 1 T 1.500e+03 0.00e+00 a 0 0 0 0 0 1292 6.860 113.087 1.634 1 T 3.893e+02 0.00e+00 a 0 0 0 0 0 1293 7.261 120.892 4.453 1 T 1.642e+04 0.00e+00 a 0 252 251 254 0 1294 9.038 125.303 1.428 1 T 6.141e+03 0.00e+00 a 0 0 0 0 0 1295 8.358 121.137 0.637 1 T 4.565e+03 0.00e+00 a 0 0 0 0 0 1296 7.263 120.892 0.763 1 T 2.612e+03 0.00e+00 a 0 0 0 0 0 1297 8.355 121.145 9.017 1 T 1.209e+03 0.00e+00 a 0 270 269 296 0 1298 8.353 120.943 4.949 1 T 5.548e+02 0.00e+00 a 0 0 0 0 0 1299 8.357 121.137 4.306 1 T 2.923e+03 0.00e+00 a 0 270 269 272 0 1300 9.037 125.299 3.686 1 T 1.123e+03 0.00e+00 a 0 0 0 0 0 1302 7.020 112.896 2.880 1 T 1.449e+03 0.00e+00 a 0 0 0 0 0 1303 7.584 112.931 2.829 1 T 2.621e+03 0.00e+00 a 0 0 0 0 0 1304 7.584 112.931 2.878 1 T 2.390e+03 0.00e+00 a 0 23 21 16 0 1305 6.780 112.919 2.149 1 T 1.016e+03 0.00e+00 a 0 370 369 0 0 1307 7.441 112.949 6.789 1 T 4.228e+04 0.00e+00 a 0 371 369 0 0 1308 6.780 112.991 7.439 1 T 3.543e+04 0.00e+00 a 0 370 369 0 0 1309 7.440 112.947 2.149 1 T 1.607e+03 0.00e+00 a 0 371 369 0 0 1310 7.439 112.951 1.919 1 T 4.287e+02 0.00e+00 a 0 0 0 0 0 1312 6.925 112.972 2.388 1 T 7.115e+02 0.00e+00 a 0 0 0 0 0 1314 8.439 118.806 1.620 1 T 4.748e+02 0.00e+00 a 0 0 0 0 0 1315 8.012 122.149 1.467 1 T 6.931e+02 0.00e+00 a 0 0 0 0 0 1316 8.014 122.149 1.394 1 T 8.273e+02 0.00e+00 a 0 0 0 0 0 1317 6.975 111.603 2.787 1 T 9.119e+02 0.00e+00 a 0 0 0 0 0 1318 6.975 111.539 4.646 1 T 3.055e+02 0.00e+00 a 0 0 0 0 0 1319 6.975 111.603 2.934 1 T 6.473e+02 0.00e+00 a 0 0 0 0 0 1320 6.976 111.602 7.683 1 T 1.377e+04 0.00e+00 a 0 0 0 0 0 1321 6.972 111.580 8.157 1 T 3.796e+02 0.00e+00 a 0 0 0 0 0 1322 7.680 111.559 8.159 1 T 4.147e+02 0.00e+00 a 0 0 0 0 0 1323 7.680 111.601 6.977 1 T 1.453e+04 0.00e+00 a 0 0 0 0 0 1324 6.977 111.608 9.927 1 T 3.683e+02 0.00e+00 a 0 0 0 0 0 1325 7.680 111.567 4.641 1 T 4.455e+02 0.00e+00 a 0 0 0 0 0 1326 7.683 111.567 2.929 1 T 8.279e+02 0.00e+00 a 0 0 0 0 0 1327 7.681 111.567 2.786 1 T 1.048e+03 0.00e+00 a 0 0 0 0 0 1328 7.311 118.091 4.647 1 T 4.187e+02 0.00e+00 a 0 0 0 0 0 1329 7.310 118.251 8.139 1 T 4.470e+02 0.00e+00 a 0 93 92 0 0 1330 8.441 118.879 8.006 1 T 8.410e+02 0.00e+00 a 0 0 0 0 0 1331 9.037 125.306 8.337 1 T 2.097e+03 0.00e+00 a 0 0 0 0 0 1332 7.551 126.281 3.889 1 T 1.482e+03 0.00e+00 a 0 0 0 0 0 1333 8.347 120.939 1.563 1 T 1.004e+04 0.00e+00 a 0 207 206 211 0 1334 8.346 120.939 1.311 1 T 1.974e+03 0.00e+00 a 0 0 0 0 0 1335 8.345 120.939 0.735 1 T 2.058e+03 0.00e+00 a 0 0 0 0 0 1338 8.356 121.137 1.561 1 T 1.318e+04 0.00e+00 a 0 0 0 0 0 1339 9.039 125.298 1.572 1 T 6.214e+03 0.00e+00 a 0 0 0 0 0 1340 8.686 123.220 1.871 1 T 3.632e+03 0.00e+00 a 0 0 0 0 0 1341 8.888 121.143 1.786 1 T 7.386e+02 0.00e+00 a 0 0 0 0 0 1342 8.424 115.759 1.926 1 T 2.741e+03 0.00e+00 a 0 0 0 0 0 1343 8.887 121.143 1.973 1 T 1.109e+03 0.00e+00 a 0 0 0 0 0 1345 8.423 115.759 2.676 1 T 2.508e+03 0.00e+00 a 0 0 0 0 0 1346 8.886 121.143 1.922 1 T 1.523e+03 0.00e+00 a 0 0 0 0 0 1347 8.423 115.759 2.474 1 T 1.901e+03 0.00e+00 a 0 0 0 0 0 1348 8.423 115.759 2.555 1 T 3.327e+03 0.00e+00 a 0 0 0 0 0 1351 7.375 118.008 10.010 1 T 2.782e+02 0.00e+00 a 0 0 0 0 0 1352 8.670 120.762 1.314 1 T 2.351e+03 0.00e+00 a 0 0 0 0 0 1353 8.021 120.157 2.608 1 T 6.286e+03 0.00e+00 a 0 0 0 0 0 1355 7.306 107.092 3.617 1 T 3.001e+03 0.00e+00 a 0 0 0 0 0 1356 8.302 118.631 7.313 1 T 2.583e+02 0.00e+00 a 0 0 0 0 0 1357 8.303 118.631 8.698 1 T 2.521e+02 0.00e+00 a 0 0 0 0 0 1358 7.720 109.081 3.449 1 T 3.957e+03 0.00e+00 a 0 0 0 0 0 1359 7.720 109.081 3.778 1 T 4.400e+03 0.00e+00 a 0 0 0 0 0 1360 6.490 105.224 3.789 1 T 1.317e+03 0.00e+00 a 0 0 0 0 0 1361 8.372 118.274 2.769 1 T 6.094e+03 0.00e+00 a 0 0 0 0 0 1363 8.964 119.318 0.719 1 T 2.289e+03 0.00e+00 a 0 0 0 0 0 1364 8.414 124.181 0.654 1 T 2.098e+03 0.00e+00 a 0 0 0 0 0 1365 8.414 124.181 3.063 1 T 6.331e+02 0.00e+00 a 0 0 0 0 0 1366 8.352 120.913 8.629 1 T 9.908e+02 0.00e+00 a 0 0 0 0 0 1367 8.357 120.918 2.819 1 T 2.230e+03 0.00e+00 a 0 0 0 0 0 1368 8.600 117.992 5.384 1 T 5.918e+03 0.00e+00 a 0 0 0 0 0 1369 8.528 120.652 0.736 1 T 9.993e+02 0.00e+00 a 0 0 0 0 0 1370 8.529 120.652 1.338 1 T 1.283e+03 0.00e+00 a 0 0 0 0 0 1371 8.528 120.652 0.626 1 T 1.014e+03 0.00e+00 a 0 0 0 0 0 1372 9.204 122.515 0.672 1 T 2.182e+03 0.00e+00 a 0 0 0 0 0 1373 9.953 128.346 6.659 1 T 6.968e+03 0.00e+00 a 0 0 0 0 0 1374 9.952 128.370 7.173 1 T 3.412e+03 0.00e+00 a 0 864 859 0 0 1375 9.952 128.440 3.832 1 T 2.583e+03 0.00e+00 a 0 0 0 0 0 1376 9.952 128.422 1.407 1 T 2.756e+03 0.00e+00 a 0 0 0 0 0 1377 9.954 128.404 2.986 1 T 8.985e+02 0.00e+00 a 0 0 0 0 0 1383 10.162 129.405 7.248 1 T 5.929e+03 0.00e+00 a 0 71 66 67 0 1384 10.161 129.405 6.330 1 T 5.089e+02 0.00e+00 a 0 0 0 0 0 1385 10.162 129.405 6.560 1 T 3.965e+02 0.00e+00 a 0 0 0 0 0 1386 10.161 129.288 7.450 1 T 1.368e+03 0.00e+00 a 0 0 0 0 0 1387 10.159 129.405 3.390 1 T 3.571e+02 0.00e+00 a 0 0 0 0 0 1389 10.161 129.477 10.534 1 T 3.984e+02 0.00e+00 a 0 0 0 0 0 1390 8.441 118.887 7.726 1 T 2.825e+02 0.00e+00 a 0 0 0 0 0 1391 8.300 121.241 3.007 1 T 1.246e+03 0.00e+00 a 0 0 0 0 0 1392 7.305 116.104 2.141 1 T 5.884e+03 0.00e+00 a 0 0 0 0 0 ; 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 HN . . 14 ppm . . . 4.771 . . 30352 3 2 . . N 15 N . . 34 ppm . . . 110 . . 30352 3 3 . . H 1 H . . 14 ppm . . . 4.771 . . 30352 3 stop_ save_