data_34258 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34258 _Entry.Title ; Solution structure of FUS-ZnF bound to UGGUG ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-04-10 _Entry.Accession_date 2018-04-10 _Entry.Last_release_date 2019-03-13 _Entry.Original_release_date 2019-03-13 _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_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34258 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 F. Loughlin F. E. . . 34258 2 F. Allain F. H.-T. . . 34258 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'RNA BINDING PROTEIN' . 34258 'RNA zinc finger RNA binding protein zinc ribbon' . 34258 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 34258 spectral_peak_list 3 34258 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 155 34258 '15N chemical shifts' 47 34258 '1H chemical shifts' 297 34258 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2019-03-15 . original BMRB . 34258 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6G99 . 34258 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34258 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1016/j.molcel.2018.11.012 _Citation.PubMed_ID 30581145 _Citation.Full_citation . _Citation.Title ; The Solution Structure of FUS Bound to RNA Reveals a Bipartite Mode of RNA Recognition with Both Sequence and Shape Specificity. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Mol. Cell' _Citation.Journal_name_full . _Citation.Journal_volume 73 _Citation.Journal_issue 3 _Citation.Journal_ASTM MOCEFL _Citation.Journal_ISSN 1097-4164 _Citation.Journal_CSD 2168 _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 490 _Citation.Page_last 504 _Citation.Year 2019 _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 F. Loughlin F. E. . . 34258 1 2 P. Lukavsky P. J. . . 34258 1 3 T. Kazeeva T. . . . 34258 1 4 S. Reber S. . . . 34258 1 5 E. Hock E. M. . . 34258 1 6 M. Colombo M. . . . 34258 1 7 C. 'Von Schroetter' C. . . . 34258 1 8 P. Pauli P. . . . 34258 1 9 A. Clery A. . . . 34258 1 10 O. Muhlemann O. . . . 34258 1 11 M. Polymenidou M. . . . 34258 1 12 M. Ruepp M. D. . . 34258 1 13 F. Allain F. H. . . 34258 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34258 _Assembly.ID 1 _Assembly.Name 'RNA-binding protein FUS/RNA Complex' _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 B yes . . . . . . 34258 1 2 entity_2 2 $entity_2 B A yes . . . . . . 34258 1 3 entity_3 3 $entity_ZN C B no . . . . . . 34258 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 coordination single . 1 . 1 CYS 15 15 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34258 1 2 coordination single . 1 . 1 CYS 20 20 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34258 1 3 coordination single . 1 . 1 CYS 31 31 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34258 1 4 coordination single . 1 . 1 CYS 34 34 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34258 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34258 _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 B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSGQQRAGDWKCPNPTC ENMNFSWRNECNQCKAPKPD G ; _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 41 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all other bound' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4528.011 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID '75 kDa DNA-pairing protein' na 34258 1 'Oncogene FUS' na 34258 1 'Oncogene TLS' na 34258 1 POMp75 na 34258 1 'Translocated in liposarcoma protein' na 34258 1 stop_ 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 1 414 GLY . 34258 1 2 415 PRO . 34258 1 3 416 LEU . 34258 1 4 417 GLY . 34258 1 5 418 SER . 34258 1 6 419 GLY . 34258 1 7 420 GLN . 34258 1 8 421 GLN . 34258 1 9 422 ARG . 34258 1 10 423 ALA . 34258 1 11 424 GLY . 34258 1 12 425 ASP . 34258 1 13 426 TRP . 34258 1 14 427 LYS . 34258 1 15 428 CYS . 34258 1 16 429 PRO . 34258 1 17 430 ASN . 34258 1 18 431 PRO . 34258 1 19 432 THR . 34258 1 20 433 CYS . 34258 1 21 434 GLU . 34258 1 22 435 ASN . 34258 1 23 436 MET . 34258 1 24 437 ASN . 34258 1 25 438 PHE . 34258 1 26 439 SER . 34258 1 27 440 TRP . 34258 1 28 441 ARG . 34258 1 29 442 ASN . 34258 1 30 443 GLU . 34258 1 31 444 CYS . 34258 1 32 445 ASN . 34258 1 33 446 GLN . 34258 1 34 447 CYS . 34258 1 35 448 LYS . 34258 1 36 449 ALA . 34258 1 37 450 PRO . 34258 1 38 451 LYS . 34258 1 39 452 PRO . 34258 1 40 453 ASP . 34258 1 41 454 GLY . 34258 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 . GLY 1 1 34258 1 . PRO 2 2 34258 1 . LEU 3 3 34258 1 . GLY 4 4 34258 1 . SER 5 5 34258 1 . GLY 6 6 34258 1 . GLN 7 7 34258 1 . GLN 8 8 34258 1 . ARG 9 9 34258 1 . ALA 10 10 34258 1 . GLY 11 11 34258 1 . ASP 12 12 34258 1 . TRP 13 13 34258 1 . LYS 14 14 34258 1 . CYS 15 15 34258 1 . PRO 16 16 34258 1 . ASN 17 17 34258 1 . PRO 18 18 34258 1 . THR 19 19 34258 1 . CYS 20 20 34258 1 . GLU 21 21 34258 1 . ASN 22 22 34258 1 . MET 23 23 34258 1 . ASN 24 24 34258 1 . PHE 25 25 34258 1 . SER 26 26 34258 1 . TRP 27 27 34258 1 . ARG 28 28 34258 1 . ASN 29 29 34258 1 . GLU 30 30 34258 1 . CYS 31 31 34258 1 . ASN 32 32 34258 1 . GLN 33 33 34258 1 . CYS 34 34 34258 1 . LYS 35 35 34258 1 . ALA 36 36 34258 1 . PRO 37 37 34258 1 . LYS 38 38 34258 1 . PRO 39 39 34258 1 . ASP 40 40 34258 1 . GLY 41 41 34258 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34258 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; UGGUG ; _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 5 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1602.992 _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 . U . 34258 2 2 . G . 34258 2 3 . G . 34258 2 4 . U . 34258 2 5 . G . 34258 2 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 . U 1 1 34258 2 . G 2 2 34258 2 . G 3 3 34258 2 . U 4 4 34258 2 . G 5 5 34258 2 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 34258 _Entity.ID 3 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 34258 3 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 34258 3 ZN 'Three letter code' 34258 3 stop_ 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 1 ZN $chem_comp_ZN 34258 3 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 34258 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'FUS, TLS' . 34258 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 34258 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 34258 _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 . . . . . . . . . . 34258 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . 34258 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 34258 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 34258 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 34258 ZN [Zn++] SMILES CACTVS 3.341 34258 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 34258 ZN [Zn+2] SMILES ACDLabs 10.04 34258 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 34258 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 34258 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 34258 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 34258 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 34258 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34258 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8 mM [U-99% 13C; U-99% 15N] FUS-ZnF, 1.0 mM RNA (5'-R(*UP*GP*GP*UP*G)-3'), 20 mM sodium phosphate, 1 mM beta-mercaptoethanol, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FUS-ZnF '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.8 . . mM . . . . 34258 1 2 "RNA (5'-R(*UP*GP*GP*UP*G)-3')" 'natural abundance' . . 2 $entity_2 . . 1.0 . . mM . . . . 34258 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34258 1 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 34258 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34258 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8 mM [U-99% 13C; U-99% 15N] FUS-ZnF, 1.0 mM RNA (5'-R(*UP*GP*GP*UP*G)-3'), 20 mM sodium phosphate, 1 mM beta-mercaptoethanol, 100% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FUS-ZnF '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.8 . . mM . . . . 34258 2 2 "RNA (5'-R(*UP*GP*GP*UP*G)-3')" 'natural abundance' . . 2 $entity_2 . . 1.0 . . mM . . . . 34258 2 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34258 2 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 34258 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 34258 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.0 mM [U-99% 15N] FUS-ZnF, 0.9 mM RNA (5'-R(*UP*GP*GP*UP*G)-3'), 20 mM sodium phosphate, 1 mM beta-mercaptoethanol, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FUS-ZnF '[U-99% 15N]' . . 1 $entity_1 . . 1.0 . . mM . . . . 34258 3 2 "RNA (5'-R(*UP*GP*GP*UP*G)-3')" 'natural abundance' . . 2 $entity_2 . . 0.9 . . mM . . . . 34258 3 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34258 3 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 34258 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 34258 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.0 mM [U-99% 13C; U-99% 15N] FUS-ZnF, 0.9 mM RNA (5'-R(*UP*GP*GP*UP*G)-3'), 20 mM sodium phosphate, 1 mM beta-mercaptoethanol, 100% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FUS-ZnF '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1.0 . . mM . . . . 34258 4 2 "RNA (5'-R(*UP*GP*GP*UP*G)-3')" 'natural abundance' . . 2 $entity_2 . . 0.9 . . mM . . . . 34258 4 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34258 4 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 34258 4 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 34258 _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 34258 1 pH 6.5 . pH 34258 1 pressure 1 . Pa 34258 1 temperature 303 0.5 K 34258 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 34258 _Sample_condition_list.ID 2 _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 34258 2 pH 6.5 . pH 34258 2 pressure 1 . Pa 34258 2 temperature 278 0.5 K 34258 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34258 _Software.ID 1 _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' . . 34258 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 34258 1 processing 34258 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34258 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 34258 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 34258 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34258 _Software.ID 3 _Software.Type . _Software.Name CANDID _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 34258 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 34258 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34258 _Software.ID 4 _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' . . 34258 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 34258 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 34258 _Software.ID 5 _Software.Type . _Software.Name AMBER _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 34258 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 34258 5 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 34258 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34258 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 34258 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 34258 _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 Avance . 900 . . . 34258 1 2 NMR_spectrometer_2 Bruker AvanceIII . 700 . . . 34258 1 3 NMR_spectrometer_3 Bruker AvanceIII . 600 . . . 34258 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 34258 _Experiment_list.ID 1 _Experiment_list.Details NULL 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 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34258 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34258 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34258 1 4 '2D 13C F2-filtered NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 34258 1 5 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34258 1 6 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34258 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 34258 _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 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.25144953 . . . . . 34258 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 external direct 1.0 . . . . . 34258 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.10132912 . . . . . 34258 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 34258 _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 '3D 1H-13C NOESY aliphatic' . . . 34258 1 2 '3D 1H-15N NOESY' . . . 34258 1 3 '2D 1H-1H NOESY' . . . 34258 1 4 '2D 13C F2-filtered NOESY' . . . 34258 1 5 '2D 1H-13C HSQC aliphatic' . . . 34258 1 6 '2D 1H-13C HSQC aromatic' . . . 34258 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 GLY H H 1 8.252 0.000 . 1 . . . . B 414 GLY H1 . 34258 1 2 . 1 1 1 1 GLY HA2 H 1 3.984 0.001 . 2 . . . . B 414 GLY HA2 . 34258 1 3 . 1 1 1 1 GLY HA3 H 1 3.937 0.001 . 2 . . . . B 414 GLY HA3 . 34258 1 4 . 1 1 1 1 GLY CA C 13 43.427 0.003 . 1 . . . . B 414 GLY CA . 34258 1 5 . 1 1 1 1 GLY N N 15 107.987 0.000 . 1 . . . . B 414 GLY N . 34258 1 6 . 1 1 2 2 PRO HA H 1 4.454 0.001 . 1 . . . . B 415 PRO HA . 34258 1 7 . 1 1 2 2 PRO HB2 H 1 2.276 0.000 . 2 . . . . B 415 PRO HB2 . 34258 1 8 . 1 1 2 2 PRO HB3 H 1 2.276 0.000 . 2 . . . . B 415 PRO HB3 . 34258 1 9 . 1 1 2 2 PRO HG2 H 1 1.981 0.002 . 2 . . . . B 415 PRO HG2 . 34258 1 10 . 1 1 2 2 PRO HG3 H 1 1.948 0.002 . 2 . . . . B 415 PRO HG3 . 34258 1 11 . 1 1 2 2 PRO HD2 H 1 3.546 0.004 . 2 . . . . B 415 PRO HD2 . 34258 1 12 . 1 1 2 2 PRO HD3 H 1 3.514 0.003 . 2 . . . . B 415 PRO HD3 . 34258 1 13 . 1 1 2 2 PRO CA C 13 63.064 0.139 . 1 . . . . B 415 PRO CA . 34258 1 14 . 1 1 2 2 PRO CB C 13 32.404 0.000 . 1 . . . . B 415 PRO CB . 34258 1 15 . 1 1 2 2 PRO CG C 13 26.943 0.000 . 1 . . . . B 415 PRO CG . 34258 1 16 . 1 1 2 2 PRO CD C 13 49.656 0.020 . 1 . . . . B 415 PRO CD . 34258 1 17 . 1 1 3 3 LEU H H 1 8.410 0.004 . 1 . . . . B 416 LEU H . 34258 1 18 . 1 1 3 3 LEU HA H 1 4.343 0.002 . 1 . . . . B 416 LEU HA . 34258 1 19 . 1 1 3 3 LEU HB2 H 1 1.618 0.000 . 2 . . . . B 416 LEU HB2 . 34258 1 20 . 1 1 3 3 LEU HB3 H 1 1.538 0.001 . 2 . . . . B 416 LEU HB3 . 34258 1 21 . 1 1 3 3 LEU HG H 1 1.590 0.001 . 1 . . . . B 416 LEU HG . 34258 1 22 . 1 1 3 3 LEU HD11 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD11 . 34258 1 23 . 1 1 3 3 LEU HD12 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD12 . 34258 1 24 . 1 1 3 3 LEU HD13 H 1 0.876 0.000 . 2 . . . . B 416 LEU HD13 . 34258 1 25 . 1 1 3 3 LEU HD21 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD21 . 34258 1 26 . 1 1 3 3 LEU HD22 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD22 . 34258 1 27 . 1 1 3 3 LEU HD23 H 1 0.851 0.008 . 2 . . . . B 416 LEU HD23 . 34258 1 28 . 1 1 3 3 LEU CA C 13 55.209 0.017 . 1 . . . . B 416 LEU CA . 34258 1 29 . 1 1 3 3 LEU CB C 13 42.534 0.070 . 1 . . . . B 416 LEU CB . 34258 1 30 . 1 1 3 3 LEU CG C 13 27.145 0.082 . 1 . . . . B 416 LEU CG . 34258 1 31 . 1 1 3 3 LEU CD1 C 13 25.107 0.010 . 2 . . . . B 416 LEU CD1 . 34258 1 32 . 1 1 3 3 LEU CD2 C 13 23.633 0.003 . 2 . . . . B 416 LEU CD2 . 34258 1 33 . 1 1 3 3 LEU N N 15 121.829 0.006 . 1 . . . . B 416 LEU N . 34258 1 34 . 1 1 4 4 GLY H H 1 8.388 0.002 . 1 . . . . B 417 GLY H . 34258 1 35 . 1 1 4 4 GLY HA2 H 1 3.966 0.002 . 2 . . . . B 417 GLY HA2 . 34258 1 36 . 1 1 4 4 GLY HA3 H 1 3.966 0.002 . 2 . . . . B 417 GLY HA3 . 34258 1 37 . 1 1 4 4 GLY CA C 13 45.230 0.000 . 1 . . . . B 417 GLY CA . 34258 1 38 . 1 1 4 4 GLY N N 15 109.939 0.001 . 1 . . . . B 417 GLY N . 34258 1 39 . 1 1 5 5 SER H H 1 8.311 0.000 . 1 . . . . B 418 SER H . 34258 1 40 . 1 1 5 5 SER HA H 1 4.378 0.001 . 1 . . . . B 418 SER HA . 34258 1 41 . 1 1 5 5 SER HB2 H 1 3.899 0.003 . 2 . . . . B 418 SER HB2 . 34258 1 42 . 1 1 5 5 SER HB3 H 1 3.845 0.002 . 2 . . . . B 418 SER HB3 . 34258 1 43 . 1 1 5 5 SER CA C 13 58.889 0.005 . 1 . . . . B 418 SER CA . 34258 1 44 . 1 1 5 5 SER CB C 13 63.775 0.027 . 1 . . . . B 418 SER CB . 34258 1 45 . 1 1 5 5 SER N N 15 115.903 0.013 . 1 . . . . B 418 SER N . 34258 1 46 . 1 1 6 6 GLY H H 1 8.498 0.002 . 1 . . . . B 419 GLY H . 34258 1 47 . 1 1 6 6 GLY HA2 H 1 3.957 0.001 . 2 . . . . B 419 GLY HA2 . 34258 1 48 . 1 1 6 6 GLY HA3 H 1 3.957 0.001 . 2 . . . . B 419 GLY HA3 . 34258 1 49 . 1 1 6 6 GLY CA C 13 45.514 0.000 . 1 . . . . B 419 GLY CA . 34258 1 50 . 1 1 6 6 GLY N N 15 110.841 0.005 . 1 . . . . B 419 GLY N . 34258 1 51 . 1 1 7 7 GLN H H 1 8.087 0.001 . 1 . . . . B 420 GLN H . 34258 1 52 . 1 1 7 7 GLN HA H 1 4.347 0.003 . 1 . . . . B 420 GLN HA . 34258 1 53 . 1 1 7 7 GLN HB2 H 1 2.109 0.001 . 2 . . . . B 420 GLN HB2 . 34258 1 54 . 1 1 7 7 GLN HB3 H 1 1.938 0.002 . 2 . . . . B 420 GLN HB3 . 34258 1 55 . 1 1 7 7 GLN HG2 H 1 2.288 0.002 . 2 . . . . B 420 GLN HG2 . 34258 1 56 . 1 1 7 7 GLN HG3 H 1 2.288 0.002 . 2 . . . . B 420 GLN HG3 . 34258 1 57 . 1 1 7 7 GLN HE21 H 1 7.487 0.010 . 2 . . . . B 420 GLN HE21 . 34258 1 58 . 1 1 7 7 GLN HE22 H 1 6.835 0.001 . 2 . . . . B 420 GLN HE22 . 34258 1 59 . 1 1 7 7 GLN CA C 13 55.635 0.031 . 1 . . . . B 420 GLN CA . 34258 1 60 . 1 1 7 7 GLN CB C 13 29.869 0.070 . 1 . . . . B 420 GLN CB . 34258 1 61 . 1 1 7 7 GLN CG C 13 33.837 0.080 . 1 . . . . B 420 GLN CG . 34258 1 62 . 1 1 7 7 GLN N N 15 119.264 0.007 . 1 . . . . B 420 GLN N . 34258 1 63 . 1 1 7 7 GLN NE2 N 15 112.333 0.011 . 1 . . . . B 420 GLN NE2 . 34258 1 64 . 1 1 8 8 GLN H H 1 8.250 0.002 . 1 . . . . B 421 GLN H . 34258 1 65 . 1 1 8 8 GLN HA H 1 4.316 0.002 . 1 . . . . B 421 GLN HA . 34258 1 66 . 1 1 8 8 GLN HB2 H 1 2.021 0.002 . 2 . . . . B 421 GLN HB2 . 34258 1 67 . 1 1 8 8 GLN HB3 H 1 1.974 0.004 . 2 . . . . B 421 GLN HB3 . 34258 1 68 . 1 1 8 8 GLN HG2 H 1 2.381 0.002 . 2 . . . . B 421 GLN HG2 . 34258 1 69 . 1 1 8 8 GLN HG3 H 1 2.329 0.007 . 2 . . . . B 421 GLN HG3 . 34258 1 70 . 1 1 8 8 GLN HE21 H 1 7.511 0.001 . 2 . . . . B 421 GLN HE21 . 34258 1 71 . 1 1 8 8 GLN HE22 H 1 6.764 0.000 . 2 . . . . B 421 GLN HE22 . 34258 1 72 . 1 1 8 8 GLN CA C 13 56.038 0.005 . 1 . . . . B 421 GLN CA . 34258 1 73 . 1 1 8 8 GLN CB C 13 29.930 0.067 . 1 . . . . B 421 GLN CB . 34258 1 74 . 1 1 8 8 GLN CG C 13 33.835 0.083 . 1 . . . . B 421 GLN CG . 34258 1 75 . 1 1 8 8 GLN N N 15 121.714 0.002 . 1 . . . . B 421 GLN N . 34258 1 76 . 1 1 8 8 GLN NE2 N 15 111.523 0.008 . 1 . . . . B 421 GLN NE2 . 34258 1 77 . 1 1 9 9 ARG H H 1 8.633 0.002 . 1 . . . . B 422 ARG H . 34258 1 78 . 1 1 9 9 ARG HA H 1 4.495 0.064 . 1 . . . . B 422 ARG HA . 34258 1 79 . 1 1 9 9 ARG HB2 H 1 1.824 0.006 . 2 . . . . B 422 ARG HB2 . 34258 1 80 . 1 1 9 9 ARG HB3 H 1 1.682 0.004 . 2 . . . . B 422 ARG HB3 . 34258 1 81 . 1 1 9 9 ARG HG2 H 1 1.520 0.003 . 2 . . . . B 422 ARG HG2 . 34258 1 82 . 1 1 9 9 ARG HG3 H 1 1.486 0.001 . 2 . . . . B 422 ARG HG3 . 34258 1 83 . 1 1 9 9 ARG HD2 H 1 2.942 0.002 . 2 . . . . B 422 ARG HD2 . 34258 1 84 . 1 1 9 9 ARG HD3 H 1 2.503 0.003 . 2 . . . . B 422 ARG HD3 . 34258 1 85 . 1 1 9 9 ARG CA C 13 55.236 0.607 . 1 . . . . B 422 ARG CA . 34258 1 86 . 1 1 9 9 ARG CB C 13 32.940 0.037 . 1 . . . . B 422 ARG CB . 34258 1 87 . 1 1 9 9 ARG CG C 13 26.848 0.062 . 1 . . . . B 422 ARG CG . 34258 1 88 . 1 1 9 9 ARG CD C 13 43.644 0.054 . 1 . . . . B 422 ARG CD . 34258 1 89 . 1 1 9 9 ARG N N 15 123.434 0.005 . 1 . . . . B 422 ARG N . 34258 1 90 . 1 1 10 10 ALA H H 1 8.526 0.001 . 1 . . . . B 423 ALA H . 34258 1 91 . 1 1 10 10 ALA HA H 1 4.138 0.001 . 1 . . . . B 423 ALA HA . 34258 1 92 . 1 1 10 10 ALA HB1 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB1 . 34258 1 93 . 1 1 10 10 ALA HB2 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB2 . 34258 1 94 . 1 1 10 10 ALA HB3 H 1 1.359 0.001 . 1 . . . . B 423 ALA HB3 . 34258 1 95 . 1 1 10 10 ALA CA C 13 53.808 0.026 . 1 . . . . B 423 ALA CA . 34258 1 96 . 1 1 10 10 ALA CB C 13 18.067 0.017 . 1 . . . . B 423 ALA CB . 34258 1 97 . 1 1 10 10 ALA N N 15 125.627 0.005 . 1 . . . . B 423 ALA N . 34258 1 98 . 1 1 11 11 GLY H H 1 8.621 0.001 . 1 . . . . B 424 GLY H . 34258 1 99 . 1 1 11 11 GLY HA2 H 1 4.243 0.005 . 2 . . . . B 424 GLY HA2 . 34258 1 100 . 1 1 11 11 GLY HA3 H 1 3.802 0.002 . 2 . . . . B 424 GLY HA3 . 34258 1 101 . 1 1 11 11 GLY CA C 13 44.966 0.012 . 1 . . . . B 424 GLY CA . 34258 1 102 . 1 1 11 11 GLY N N 15 109.766 0.008 . 1 . . . . B 424 GLY N . 34258 1 103 . 1 1 12 12 ASP H H 1 7.819 0.002 . 1 . . . . B 425 ASP H . 34258 1 104 . 1 1 12 12 ASP HA H 1 4.773 0.001 . 1 . . . . B 425 ASP HA . 34258 1 105 . 1 1 12 12 ASP HB2 H 1 2.685 0.002 . 2 . . . . B 425 ASP HB2 . 34258 1 106 . 1 1 12 12 ASP HB3 H 1 2.629 0.001 . 2 . . . . B 425 ASP HB3 . 34258 1 107 . 1 1 12 12 ASP CA C 13 55.940 0.009 . 1 . . . . B 425 ASP CA . 34258 1 108 . 1 1 12 12 ASP CB C 13 40.527 0.026 . 1 . . . . B 425 ASP CB . 34258 1 109 . 1 1 12 12 ASP N N 15 123.548 0.012 . 1 . . . . B 425 ASP N . 34258 1 110 . 1 1 13 13 TRP H H 1 8.821 0.007 . 1 . . . . B 426 TRP H . 34258 1 111 . 1 1 13 13 TRP HA H 1 5.112 0.001 . 1 . . . . B 426 TRP HA . 34258 1 112 . 1 1 13 13 TRP HB2 H 1 3.183 0.001 . 1 . . . . B 426 TRP HB2 . 34258 1 113 . 1 1 13 13 TRP HB3 H 1 3.018 0.002 . 1 . . . . B 426 TRP HB3 . 34258 1 114 . 1 1 13 13 TRP HD1 H 1 7.218 0.000 . 1 . . . . B 426 TRP HD1 . 34258 1 115 . 1 1 13 13 TRP HE1 H 1 9.671 0.001 . 1 . . . . B 426 TRP HE1 . 34258 1 116 . 1 1 13 13 TRP HE3 H 1 7.350 0.000 . 3 . . . . B 426 TRP HE3 . 34258 1 117 . 1 1 13 13 TRP HZ2 H 1 6.499 0.001 . 3 . . . . B 426 TRP HZ2 . 34258 1 118 . 1 1 13 13 TRP HZ3 H 1 6.947 0.000 . 1 . . . . B 426 TRP HZ3 . 34258 1 119 . 1 1 13 13 TRP HH2 H 1 6.953 0.000 . 1 . . . . B 426 TRP HH2 . 34258 1 120 . 1 1 13 13 TRP CA C 13 53.499 0.007 . 1 . . . . B 426 TRP CA . 34258 1 121 . 1 1 13 13 TRP CB C 13 31.248 0.007 . 1 . . . . B 426 TRP CB . 34258 1 122 . 1 1 13 13 TRP CD1 C 13 128.270 0.000 . 1 . . . . B 426 TRP CD1 . 34258 1 123 . 1 1 13 13 TRP CE3 C 13 120.822 0.000 . 3 . . . . B 426 TRP CE3 . 34258 1 124 . 1 1 13 13 TRP CZ2 C 13 113.607 0.000 . 3 . . . . B 426 TRP CZ2 . 34258 1 125 . 1 1 13 13 TRP CZ3 C 13 120.729 0.000 . 1 . . . . B 426 TRP CZ3 . 34258 1 126 . 1 1 13 13 TRP CH2 C 13 123.941 0.000 . 1 . . . . B 426 TRP CH2 . 34258 1 127 . 1 1 13 13 TRP N N 15 119.258 0.011 . 1 . . . . B 426 TRP N . 34258 1 128 . 1 1 13 13 TRP NE1 N 15 130.405 0.015 . 1 . . . . B 426 TRP NE1 . 34258 1 129 . 1 1 14 14 LYS H H 1 8.831 0.000 . 1 . . . . B 427 LYS H . 34258 1 130 . 1 1 14 14 LYS HA H 1 4.430 0.002 . 1 . . . . B 427 LYS HA . 34258 1 131 . 1 1 14 14 LYS HB2 H 1 1.555 0.004 . 2 . . . . B 427 LYS HB2 . 34258 1 132 . 1 1 14 14 LYS HB3 H 1 1.725 0.002 . 2 . . . . B 427 LYS HB3 . 34258 1 133 . 1 1 14 14 LYS HG2 H 1 1.349 0.009 . 2 . . . . B 427 LYS HG2 . 34258 1 134 . 1 1 14 14 LYS HG3 H 1 1.164 0.001 . 2 . . . . B 427 LYS HG3 . 34258 1 135 . 1 1 14 14 LYS HD2 H 1 1.593 0.001 . 2 . . . . B 427 LYS HD2 . 34258 1 136 . 1 1 14 14 LYS HD3 H 1 1.593 0.001 . 2 . . . . B 427 LYS HD3 . 34258 1 137 . 1 1 14 14 LYS HE2 H 1 2.911 0.001 . 2 . . . . B 427 LYS HE2 . 34258 1 138 . 1 1 14 14 LYS HE3 H 1 2.911 0.001 . 2 . . . . B 427 LYS HE3 . 34258 1 139 . 1 1 14 14 LYS CA C 13 55.460 0.000 . 1 . . . . B 427 LYS CA . 34258 1 140 . 1 1 14 14 LYS CB C 13 33.285 0.016 . 1 . . . . B 427 LYS CB . 34258 1 141 . 1 1 14 14 LYS CG C 13 23.999 0.027 . 1 . . . . B 427 LYS CG . 34258 1 142 . 1 1 14 14 LYS CD C 13 29.241 0.005 . 1 . . . . B 427 LYS CD . 34258 1 143 . 1 1 14 14 LYS CE C 13 41.855 0.139 . 1 . . . . B 427 LYS CE . 34258 1 144 . 1 1 14 14 LYS N N 15 126.429 0.003 . 1 . . . . B 427 LYS N . 34258 1 145 . 1 1 15 15 CYS H H 1 8.881 0.001 . 1 . . . . B 428 CYS H . 34258 1 146 . 1 1 15 15 CYS HA H 1 4.575 0.005 . 1 . . . . B 428 CYS HA . 34258 1 147 . 1 1 15 15 CYS HB2 H 1 2.820 0.001 . 2 . . . . B 428 CYS HB2 . 34258 1 148 . 1 1 15 15 CYS HB3 H 1 2.776 0.001 . 2 . . . . B 428 CYS HB3 . 34258 1 149 . 1 1 15 15 CYS CA C 13 57.643 0.023 . 1 . . . . B 428 CYS CA . 34258 1 150 . 1 1 15 15 CYS CB C 13 32.135 0.004 . 1 . . . . B 428 CYS CB . 34258 1 151 . 1 1 15 15 CYS N N 15 132.034 0.007 . 1 . . . . B 428 CYS N . 34258 1 152 . 1 1 16 16 PRO HA H 1 4.570 0.006 . 1 . . . . B 429 PRO HA . 34258 1 153 . 1 1 16 16 PRO HB2 H 1 2.155 0.000 . 2 . . . . B 429 PRO HB2 . 34258 1 154 . 1 1 16 16 PRO HB3 H 1 2.216 0.000 . 2 . . . . B 429 PRO HB3 . 34258 1 155 . 1 1 16 16 PRO HG2 H 1 1.956 0.006 . 2 . . . . B 429 PRO HG2 . 34258 1 156 . 1 1 16 16 PRO HG3 H 1 2.106 0.001 . 2 . . . . B 429 PRO HG3 . 34258 1 157 . 1 1 16 16 PRO HD2 H 1 4.681 0.003 . 2 . . . . B 429 PRO HD2 . 34258 1 158 . 1 1 16 16 PRO HD3 H 1 3.870 0.001 . 2 . . . . B 429 PRO HD3 . 34258 1 159 . 1 1 16 16 PRO CA C 13 63.254 0.037 . 1 . . . . B 429 PRO CA . 34258 1 160 . 1 1 16 16 PRO CB C 13 32.094 0.014 . 1 . . . . B 429 PRO CB . 34258 1 161 . 1 1 16 16 PRO CG C 13 26.385 0.044 . 1 . . . . B 429 PRO CG . 34258 1 162 . 1 1 16 16 PRO CD C 13 51.688 0.019 . 1 . . . . B 429 PRO CD . 34258 1 163 . 1 1 17 17 ASN H H 1 9.267 0.001 . 1 . . . . B 430 ASN H . 34258 1 164 . 1 1 17 17 ASN HA H 1 4.883 0.002 . 1 . . . . B 430 ASN HA . 34258 1 165 . 1 1 17 17 ASN HB2 H 1 3.921 0.001 . 2 . . . . B 430 ASN HB2 . 34258 1 166 . 1 1 17 17 ASN HB3 H 1 2.785 0.003 . 2 . . . . B 430 ASN HB3 . 34258 1 167 . 1 1 17 17 ASN HD21 H 1 7.977 0.002 . 2 . . . . B 430 ASN HD21 . 34258 1 168 . 1 1 17 17 ASN HD22 H 1 6.844 0.003 . 2 . . . . B 430 ASN HD22 . 34258 1 169 . 1 1 17 17 ASN CA C 13 50.959 0.019 . 1 . . . . B 430 ASN CA . 34258 1 170 . 1 1 17 17 ASN CB C 13 38.881 0.008 . 1 . . . . B 430 ASN CB . 34258 1 171 . 1 1 17 17 ASN N N 15 126.554 0.003 . 1 . . . . B 430 ASN N . 34258 1 172 . 1 1 17 17 ASN ND2 N 15 113.133 0.001 . 1 . . . . B 430 ASN ND2 . 34258 1 173 . 1 1 18 18 PRO HA H 1 4.423 0.003 . 1 . . . . B 431 PRO HA . 34258 1 174 . 1 1 18 18 PRO HB2 H 1 1.993 0.003 . 2 . . . . B 431 PRO HB2 . 34258 1 175 . 1 1 18 18 PRO HB3 H 1 2.358 0.001 . 2 . . . . B 431 PRO HB3 . 34258 1 176 . 1 1 18 18 PRO HG2 H 1 1.992 0.000 . 2 . . . . B 431 PRO HG2 . 34258 1 177 . 1 1 18 18 PRO HG3 H 1 2.074 0.004 . 2 . . . . B 431 PRO HG3 . 34258 1 178 . 1 1 18 18 PRO HD2 H 1 4.037 0.001 . 2 . . . . B 431 PRO HD2 . 34258 1 179 . 1 1 18 18 PRO HD3 H 1 4.220 0.000 . 2 . . . . B 431 PRO HD3 . 34258 1 180 . 1 1 18 18 PRO CA C 13 64.512 0.017 . 1 . . . . B 431 PRO CA . 34258 1 181 . 1 1 18 18 PRO CB C 13 32.442 0.020 . 1 . . . . B 431 PRO CB . 34258 1 182 . 1 1 18 18 PRO CG C 13 27.043 0.044 . 1 . . . . B 431 PRO CG . 34258 1 183 . 1 1 18 18 PRO CD C 13 51.460 0.006 . 1 . . . . B 431 PRO CD . 34258 1 184 . 1 1 19 19 THR H H 1 7.430 0.008 . 1 . . . . B 432 THR H . 34258 1 185 . 1 1 19 19 THR HA H 1 4.297 0.003 . 1 . . . . B 432 THR HA . 34258 1 186 . 1 1 19 19 THR HB H 1 4.363 0.001 . 1 . . . . B 432 THR HB . 34258 1 187 . 1 1 19 19 THR HG21 H 1 1.147 0.000 . 1 . . . . B 432 THR HG21 . 34258 1 188 . 1 1 19 19 THR HG22 H 1 1.147 0.000 . 1 . . . . B 432 THR HG22 . 34258 1 189 . 1 1 19 19 THR HG23 H 1 1.147 0.000 . 1 . . . . B 432 THR HG23 . 34258 1 190 . 1 1 19 19 THR CA C 13 61.639 0.001 . 1 . . . . B 432 THR CA . 34258 1 191 . 1 1 19 19 THR CB C 13 68.742 0.063 . 1 . . . . B 432 THR CB . 34258 1 192 . 1 1 19 19 THR CG2 C 13 21.760 0.000 . 1 . . . . B 432 THR CG2 . 34258 1 193 . 1 1 19 19 THR N N 15 107.075 0.010 . 1 . . . . B 432 THR N . 34258 1 194 . 1 1 20 20 CYS H H 1 7.992 0.004 . 1 . . . . B 433 CYS H . 34258 1 195 . 1 1 20 20 CYS HA H 1 4.320 0.002 . 1 . . . . B 433 CYS HA . 34258 1 196 . 1 1 20 20 CYS HB2 H 1 2.540 0.001 . 2 . . . . B 433 CYS HB2 . 34258 1 197 . 1 1 20 20 CYS HB3 H 1 3.109 0.001 . 2 . . . . B 433 CYS HB3 . 34258 1 198 . 1 1 20 20 CYS CA C 13 60.097 0.039 . 1 . . . . B 433 CYS CA . 34258 1 199 . 1 1 20 20 CYS CB C 13 32.292 0.058 . 1 . . . . B 433 CYS CB . 34258 1 200 . 1 1 20 20 CYS N N 15 125.510 0.002 . 1 . . . . B 433 CYS N . 34258 1 201 . 1 1 21 21 GLU H H 1 7.668 0.002 . 1 . . . . B 434 GLU H . 34258 1 202 . 1 1 21 21 GLU HA H 1 4.117 0.003 . 1 . . . . B 434 GLU HA . 34258 1 203 . 1 1 21 21 GLU HB2 H 1 2.101 0.002 . 2 . . . . B 434 GLU HB2 . 34258 1 204 . 1 1 21 21 GLU HB3 H 1 2.041 0.000 . 2 . . . . B 434 GLU HB3 . 34258 1 205 . 1 1 21 21 GLU HG2 H 1 2.008 0.000 . 2 . . . . B 434 GLU HG2 . 34258 1 206 . 1 1 21 21 GLU HG3 H 1 2.175 0.000 . 2 . . . . B 434 GLU HG3 . 34258 1 207 . 1 1 21 21 GLU CA C 13 57.887 0.013 . 1 . . . . B 434 GLU CA . 34258 1 208 . 1 1 21 21 GLU CB C 13 27.958 0.123 . 1 . . . . B 434 GLU CB . 34258 1 209 . 1 1 21 21 GLU CG C 13 37.351 0.022 . 1 . . . . B 434 GLU CG . 34258 1 210 . 1 1 21 21 GLU N N 15 109.352 0.036 . 1 . . . . B 434 GLU N . 34258 1 211 . 1 1 22 22 ASN H H 1 8.486 0.002 . 1 . . . . B 435 ASN H . 34258 1 212 . 1 1 22 22 ASN HA H 1 4.196 0.001 . 1 . . . . B 435 ASN HA . 34258 1 213 . 1 1 22 22 ASN HB2 H 1 2.739 0.004 . 2 . . . . B 435 ASN HB2 . 34258 1 214 . 1 1 22 22 ASN HB3 H 1 2.532 0.001 . 2 . . . . B 435 ASN HB3 . 34258 1 215 . 1 1 22 22 ASN HD21 H 1 6.639 0.001 . 2 . . . . B 435 ASN HD21 . 34258 1 216 . 1 1 22 22 ASN HD22 H 1 6.639 0.001 . 2 . . . . B 435 ASN HD22 . 34258 1 217 . 1 1 22 22 ASN CA C 13 54.819 0.011 . 1 . . . . B 435 ASN CA . 34258 1 218 . 1 1 22 22 ASN CB C 13 40.864 0.020 . 1 . . . . B 435 ASN CB . 34258 1 219 . 1 1 22 22 ASN N N 15 119.518 0.004 . 1 . . . . B 435 ASN N . 34258 1 220 . 1 1 22 22 ASN ND2 N 15 113.998 0.033 . 1 . . . . B 435 ASN ND2 . 34258 1 221 . 1 1 23 23 MET H H 1 8.163 0.004 . 1 . . . . B 436 MET H . 34258 1 222 . 1 1 23 23 MET HA H 1 4.710 0.002 . 1 . . . . B 436 MET HA . 34258 1 223 . 1 1 23 23 MET HB2 H 1 1.896 0.002 . 2 . . . . B 436 MET HB2 . 34258 1 224 . 1 1 23 23 MET HB3 H 1 1.896 0.002 . 2 . . . . B 436 MET HB3 . 34258 1 225 . 1 1 23 23 MET HG2 H 1 2.495 0.004 . 2 . . . . B 436 MET HG2 . 34258 1 226 . 1 1 23 23 MET HG3 H 1 2.354 0.003 . 2 . . . . B 436 MET HG3 . 34258 1 227 . 1 1 23 23 MET HE1 H 1 1.886 0.007 . 1 . . . . B 436 MET HE1 . 34258 1 228 . 1 1 23 23 MET HE2 H 1 1.886 0.007 . 1 . . . . B 436 MET HE2 . 34258 1 229 . 1 1 23 23 MET HE3 H 1 1.886 0.007 . 1 . . . . B 436 MET HE3 . 34258 1 230 . 1 1 23 23 MET CA C 13 52.941 0.012 . 1 . . . . B 436 MET CA . 34258 1 231 . 1 1 23 23 MET CB C 13 29.749 0.047 . 1 . . . . B 436 MET CB . 34258 1 232 . 1 1 23 23 MET CG C 13 31.598 0.036 . 1 . . . . B 436 MET CG . 34258 1 233 . 1 1 23 23 MET CE C 13 15.477 0.000 . 1 . . . . B 436 MET CE . 34258 1 234 . 1 1 23 23 MET N N 15 122.925 0.006 . 1 . . . . B 436 MET N . 34258 1 235 . 1 1 24 24 ASN H H 1 9.048 0.002 . 1 . . . . B 437 ASN H . 34258 1 236 . 1 1 24 24 ASN HA H 1 4.543 0.006 . 1 . . . . B 437 ASN HA . 34258 1 237 . 1 1 24 24 ASN HB2 H 1 0.387 0.002 . 2 . . . . B 437 ASN HB2 . 34258 1 238 . 1 1 24 24 ASN HB3 H 1 1.262 0.001 . 2 . . . . B 437 ASN HB3 . 34258 1 239 . 1 1 24 24 ASN HD21 H 1 4.303 0.001 . 2 . . . . B 437 ASN HD21 . 34258 1 240 . 1 1 24 24 ASN HD22 H 1 6.897 0.002 . 2 . . . . B 437 ASN HD22 . 34258 1 241 . 1 1 24 24 ASN CA C 13 53.704 0.050 . 1 . . . . B 437 ASN CA . 34258 1 242 . 1 1 24 24 ASN CB C 13 41.499 0.023 . 1 . . . . B 437 ASN CB . 34258 1 243 . 1 1 24 24 ASN N N 15 126.935 0.024 . 1 . . . . B 437 ASN N . 34258 1 244 . 1 1 24 24 ASN ND2 N 15 113.310 0.007 . 1 . . . . B 437 ASN ND2 . 34258 1 245 . 1 1 25 25 PHE H H 1 7.612 0.003 . 1 . . . . B 438 PHE H . 34258 1 246 . 1 1 25 25 PHE HA H 1 4.466 0.005 . 1 . . . . B 438 PHE HA . 34258 1 247 . 1 1 25 25 PHE HB2 H 1 2.529 0.004 . 2 . . . . B 438 PHE HB2 . 34258 1 248 . 1 1 25 25 PHE HB3 H 1 1.537 0.002 . 2 . . . . B 438 PHE HB3 . 34258 1 249 . 1 1 25 25 PHE HD1 H 1 6.394 0.003 . 3 . . . . B 438 PHE HD1 . 34258 1 250 . 1 1 25 25 PHE HD2 H 1 6.394 0.003 . 3 . . . . B 438 PHE HD2 . 34258 1 251 . 1 1 25 25 PHE HE1 H 1 6.603 0.006 . 3 . . . . B 438 PHE HE1 . 34258 1 252 . 1 1 25 25 PHE HE2 H 1 6.603 0.006 . 3 . . . . B 438 PHE HE2 . 34258 1 253 . 1 1 25 25 PHE HZ H 1 6.374 0.000 . 1 . . . . B 438 PHE HZ . 34258 1 254 . 1 1 25 25 PHE CA C 13 53.679 0.025 . 1 . . . . B 438 PHE CA . 34258 1 255 . 1 1 25 25 PHE CB C 13 35.640 0.077 . 1 . . . . B 438 PHE CB . 34258 1 256 . 1 1 25 25 PHE CD1 C 13 128.034 0.000 . 3 . . . . B 438 PHE CD1 . 34258 1 257 . 1 1 25 25 PHE CE1 C 13 129.762 0.000 . 3 . . . . B 438 PHE CE1 . 34258 1 258 . 1 1 25 25 PHE N N 15 119.476 0.017 . 1 . . . . B 438 PHE N . 34258 1 259 . 1 1 26 26 SER H H 1 8.475 0.003 . 1 . . . . B 439 SER H . 34258 1 260 . 1 1 26 26 SER HA H 1 4.250 0.002 . 1 . . . . B 439 SER HA . 34258 1 261 . 1 1 26 26 SER HB2 H 1 4.145 0.001 . 2 . . . . B 439 SER HB2 . 34258 1 262 . 1 1 26 26 SER HB3 H 1 3.890 0.002 . 2 . . . . B 439 SER HB3 . 34258 1 263 . 1 1 26 26 SER CA C 13 61.284 0.004 . 1 . . . . B 439 SER CA . 34258 1 264 . 1 1 26 26 SER CB C 13 63.915 0.006 . 1 . . . . B 439 SER CB . 34258 1 265 . 1 1 26 26 SER N N 15 116.410 0.005 . 1 . . . . B 439 SER N . 34258 1 266 . 1 1 27 27 TRP H H 1 6.772 0.001 . 1 . . . . B 440 TRP H . 34258 1 267 . 1 1 27 27 TRP HA H 1 4.615 0.002 . 1 . . . . B 440 TRP HA . 34258 1 268 . 1 1 27 27 TRP HB2 H 1 3.690 0.003 . 2 . . . . B 440 TRP HB2 . 34258 1 269 . 1 1 27 27 TRP HB3 H 1 3.175 0.002 . 2 . . . . B 440 TRP HB3 . 34258 1 270 . 1 1 27 27 TRP HD1 H 1 7.505 0.004 . 1 . . . . B 440 TRP HD1 . 34258 1 271 . 1 1 27 27 TRP HE1 H 1 10.315 0.002 . 1 . . . . B 440 TRP HE1 . 34258 1 272 . 1 1 27 27 TRP HE3 H 1 7.331 0.001 . 3 . . . . B 440 TRP HE3 . 34258 1 273 . 1 1 27 27 TRP HZ2 H 1 7.444 0.000 . 3 . . . . B 440 TRP HZ2 . 34258 1 274 . 1 1 27 27 TRP HZ3 H 1 7.126 0.000 . 1 . . . . B 440 TRP HZ3 . 34258 1 275 . 1 1 27 27 TRP HH2 H 1 7.207 0.000 . 1 . . . . B 440 TRP HH2 . 34258 1 276 . 1 1 27 27 TRP CA C 13 54.231 0.010 . 1 . . . . B 440 TRP CA . 34258 1 277 . 1 1 27 27 TRP CB C 13 28.859 0.029 . 1 . . . . B 440 TRP CB . 34258 1 278 . 1 1 27 27 TRP CD1 C 13 128.672 0.000 . 1 . . . . B 440 TRP CD1 . 34258 1 279 . 1 1 27 27 TRP CE3 C 13 121.454 0.000 . 3 . . . . B 440 TRP CE3 . 34258 1 280 . 1 1 27 27 TRP CZ2 C 13 114.569 0.000 . 3 . . . . B 440 TRP CZ2 . 34258 1 281 . 1 1 27 27 TRP CZ3 C 13 122.661 0.000 . 1 . . . . B 440 TRP CZ3 . 34258 1 282 . 1 1 27 27 TRP CH2 C 13 125.398 0.000 . 1 . . . . B 440 TRP CH2 . 34258 1 283 . 1 1 27 27 TRP N N 15 116.053 0.009 . 1 . . . . B 440 TRP N . 34258 1 284 . 1 1 27 27 TRP NE1 N 15 131.637 0.013 . 1 . . . . B 440 TRP NE1 . 34258 1 285 . 1 1 28 28 ARG H H 1 7.933 0.001 . 1 . . . . B 441 ARG H . 34258 1 286 . 1 1 28 28 ARG HA H 1 4.319 0.001 . 1 . . . . B 441 ARG HA . 34258 1 287 . 1 1 28 28 ARG HB2 H 1 1.790 0.002 . 2 . . . . B 441 ARG HB2 . 34258 1 288 . 1 1 28 28 ARG HB3 H 1 1.923 0.002 . 2 . . . . B 441 ARG HB3 . 34258 1 289 . 1 1 28 28 ARG HG2 H 1 1.094 0.004 . 2 . . . . B 441 ARG HG2 . 34258 1 290 . 1 1 28 28 ARG HG3 H 1 0.531 0.002 . 2 . . . . B 441 ARG HG3 . 34258 1 291 . 1 1 28 28 ARG HD2 H 1 3.010 0.003 . 2 . . . . B 441 ARG HD2 . 34258 1 292 . 1 1 28 28 ARG HD3 H 1 2.906 0.003 . 2 . . . . B 441 ARG HD3 . 34258 1 293 . 1 1 28 28 ARG HE H 1 7.562 0.001 . 1 . . . . B 441 ARG HE . 34258 1 294 . 1 1 28 28 ARG CA C 13 58.040 0.046 . 1 . . . . B 441 ARG CA . 34258 1 295 . 1 1 28 28 ARG CB C 13 30.007 0.036 . 1 . . . . B 441 ARG CB . 34258 1 296 . 1 1 28 28 ARG CG C 13 28.305 0.036 . 1 . . . . B 441 ARG CG . 34258 1 297 . 1 1 28 28 ARG CD C 13 42.713 0.038 . 1 . . . . B 441 ARG CD . 34258 1 298 . 1 1 28 28 ARG N N 15 122.094 0.003 . 1 . . . . B 441 ARG N . 34258 1 299 . 1 1 28 28 ARG NE N 15 82.696 0.009 . 1 . . . . B 441 ARG NE . 34258 1 300 . 1 1 29 29 ASN H H 1 9.185 0.003 . 1 . . . . B 442 ASN H . 34258 1 301 . 1 1 29 29 ASN HA H 1 4.816 0.004 . 1 . . . . B 442 ASN HA . 34258 1 302 . 1 1 29 29 ASN HB2 H 1 2.907 0.004 . 2 . . . . B 442 ASN HB2 . 34258 1 303 . 1 1 29 29 ASN HB3 H 1 2.811 0.002 . 2 . . . . B 442 ASN HB3 . 34258 1 304 . 1 1 29 29 ASN HD21 H 1 7.629 0.004 . 2 . . . . B 442 ASN HD21 . 34258 1 305 . 1 1 29 29 ASN HD22 H 1 6.910 0.002 . 2 . . . . B 442 ASN HD22 . 34258 1 306 . 1 1 29 29 ASN CA C 13 53.354 0.015 . 1 . . . . B 442 ASN CA . 34258 1 307 . 1 1 29 29 ASN CB C 13 39.379 0.072 . 1 . . . . B 442 ASN CB . 34258 1 308 . 1 1 29 29 ASN N N 15 119.651 0.012 . 1 . . . . B 442 ASN N . 34258 1 309 . 1 1 29 29 ASN ND2 N 15 112.947 0.003 . 1 . . . . B 442 ASN ND2 . 34258 1 310 . 1 1 30 30 GLU H H 1 7.659 0.002 . 1 . . . . B 443 GLU H . 34258 1 311 . 1 1 30 30 GLU HA H 1 5.126 0.002 . 1 . . . . B 443 GLU HA . 34258 1 312 . 1 1 30 30 GLU HB2 H 1 1.910 0.001 . 2 . . . . B 443 GLU HB2 . 34258 1 313 . 1 1 30 30 GLU HB3 H 1 1.704 0.001 . 2 . . . . B 443 GLU HB3 . 34258 1 314 . 1 1 30 30 GLU HG2 H 1 1.963 0.000 . 2 . . . . B 443 GLU HG2 . 34258 1 315 . 1 1 30 30 GLU HG3 H 1 2.118 0.001 . 2 . . . . B 443 GLU HG3 . 34258 1 316 . 1 1 30 30 GLU CA C 13 53.816 0.011 . 1 . . . . B 443 GLU CA . 34258 1 317 . 1 1 30 30 GLU CB C 13 32.410 0.033 . 1 . . . . B 443 GLU CB . 34258 1 318 . 1 1 30 30 GLU CG C 13 34.906 0.027 . 1 . . . . B 443 GLU CG . 34258 1 319 . 1 1 30 30 GLU N N 15 117.743 0.004 . 1 . . . . B 443 GLU N . 34258 1 320 . 1 1 31 31 CYS H H 1 9.780 0.001 . 1 . . . . B 444 CYS H . 34258 1 321 . 1 1 31 31 CYS HA H 1 3.823 0.001 . 1 . . . . B 444 CYS HA . 34258 1 322 . 1 1 31 31 CYS HB2 H 1 3.109 0.001 . 2 . . . . B 444 CYS HB2 . 34258 1 323 . 1 1 31 31 CYS HB3 H 1 3.282 0.001 . 2 . . . . B 444 CYS HB3 . 34258 1 324 . 1 1 31 31 CYS CA C 13 58.842 0.008 . 1 . . . . B 444 CYS CA . 34258 1 325 . 1 1 31 31 CYS CB C 13 30.532 0.017 . 1 . . . . B 444 CYS CB . 34258 1 326 . 1 1 31 31 CYS N N 15 125.704 0.002 . 1 . . . . B 444 CYS N . 34258 1 327 . 1 1 32 32 ASN H H 1 8.440 0.002 . 1 . . . . B 445 ASN H . 34258 1 328 . 1 1 32 32 ASN HA H 1 4.363 0.002 . 1 . . . . B 445 ASN HA . 34258 1 329 . 1 1 32 32 ASN HB2 H 1 2.324 0.002 . 2 . . . . B 445 ASN HB2 . 34258 1 330 . 1 1 32 32 ASN HB3 H 1 2.117 0.001 . 2 . . . . B 445 ASN HB3 . 34258 1 331 . 1 1 32 32 ASN HD21 H 1 7.183 0.001 . 2 . . . . B 445 ASN HD21 . 34258 1 332 . 1 1 32 32 ASN HD22 H 1 6.401 0.002 . 2 . . . . B 445 ASN HD22 . 34258 1 333 . 1 1 32 32 ASN CA C 13 54.860 0.010 . 1 . . . . B 445 ASN CA . 34258 1 334 . 1 1 32 32 ASN CB C 13 39.161 0.019 . 1 . . . . B 445 ASN CB . 34258 1 335 . 1 1 32 32 ASN N N 15 126.894 0.003 . 1 . . . . B 445 ASN N . 34258 1 336 . 1 1 32 32 ASN ND2 N 15 112.191 0.003 . 1 . . . . B 445 ASN ND2 . 34258 1 337 . 1 1 33 33 GLN H H 1 9.047 0.002 . 1 . . . . B 446 GLN H . 34258 1 338 . 1 1 33 33 GLN HA H 1 4.294 0.008 . 1 . . . . B 446 GLN HA . 34258 1 339 . 1 1 33 33 GLN HB2 H 1 1.726 0.001 . 2 . . . . B 446 GLN HB2 . 34258 1 340 . 1 1 33 33 GLN HB3 H 1 1.905 0.001 . 2 . . . . B 446 GLN HB3 . 34258 1 341 . 1 1 33 33 GLN HG2 H 1 1.986 0.008 . 2 . . . . B 446 GLN HG2 . 34258 1 342 . 1 1 33 33 GLN HG3 H 1 1.893 0.004 . 2 . . . . B 446 GLN HG3 . 34258 1 343 . 1 1 33 33 GLN HE21 H 1 6.521 0.002 . 2 . . . . B 446 GLN HE21 . 34258 1 344 . 1 1 33 33 GLN HE22 H 1 6.763 0.004 . 2 . . . . B 446 GLN HE22 . 34258 1 345 . 1 1 33 33 GLN CA C 13 56.806 0.010 . 1 . . . . B 446 GLN CA . 34258 1 346 . 1 1 33 33 GLN CB C 13 30.728 0.030 . 1 . . . . B 446 GLN CB . 34258 1 347 . 1 1 33 33 GLN CG C 13 33.083 0.052 . 1 . . . . B 446 GLN CG . 34258 1 348 . 1 1 33 33 GLN N N 15 116.896 0.025 . 1 . . . . B 446 GLN N . 34258 1 349 . 1 1 33 33 GLN NE2 N 15 110.334 0.047 . 1 . . . . B 446 GLN NE2 . 34258 1 350 . 1 1 34 34 CYS H H 1 8.098 0.001 . 1 . . . . B 447 CYS H . 34258 1 351 . 1 1 34 34 CYS HA H 1 4.889 0.002 . 1 . . . . B 447 CYS HA . 34258 1 352 . 1 1 34 34 CYS HB2 H 1 3.112 0.000 . 2 . . . . B 447 CYS HB2 . 34258 1 353 . 1 1 34 34 CYS HB3 H 1 2.609 0.001 . 2 . . . . B 447 CYS HB3 . 34258 1 354 . 1 1 34 34 CYS CA C 13 59.063 0.012 . 1 . . . . B 447 CYS CA . 34258 1 355 . 1 1 34 34 CYS CB C 13 31.581 0.006 . 1 . . . . B 447 CYS CB . 34258 1 356 . 1 1 34 34 CYS N N 15 118.672 0.005 . 1 . . . . B 447 CYS N . 34258 1 357 . 1 1 35 35 LYS H H 1 7.509 0.002 . 1 . . . . B 448 LYS H . 34258 1 358 . 1 1 35 35 LYS HA H 1 4.057 0.003 . 1 . . . . B 448 LYS HA . 34258 1 359 . 1 1 35 35 LYS HB2 H 1 2.104 0.001 . 2 . . . . B 448 LYS HB2 . 34258 1 360 . 1 1 35 35 LYS HB3 H 1 2.013 0.036 . 2 . . . . B 448 LYS HB3 . 34258 1 361 . 1 1 35 35 LYS HG2 H 1 1.285 0.001 . 2 . . . . B 448 LYS HG2 . 34258 1 362 . 1 1 35 35 LYS HG3 H 1 1.221 0.001 . 2 . . . . B 448 LYS HG3 . 34258 1 363 . 1 1 35 35 LYS HD2 H 1 1.606 0.003 . 2 . . . . B 448 LYS HD2 . 34258 1 364 . 1 1 35 35 LYS HD3 H 1 1.526 0.004 . 2 . . . . B 448 LYS HD3 . 34258 1 365 . 1 1 35 35 LYS HE2 H 1 2.879 0.000 . 2 . . . . B 448 LYS HE2 . 34258 1 366 . 1 1 35 35 LYS HE3 H 1 2.879 0.000 . 2 . . . . B 448 LYS HE3 . 34258 1 367 . 1 1 35 35 LYS CA C 13 58.490 0.012 . 1 . . . . B 448 LYS CA . 34258 1 368 . 1 1 35 35 LYS CB C 13 29.522 0.043 . 1 . . . . B 448 LYS CB . 34258 1 369 . 1 1 35 35 LYS CG C 13 25.248 0.042 . 1 . . . . B 448 LYS CG . 34258 1 370 . 1 1 35 35 LYS CD C 13 28.568 0.050 . 1 . . . . B 448 LYS CD . 34258 1 371 . 1 1 35 35 LYS CE C 13 42.248 0.006 . 1 . . . . B 448 LYS CE . 34258 1 372 . 1 1 35 35 LYS N N 15 116.426 0.002 . 1 . . . . B 448 LYS N . 34258 1 373 . 1 1 36 36 ALA H H 1 8.889 0.001 . 1 . . . . B 449 ALA H . 34258 1 374 . 1 1 36 36 ALA HA H 1 4.485 0.002 . 1 . . . . B 449 ALA HA . 34258 1 375 . 1 1 36 36 ALA HB1 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB1 . 34258 1 376 . 1 1 36 36 ALA HB2 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB2 . 34258 1 377 . 1 1 36 36 ALA HB3 H 1 1.526 0.001 . 1 . . . . B 449 ALA HB3 . 34258 1 378 . 1 1 36 36 ALA CA C 13 51.861 0.013 . 1 . . . . B 449 ALA CA . 34258 1 379 . 1 1 36 36 ALA CB C 13 18.483 0.037 . 1 . . . . B 449 ALA CB . 34258 1 380 . 1 1 36 36 ALA N N 15 127.281 0.003 . 1 . . . . B 449 ALA N . 34258 1 381 . 1 1 37 37 PRO HA H 1 4.491 0.002 . 1 . . . . B 450 PRO HA . 34258 1 382 . 1 1 37 37 PRO HB2 H 1 1.752 0.002 . 2 . . . . B 450 PRO HB2 . 34258 1 383 . 1 1 37 37 PRO HB3 H 1 2.310 0.001 . 2 . . . . B 450 PRO HB3 . 34258 1 384 . 1 1 37 37 PRO HG2 H 1 2.030 0.001 . 2 . . . . B 450 PRO HG2 . 34258 1 385 . 1 1 37 37 PRO HG3 H 1 2.030 0.001 . 2 . . . . B 450 PRO HG3 . 34258 1 386 . 1 1 37 37 PRO HD2 H 1 3.616 0.001 . 2 . . . . B 450 PRO HD2 . 34258 1 387 . 1 1 37 37 PRO HD3 H 1 3.905 0.001 . 2 . . . . B 450 PRO HD3 . 34258 1 388 . 1 1 37 37 PRO CA C 13 62.365 0.007 . 1 . . . . B 450 PRO CA . 34258 1 389 . 1 1 37 37 PRO CB C 13 32.016 0.007 . 1 . . . . B 450 PRO CB . 34258 1 390 . 1 1 37 37 PRO CG C 13 27.311 0.033 . 1 . . . . B 450 PRO CG . 34258 1 391 . 1 1 37 37 PRO CD C 13 50.317 0.017 . 1 . . . . B 450 PRO CD . 34258 1 392 . 1 1 38 38 LYS H H 1 7.175 0.000 . 1 . . . . B 451 LYS H . 34258 1 393 . 1 1 38 38 LYS HA H 1 2.837 0.001 . 1 . . . . B 451 LYS HA . 34258 1 394 . 1 1 38 38 LYS HB2 H 1 1.022 0.001 . 2 . . . . B 451 LYS HB2 . 34258 1 395 . 1 1 38 38 LYS HB3 H 1 0.512 0.002 . 2 . . . . B 451 LYS HB3 . 34258 1 396 . 1 1 38 38 LYS HG2 H 1 -0.854 0.001 . 1 . . . . B 451 LYS HG2 . 34258 1 397 . 1 1 38 38 LYS HG3 H 1 0.681 0.001 . 2 . . . . B 451 LYS HG3 . 34258 1 398 . 1 1 38 38 LYS HD2 H 1 1.045 0.001 . 2 . . . . B 451 LYS HD2 . 34258 1 399 . 1 1 38 38 LYS HD3 H 1 1.045 0.001 . 2 . . . . B 451 LYS HD3 . 34258 1 400 . 1 1 38 38 LYS HE2 H 1 2.388 0.000 . 2 . . . . B 451 LYS HE2 . 34258 1 401 . 1 1 38 38 LYS HE3 H 1 2.388 0.000 . 2 . . . . B 451 LYS HE3 . 34258 1 402 . 1 1 38 38 LYS CA C 13 54.207 0.013 . 1 . . . . B 451 LYS CA . 34258 1 403 . 1 1 38 38 LYS CB C 13 33.357 0.012 . 1 . . . . B 451 LYS CB . 34258 1 404 . 1 1 38 38 LYS CG C 13 23.092 0.013 . 1 . . . . B 451 LYS CG . 34258 1 405 . 1 1 38 38 LYS CD C 13 29.243 0.000 . 1 . . . . B 451 LYS CD . 34258 1 406 . 1 1 38 38 LYS CE C 13 41.900 0.000 . 1 . . . . B 451 LYS CE . 34258 1 407 . 1 1 38 38 LYS N N 15 122.761 0.002 . 1 . . . . B 451 LYS N . 34258 1 408 . 1 1 39 39 PRO HA H 1 4.276 0.003 . 1 . . . . B 452 PRO HA . 34258 1 409 . 1 1 39 39 PRO HB2 H 1 2.218 0.001 . 2 . . . . B 452 PRO HB2 . 34258 1 410 . 1 1 39 39 PRO HB3 H 1 1.875 0.001 . 2 . . . . B 452 PRO HB3 . 34258 1 411 . 1 1 39 39 PRO HG2 H 1 1.900 0.000 . 2 . . . . B 452 PRO HG2 . 34258 1 412 . 1 1 39 39 PRO HG3 H 1 2.057 0.000 . 2 . . . . B 452 PRO HG3 . 34258 1 413 . 1 1 39 39 PRO HD2 H 1 3.032 0.001 . 2 . . . . B 452 PRO HD2 . 34258 1 414 . 1 1 39 39 PRO HD3 H 1 3.618 0.001 . 2 . . . . B 452 PRO HD3 . 34258 1 415 . 1 1 39 39 PRO CA C 13 62.885 0.003 . 1 . . . . B 452 PRO CA . 34258 1 416 . 1 1 39 39 PRO CB C 13 32.167 0.056 . 1 . . . . B 452 PRO CB . 34258 1 417 . 1 1 39 39 PRO CG C 13 27.102 0.057 . 1 . . . . B 452 PRO CG . 34258 1 418 . 1 1 39 39 PRO CD C 13 51.367 0.027 . 1 . . . . B 452 PRO CD . 34258 1 419 . 1 1 40 40 ASP H H 1 8.261 0.003 . 1 . . . . B 453 ASP H . 34258 1 420 . 1 1 40 40 ASP HA H 1 4.443 0.003 . 1 . . . . B 453 ASP HA . 34258 1 421 . 1 1 40 40 ASP HB2 H 1 2.590 0.002 . 2 . . . . B 453 ASP HB2 . 34258 1 422 . 1 1 40 40 ASP HB3 H 1 2.520 0.003 . 2 . . . . B 453 ASP HB3 . 34258 1 423 . 1 1 40 40 ASP CA C 13 54.300 0.015 . 1 . . . . B 453 ASP CA . 34258 1 424 . 1 1 40 40 ASP CB C 13 41.159 0.031 . 1 . . . . B 453 ASP CB . 34258 1 425 . 1 1 40 40 ASP N N 15 121.548 0.000 . 1 . . . . B 453 ASP N . 34258 1 426 . 1 1 41 41 GLY H H 1 7.718 0.002 . 1 . . . . B 454 GLY H . 34258 1 427 . 1 1 41 41 GLY HA2 H 1 3.684 0.001 . 2 . . . . B 454 GLY HA2 . 34258 1 428 . 1 1 41 41 GLY HA3 H 1 3.684 0.001 . 2 . . . . B 454 GLY HA3 . 34258 1 429 . 1 1 41 41 GLY CA C 13 46.211 0.001 . 1 . . . . B 454 GLY CA . 34258 1 430 . 1 1 41 41 GLY N N 15 114.897 0.000 . 1 . . . . B 454 GLY N . 34258 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 34258 _Assigned_chem_shift_list.ID 2 _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 '3D 1H-13C NOESY aliphatic' . . . 34258 2 2 '3D 1H-15N NOESY' . . . 34258 2 3 '2D 1H-1H NOESY' . . . 34258 2 4 '2D 13C F2-filtered NOESY' . . . 34258 2 5 '2D 1H-13C HSQC aliphatic' . . . 34258 2 6 '2D 1H-13C HSQC aromatic' . . . 34258 2 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 . 2 2 1 1 U H1' H 1 5.771 0.001 . 1 . . . . A 1 U H1' . 34258 2 2 . 2 2 1 1 U H2' H 1 4.384 0.000 . 1 . . . . A 1 U H2' . 34258 2 3 . 2 2 1 1 U H3' H 1 4.624 0.001 . 1 . . . . A 1 U H3' . 34258 2 4 . 2 2 1 1 U H4' H 1 4.217 0.002 . 1 . . . . A 1 U H4' . 34258 2 5 . 2 2 1 1 U H5 H 1 5.438 0.002 . 1 . . . . A 1 U H5 . 34258 2 6 . 2 2 1 1 U H5' H 1 3.714 0.001 . 2 . . . . A 1 U H5' . 34258 2 7 . 2 2 1 1 U H5'' H 1 3.714 0.001 . 2 . . . . A 1 U H5'' . 34258 2 8 . 2 2 1 1 U H6 H 1 7.383 0.002 . 1 . . . . A 1 U H6 . 34258 2 9 . 2 2 1 1 U C1' C 13 90.888 0.000 . 1 . . . . A 1 U C1' . 34258 2 10 . 2 2 1 1 U C2' C 13 74.925 0.000 . 1 . . . . A 1 U C2' . 34258 2 11 . 2 2 1 1 U C3' C 13 77.437 0.000 . 1 . . . . A 1 U C3' . 34258 2 12 . 2 2 1 1 U C4' C 13 86.956 0.000 . 1 . . . . A 1 U C4' . 34258 2 13 . 2 2 1 1 U C5 C 13 104.911 0.000 . 1 . . . . A 1 U C5 . 34258 2 14 . 2 2 1 1 U C5' C 13 63.572 0.000 . 1 . . . . A 1 U C5' . 34258 2 15 . 2 2 1 1 U C6 C 13 143.505 0.000 . 1 . . . . A 1 U C6 . 34258 2 16 . 2 2 2 2 G H1' H 1 5.623 0.002 . 1 . . . . A 2 G H1' . 34258 2 17 . 2 2 2 2 G H2' H 1 4.399 0.006 . 1 . . . . A 2 G H2' . 34258 2 18 . 2 2 2 2 G H3' H 1 4.867 0.002 . 1 . . . . A 2 G H3' . 34258 2 19 . 2 2 2 2 G H4' H 1 4.369 0.003 . 1 . . . . A 2 G H4' . 34258 2 20 . 2 2 2 2 G H5' H 1 4.291 0.006 . 2 . . . . A 2 G H5' . 34258 2 21 . 2 2 2 2 G H5'' H 1 4.190 0.006 . 2 . . . . A 2 G H5'' . 34258 2 22 . 2 2 2 2 G H8 H 1 8.028 0.003 . 1 . . . . A 2 G H8 . 34258 2 23 . 2 2 2 2 G C1' C 13 91.676 0.000 . 1 . . . . A 2 G C1' . 34258 2 24 . 2 2 2 2 G C2' C 13 75.989 0.000 . 1 . . . . A 2 G C2' . 34258 2 25 . 2 2 2 2 G C3' C 13 74.513 0.000 . 1 . . . . A 2 G C3' . 34258 2 26 . 2 2 2 2 G C4' C 13 83.185 0.000 . 1 . . . . A 2 G C4' . 34258 2 27 . 2 2 2 2 G C5' C 13 68.050 0.000 . 1 . . . . A 2 G C5' . 34258 2 28 . 2 2 2 2 G C8 C 13 139.043 0.000 . 1 . . . . A 2 G C8 . 34258 2 29 . 2 2 3 3 G H1' H 1 5.500 0.003 . 1 . . . . A 3 G H1' . 34258 2 30 . 2 2 3 3 G H2' H 1 4.890 0.008 . 1 . . . . A 3 G H2' . 34258 2 31 . 2 2 3 3 G H3' H 1 4.840 0.006 . 1 . . . . A 3 G H3' . 34258 2 32 . 2 2 3 3 G H4' H 1 4.509 0.001 . 1 . . . . A 3 G H4' . 34258 2 33 . 2 2 3 3 G H5' H 1 4.291 0.006 . 2 . . . . A 3 G H5' . 34258 2 34 . 2 2 3 3 G H5'' H 1 4.190 0.006 . 2 . . . . A 3 G H5'' . 34258 2 35 . 2 2 3 3 G H8 H 1 8.050 0.002 . 1 . . . . A 3 G H8 . 34258 2 36 . 2 2 3 3 G C1' C 13 86.716 0.000 . 1 . . . . A 3 G C1' . 34258 2 37 . 2 2 3 3 G C2' C 13 74.204 0.000 . 1 . . . . A 3 G C2' . 34258 2 38 . 2 2 3 3 G C3' C 13 78.027 0.000 . 1 . . . . A 3 G C3' . 34258 2 39 . 2 2 3 3 G C4' C 13 86.009 0.000 . 1 . . . . A 3 G C4' . 34258 2 40 . 2 2 3 3 G C5' C 13 67.790 0.000 . 1 . . . . A 3 G C5' . 34258 2 41 . 2 2 3 3 G C8 C 13 137.889 0.000 . 1 . . . . A 3 G C8 . 34258 2 42 . 2 2 4 4 U H1' H 1 5.927 0.002 . 1 . . . . A 4 U H1' . 34258 2 43 . 2 2 4 4 U H2' H 1 4.174 0.001 . 1 . . . . A 4 U H2' . 34258 2 44 . 2 2 4 4 U H3' H 1 4.546 0.002 . 1 . . . . A 4 U H3' . 34258 2 45 . 2 2 4 4 U H4' H 1 4.267 0.003 . 1 . . . . A 4 U H4' . 34258 2 46 . 2 2 4 4 U H5 H 1 5.035 0.012 . 1 . . . . A 4 U H5 . 34258 2 47 . 2 2 4 4 U H5' H 1 4.102 0.000 . 2 . . . . A 4 U H5' . 34258 2 48 . 2 2 4 4 U H5'' H 1 4.152 0.000 . 2 . . . . A 4 U H5'' . 34258 2 49 . 2 2 4 4 U H6 H 1 7.566 0.001 . 1 . . . . A 4 U H6 . 34258 2 50 . 2 2 4 4 U C1' C 13 89.641 0.000 . 1 . . . . A 4 U C1' . 34258 2 51 . 2 2 4 4 U C2' C 13 75.206 0.000 . 1 . . . . A 4 U C2' . 34258 2 52 . 2 2 4 4 U C3' C 13 75.785 0.000 . 1 . . . . A 4 U C3' . 34258 2 53 . 2 2 4 4 U C4' C 13 85.074 0.000 . 1 . . . . A 4 U C4' . 34258 2 54 . 2 2 4 4 U C5 C 13 104.759 0.000 . 1 . . . . A 4 U C5 . 34258 2 55 . 2 2 4 4 U C5' C 13 68.253 0.009 . 1 . . . . A 4 U C5' . 34258 2 56 . 2 2 4 4 U C6 C 13 143.849 0.000 . 1 . . . . A 4 U C6 . 34258 2 57 . 2 2 5 5 G H1' H 1 5.869 0.003 . 1 . . . . A 5 G H1' . 34258 2 58 . 2 2 5 5 G H2' H 1 4.757 0.001 . 1 . . . . A 5 G H2' . 34258 2 59 . 2 2 5 5 G H3' H 1 4.470 0.002 . 1 . . . . A 5 G H3' . 34258 2 60 . 2 2 5 5 G H4' H 1 4.295 0.001 . 1 . . . . A 5 G H4' . 34258 2 61 . 2 2 5 5 G H5' H 1 4.123 0.000 . 2 . . . . A 5 G H5' . 34258 2 62 . 2 2 5 5 G H5'' H 1 4.123 0.000 . 2 . . . . A 5 G H5'' . 34258 2 63 . 2 2 5 5 G H8 H 1 7.992 0.004 . 1 . . . . A 5 G H8 . 34258 2 64 . 2 2 5 5 G C1' C 13 90.045 0.000 . 1 . . . . A 5 G C1' . 34258 2 65 . 2 2 5 5 G C2' C 13 76.055 0.000 . 1 . . . . A 5 G C2' . 34258 2 66 . 2 2 5 5 G C3' C 13 73.014 0.000 . 1 . . . . A 5 G C3' . 34258 2 67 . 2 2 5 5 G C4' C 13 86.297 0.000 . 1 . . . . A 5 G C4' . 34258 2 68 . 2 2 5 5 G C5' C 13 67.382 0.009 . 1 . . . . A 5 G C5' . 34258 2 69 . 2 2 5 5 G C8 C 13 140.300 0.000 . 1 . . . . A 5 G C8 . 34258 2 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 34258 _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 1 _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 H # INAME 2 HC # INAME 3 C # CYANAFORMAT hHC 1 7.715 3.708 46.206 1 U 1.636E+03 2.308E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 2 7.717 3.682 46.075 1 U 1.583E+04 2.739E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 3 3.026 3.681 46.080 1 U 3.294E+03 3.315E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 4 2.851 3.680 46.070 1 U 2.887E+03 2.826E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 5 2.593 3.683 46.050 1 U 3.043E+03 2.876E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 6 1.037 3.682 46.080 1 U 8.430E+02 2.684E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 7 7.821 4.262 44.952 1 U 2.371E+03 2.375E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 8 7.824 4.243 45.002 1 U 2.533E+03 1.948E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 9 4.125 4.243 44.957 1 U 1.185E+04 4.453E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 10 3.902 4.243 44.992 1 U 5.879E+03 2.000E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 11 3.788 4.245 44.952 1 U 8.190E+04 2.553E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 12 7.816 3.808 44.972 1 U 2.812E+03 1.350E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 13 4.540 3.813 44.922 1 U 5.966E+02 1.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 14 4.453 3.809 45.072 1 U 9.703E+02 1.496E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 15 4.240 3.805 44.972 1 U 8.642E+04 1.406E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 16 4.123 3.806 45.012 1 U 7.390E+03 2.352E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 17 1.350 3.805 44.931 1 U 1.706E+03 1.244E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 18 1.351 4.243 44.899 1 U 1.493E+03 2.408E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 19 8.621 3.806 44.538 1 U 1.320E+03 1.460E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 20 3.133 3.022 42.956 1 U 5.051E+03 1.535E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 21 1.508 3.020 42.931 1 U 1.226E+03 1.736E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 22 4.337 3.013 42.780 1 U 1.691E+03 1.587E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 23 2.319 3.012 42.770 1 U 4.533E+03 1.787E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 24 2.109 3.014 42.780 1 U 1.569E+03 1.945E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 25 8.437 2.908 42.850 1 U 1.756E+03 3.506E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 26 0.529 2.908 42.810 1 U 2.772E+03 3.551E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 27 8.441 3.014 42.611 1 U 1.367E+03 1.359E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 28 7.562 3.011 42.717 1 U 1.092E+03 1.455E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 29 2.900 3.013 42.722 1 U 5.998E+04 1.635E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 30 1.915 3.012 42.697 1 U 6.333E+03 1.409E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 31 1.783 3.014 42.737 1 U 3.729E+03 1.631E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 32 1.087 3.013 42.707 1 U 4.362E+03 1.362E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 33 0.529 3.011 42.747 1 U 4.014E+03 1.444E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 34 7.927 3.012 42.436 1 U 7.473E+02 1.421E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 35 1.256 3.010 42.671 1 U 2.180E+03 1.445E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 36 1.773 2.917 42.689 1 U 1.621E+03 3.051E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 37 8.438 2.912 42.490 1 U 9.185E+02 2.755E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 38 3.017 2.912 42.666 1 U 4.776E+04 3.224E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 39 1.915 2.913 42.525 1 U 5.863E+03 2.729E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 40 1.081 2.914 42.500 1 U 3.191E+03 2.778E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 41 7.556 2.908 42.566 1 U 1.033E+03 3.330E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 42 2.327 2.907 42.510 1 U 4.796E+03 3.448E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 43 0.522 2.924 42.392 1 U 2.371E+03 2.887E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 44 2.487 2.882 42.251 1 U 2.221E+03 1.809E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 45 1.601 2.878 42.219 1 U 8.128E+03 1.761E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 46 3.030 2.917 41.941 1 U 7.462E+04 3.339E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 47 8.484 2.914 42.147 1 U 2.404E+03 3.768E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 48 4.578 2.906 42.016 1 U 1.083E+03 2.460E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 49 4.055 2.881 42.031 1 U 7.497E+02 2.002E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 50 3.192 2.396 42.026 1 U 1.952E+03 2.134E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 51 2.695 2.918 41.883 1 U 3.299E+04 3.698E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 52 2.604 2.917 41.827 1 U 1.496E+04 3.846E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 53 2.520 2.917 41.797 1 U 8.435E+03 3.787E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 54 2.168 2.918 41.737 1 U 2.670E+03 3.581E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 55 1.581 2.917 41.772 1 U 2.672E+04 4.050E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 56 1.157 2.917 41.913 1 U 3.411E+03 3.793E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 57 2.014 2.915 41.827 1 U 7.285E+03 4.146E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 58 2.857 2.394 41.858 1 U 2.874E+03 2.445E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 59 2.169 2.394 41.888 1 U 2.052E+04 2.825E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 60 1.909 2.394 41.873 1 U 5.384E+03 2.389E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 61 1.044 2.395 41.903 1 U 3.264E+04 2.521E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 62 0.678 2.395 41.893 1 U 1.163E+04 2.301E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 63 -0.859 2.394 41.903 1 U 1.349E+04 2.311E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 64 9.655 2.392 41.802 1 U 1.769E+03 2.285E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 65 7.209 2.394 41.908 1 U 2.311E+03 2.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 66 6.490 2.392 41.933 1 U 8.770E+02 2.266E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 67 3.026 2.394 41.873 1 U 5.424E+03 2.230E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 68 2.084 2.394 41.873 1 U 9.151E+03 2.501E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 69 1.735 2.393 41.832 1 U 1.788E+03 2.337E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 70 0.509 2.394 41.863 1 U 3.195E+03 2.224E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 71 9.656 1.269 41.467 1 U 1.885E+03 1.316E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 72 8.805 1.268 41.578 1 U 8.275E+02 1.343E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 73 8.444 1.268 41.558 1 U 7.088E+02 1.289E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 74 9.047 1.266 41.518 1 U 3.559E+03 1.224E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 75 7.613 1.261 41.497 1 U 2.358E+03 1.202E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 76 6.902 1.265 41.467 1 U 1.543E+03 1.115E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 77 6.486 1.266 41.512 1 U 1.646E+03 1.157E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 78 4.534 1.266 41.512 1 U 5.100E+03 1.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 79 4.303 1.265 41.497 1 U 5.285E+03 1.365E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 80 3.003 1.262 41.487 1 U 1.428E+03 1.280E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 81 2.901 1.261 41.467 1 U 3.851E+03 1.248E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 82 1.909 1.261 41.477 1 U 1.920E+03 1.600E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 83 1.785 1.266 41.467 1 U 5.099E+03 1.332E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 84 0.380 1.265 41.502 1 U 5.677E+04 1.896E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 85 4.421 1.261 41.410 1 U 4.243E+02 1.421E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 86 3.823 1.260 41.402 1 U 1.043E+03 1.423E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 87 0.510 1.260 41.413 1 U 1.901E+03 1.487E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 88 9.653 0.391 41.538 1 U 1.179E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 89 9.048 0.391 41.497 1 U 6.976E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 90 8.809 0.390 41.573 1 U 1.349E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 91 7.210 0.392 41.417 1 U 5.780E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 92 6.892 0.389 41.492 1 U 2.625E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 93 4.534 0.390 41.507 1 U 2.447E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 94 4.429 0.392 41.553 1 U 6.544E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 95 4.303 0.391 41.497 1 U 9.394E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 96 2.900 0.391 41.649 1 U 1.259E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 97 1.904 0.391 41.523 1 U 4.537E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 98 1.253 0.391 41.502 1 U 4.775E+04 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 99 0.507 0.392 41.477 1 U 1.725E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 100 7.619 0.388 41.538 1 U 6.160E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 101 7.352 0.385 41.447 1 U 6.158E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 102 6.484 0.389 41.406 1 U 5.869E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 103 3.010 0.387 41.447 1 U 5.986E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 104 3.818 0.380 41.407 1 U 4.665E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 105 8.262 2.594 41.182 1 U 3.119E+03 1.677E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 106 3.675 2.593 41.187 1 U 7.909E+02 1.776E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 107 2.514 2.597 41.182 1 U 5.079E+05 1.969E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 108 2.386 2.597 41.142 1 U 2.224E+04 1.790E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 109 2.293 2.594 41.157 1 U 8.091E+03 1.736E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 110 2.202 2.592 41.238 1 U 3.131E+03 1.883E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 111 2.031 2.591 41.318 1 U 1.416E+03 1.892E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 112 7.730 2.588 41.192 1 U 6.588E+02 1.259E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 113 4.437 2.589 41.157 1 U 8.201E+03 1.624E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 114 2.293 2.527 41.167 1 U 7.409E+03 2.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 115 2.581 2.519 41.177 1 U 4.782E+05 2.389E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 116 8.262 2.505 41.192 1 U 2.110E+03 1.935E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 117 1.044 1.262 41.329 1 U 1.700E+03 1.623E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 118 1.045 0.390 41.288 1 U 5.352E+02 1.387E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 119 1.785 0.387 41.394 1 U 1.714E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 120 6.639 2.744 40.864 1 U 7.357E+03 1.853E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 121 9.057 2.743 40.963 1 U 6.926E+02 1.576E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 122 8.486 2.741 40.883 1 U 1.250E+04 1.645E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 123 4.305 2.741 40.953 1 U 1.066E+03 1.697E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 124 2.319 2.741 40.893 1 U 1.576E+03 1.938E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 125 1.714 2.741 40.943 1 U 3.138E+03 1.683E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 126 8.486 2.536 40.908 1 U 1.028E+04 2.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 127 6.886 2.534 40.925 1 U 2.402E+03 2.394E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 128 2.732 2.535 40.878 1 U 7.863E+04 2.363E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 129 1.710 2.534 40.983 1 U 1.453E+03 2.377E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 130 8.261 2.527 41.124 1 U 2.459E+03 2.007E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 131 7.734 2.523 40.953 1 U 7.958E+02 2.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 132 4.435 2.523 41.130 1 U 9.482E+03 2.220E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 133 4.302 2.524 40.948 1 U 1.744E+03 2.156E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 134 2.121 2.525 41.124 1 U 1.744E+03 2.048E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 135 8.148 2.741 40.779 1 U 6.753E+02 1.499E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 136 6.886 2.743 40.845 1 U 1.615E+03 1.678E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 137 4.187 2.741 40.855 1 U 8.322E+03 1.591E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 138 2.523 2.743 40.855 1 U 7.681E+04 1.650E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 139 2.643 2.672 40.779 1 U 1.389E+05 1.930E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 140 4.702 2.546 40.804 1 U 3.527E+02 1.766E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 141 8.876 2.536 40.804 1 U 7.054E+02 2.323E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 142 6.640 2.537 40.835 1 U 1.137E+04 2.339E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 143 4.187 2.536 40.835 1 U 6.881E+03 3.090E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 144 1.886 2.536 40.840 1 U 1.064E+03 2.609E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 145 8.807 2.685 40.515 1 U 2.967E+03 1.408E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 146 7.818 2.687 40.515 1 U 5.195E+03 1.464E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 147 4.764 2.684 40.464 1 U 3.566E+03 1.275E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 148 2.639 2.685 40.575 1 U 1.306E+05 2.599E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 149 2.363 2.685 40.530 1 U 3.855E+03 1.516E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 150 1.875 2.686 40.485 1 U 3.174E+03 1.437E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 151 8.807 2.632 40.520 1 U 3.064E+03 1.768E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 152 4.763 2.630 40.530 1 U 3.272E+03 1.747E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 153 7.818 2.625 40.550 1 U 7.104E+03 1.411E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 154 4.299 2.625 40.485 1 U 4.746E+02 1.316E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 155 1.872 2.627 40.464 1 U 3.880E+03 1.319E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 156 8.631 2.622 40.369 1 U 7.311E+02 1.610E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 157 4.763 2.608 40.515 1 U 2.510E+03 1.328E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 158 6.908 2.917 39.666 1 U 1.546E+03 2.336E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 159 3.028 2.813 39.560 1 U 4.933E+03 2.038E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 160 4.809 2.924 39.431 1 U 7.693E+03 1.925E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 161 7.625 2.911 39.300 1 U 2.724E+03 1.559E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 162 2.800 2.911 39.396 1 U 2.231E+05 1.839E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 163 1.025 2.916 39.396 1 U 2.052E+03 1.589E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 164 6.912 2.908 39.416 1 U 1.403E+03 2.223E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 165 4.808 2.906 39.406 1 U 1.035E+04 2.372E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 166 3.027 2.905 39.290 1 U 6.180E+03 2.677E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 167 1.931 2.909 39.441 1 U 1.404E+03 2.215E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 168 2.516 2.901 39.346 1 U 1.612E+03 2.107E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 169 1.965 2.822 39.336 1 U 4.159E+02 1.593E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 170 7.633 2.813 39.376 1 U 1.618E+03 1.691E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 171 4.810 2.814 39.376 1 U 9.544E+03 1.567E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 172 2.903 2.812 39.381 1 U 2.204E+05 2.297E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 173 1.021 2.811 39.331 1 U 1.278E+03 1.603E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 174 0.501 2.815 39.304 1 U 7.740E+02 1.519E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 175 3.005 2.326 39.275 1 U 3.060E+03 1.955E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 176 2.526 2.327 39.341 1 U 6.205E+02 1.654E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 177 3.006 2.119 39.315 1 U 2.162E+03 1.826E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 178 2.884 2.116 39.255 1 U 1.372E+03 1.670E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 179 6.907 2.818 39.217 1 U 6.653E+02 1.195E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 180 2.885 2.339 39.197 1 U 2.377E+03 2.000E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 181 6.640 2.331 39.152 1 U 3.256E+03 1.515E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 182 1.989 2.330 39.147 1 U 4.197E+03 1.977E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 183 9.045 2.330 39.076 1 U 1.280E+03 1.522E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 184 8.440 2.324 39.177 1 U 8.124E+03 1.298E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 185 7.183 2.329 39.142 1 U 5.459E+03 1.267E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 186 6.402 2.329 39.172 1 U 1.953E+03 1.369E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 187 4.356 2.324 39.142 1 U 8.231E+03 1.290E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 188 3.818 2.326 39.182 1 U 1.148E+03 1.402E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 189 2.106 2.329 39.162 1 U 6.369E+04 1.581E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 190 6.525 2.323 39.046 1 U 5.136E+02 1.407E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 191 3.816 2.121 39.247 1 U 8.602E+02 1.963E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 192 1.989 2.123 39.036 1 U 5.113E+03 2.322E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 193 9.044 2.117 39.046 1 U 2.447E+03 2.014E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 194 8.440 2.117 39.162 1 U 7.600E+03 2.240E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 195 7.183 2.117 39.167 1 U 6.956E+03 2.032E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 196 6.639 2.117 39.152 1 U 5.529E+03 2.044E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 197 6.400 2.118 39.157 1 U 2.948E+03 1.976E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 198 4.356 2.117 39.167 1 U 6.959E+03 2.605E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 199 2.318 2.117 39.162 1 U 6.322E+04 2.371E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 200 1.893 2.118 39.202 1 U 1.463E+03 2.952E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 201 6.829 3.934 38.795 1 U 1.340E+03 1.664E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 202 7.666 3.930 38.786 1 U 1.507E+03 1.981E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 203 9.269 3.925 38.887 1 U 1.352E+04 1.509E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 204 7.978 3.926 38.862 1 U 6.570E+03 1.489E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 205 4.875 3.926 38.902 1 U 6.766E+03 1.566E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 206 3.101 3.926 38.887 1 U 1.283E+04 1.984E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 207 2.773 3.926 38.877 1 U 7.994E+04 1.759E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 208 2.537 3.925 38.912 1 U 5.571E+03 1.461E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 209 1.519 3.926 38.877 1 U 3.557E+03 1.685E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 210 6.845 3.917 38.897 1 U 2.282E+03 2.113E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 211 4.332 3.917 38.736 1 U 8.002E+02 3.302E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 212 4.043 3.916 38.791 1 U 2.685E+03 2.668E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 213 9.269 2.792 38.872 1 U 1.206E+04 1.648E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 214 7.976 2.793 38.882 1 U 7.459E+03 1.622E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 215 6.843 2.794 38.872 1 U 2.166E+03 1.640E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 216 4.875 2.794 38.882 1 U 1.283E+04 1.637E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 217 4.212 2.794 38.847 1 U 8.717E+02 1.593E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 218 4.039 2.793 38.897 1 U 2.507E+03 1.641E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 219 3.914 2.791 38.887 1 U 7.605E+04 1.728E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 220 3.695 2.793 38.887 1 U 8.148E+02 2.033E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 221 1.965 2.795 38.882 1 U 1.425E+03 1.610E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 222 1.517 2.794 38.882 1 U 7.051E+03 2.018E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 223 3.099 2.790 38.907 1 U 7.031E+03 1.699E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 224 4.876 2.775 38.872 1 U 1.199E+04 2.056E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 225 4.414 2.180 37.368 1 U 5.720E+03 1.794E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 226 2.003 2.179 37.368 1 U 1.086E+05 2.004E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 227 1.603 2.181 37.499 1 U 1.095E+03 2.022E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 228 4.294 2.175 37.464 1 U 9.411E+02 1.589E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 229 2.900 2.176 37.464 1 U 9.929E+02 1.792E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 230 4.299 2.007 37.378 1 U 7.043E+02 1.374E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 231 2.904 2.007 37.600 1 U 1.234E+03 1.720E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 232 4.414 2.002 37.403 1 U 5.848E+03 1.522E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 233 2.165 2.004 37.363 1 U 1.027E+05 1.689E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 234 1.354 2.006 37.428 1 U 9.140E+02 1.786E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 235 7.990 1.997 37.464 1 U 1.003E+03 2.186E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 236 8.006 2.180 37.290 1 U 9.662E+02 1.568E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 237 7.666 2.179 37.295 1 U 2.721E+03 1.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 238 4.111 2.180 37.330 1 U 6.087E+03 1.594E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 239 7.667 2.002 37.335 1 U 3.003E+03 1.686E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 240 4.110 2.004 37.345 1 U 8.474E+03 1.623E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 241 1.602 2.002 37.255 1 U 1.090E+03 2.228E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 242 6.581 2.542 35.697 1 U 9.773E+02 1.401E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 243 8.476 2.546 35.652 1 U 2.069E+03 1.623E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 244 4.458 2.543 35.617 1 U 4.887E+03 1.810E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 245 2.912 2.542 35.778 1 U 5.838E+02 1.837E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 246 1.528 2.534 35.639 1 U 4.328E+04 2.046E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 247 0.525 2.540 35.652 1 U 2.761E+03 1.865E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 248 10.306 2.528 35.652 1 U 1.691E+03 1.728E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 249 7.611 2.532 35.682 1 U 3.474E+03 1.647E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 250 7.504 2.531 35.511 1 U 3.569E+03 1.678E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 251 6.772 2.533 35.652 1 U 1.912E+03 1.687E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 252 6.394 2.532 35.657 1 U 5.614E+03 1.640E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 253 4.458 2.527 35.627 1 U 4.608E+03 2.067E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 254 6.595 1.548 35.561 1 U 9.101E+02 1.704E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 255 7.928 1.544 35.567 1 U 8.143E+02 2.098E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 256 7.612 1.542 35.657 1 U 3.793E+03 2.036E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 257 6.771 1.542 35.617 1 U 8.989E+02 1.983E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 258 0.528 1.542 35.607 1 U 5.948E+03 2.046E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 259 10.311 1.537 35.521 1 U 8.433E+02 1.827E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 260 8.480 1.539 35.632 1 U 1.142E+03 1.873E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 261 6.395 1.540 35.617 1 U 5.383E+03 1.771E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 262 3.908 1.537 35.652 1 U 6.134E+02 1.845E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 263 2.524 1.540 35.617 1 U 4.321E+04 5.050E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 264 1.107 1.538 35.597 1 U 9.612E+02 3.227E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 265 4.455 1.533 35.627 1 U 2.975E+03 1.778E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 266 6.603 1.539 35.458 1 U 6.578E+02 1.537E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 267 7.668 2.125 34.965 1 U 1.393E+03 2.066E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 268 4.490 2.123 35.058 1 U 1.731E+03 2.113E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 269 1.954 2.124 34.952 1 U 1.894E+05 2.474E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 270 7.663 1.965 34.962 1 U 1.548E+03 1.835E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 271 2.112 1.966 34.937 1 U 1.906E+05 2.075E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 272 1.708 1.966 34.962 1 U 1.123E+04 2.221E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 273 5.112 2.123 34.843 1 U 2.729E+03 2.318E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 274 4.049 2.121 34.687 1 U 2.007E+03 2.347E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 275 1.711 2.123 34.929 1 U 9.547E+03 2.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 276 4.046 1.989 34.712 1 U 2.311E+03 2.809E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 277 5.118 1.964 34.808 1 U 2.139E+03 1.814E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 278 4.490 1.967 34.778 1 U 1.328E+03 1.798E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 279 4.052 1.967 34.823 1 U 1.537E+03 1.957E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 280 9.774 1.959 34.712 1 U 5.386E+02 1.707E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 281 7.999 4.369 34.234 1 U -1.931E+03 2.751E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 282 7.436 4.369 34.279 1 U -2.472E+03 2.463E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 283 4.056 4.367 34.229 1 U -4.482E+03 3.189E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 284 1.987 4.371 34.133 1 U -9.184E+02 2.906E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 285 1.144 4.369 34.193 1 U -5.475E+04 2.460E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 286 2.100 1.889 33.380 1 U 7.839E+03 3.145E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 287 9.045 1.885 33.230 1 U 1.625E+03 2.699E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 288 1.159 1.730 33.339 1 U 8.407E+03 1.721E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 289 4.424 1.556 33.316 1 U 7.651E+03 1.669E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 290 2.910 1.555 33.516 1 U 2.041E+03 1.760E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 291 3.615 1.028 33.460 1 U 1.072E+03 1.540E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 292 2.388 1.032 33.315 1 U 1.388E+03 1.546E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 293 7.176 1.021 33.359 1 U 1.186E+04 1.320E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 294 4.808 1.025 33.339 1 U 3.138E+03 1.341E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 295 4.482 1.022 33.506 1 U 9.621E+02 1.703E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 296 2.830 1.025 33.375 1 U 5.938E+03 1.594E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 297 0.675 1.021 33.365 1 U 1.602E+04 1.610E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 298 0.506 1.022 33.344 1 U 6.338E+04 1.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 299 -0.860 1.020 33.349 1 U 7.051E+03 1.361E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 300 6.941 1.018 33.339 1 U 7.988E+02 1.160E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 301 7.176 0.516 33.365 1 U 1.070E+04 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 302 6.942 0.518 33.329 1 U 1.263E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 303 6.487 0.518 33.370 1 U 2.321E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 304 5.119 0.517 33.359 1 U 7.350E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 305 4.484 0.518 33.316 1 U 8.439E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 306 3.613 0.517 33.511 1 U 1.292E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 307 3.031 0.517 33.349 1 U 2.206E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 308 2.830 0.517 33.354 1 U 9.558E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 309 1.016 0.516 33.349 1 U 6.720E+04 1.114E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 310 0.674 0.516 33.359 1 U 2.499E+04 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 311 -0.860 0.517 33.359 1 U 1.393E+04 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 312 4.808 0.516 33.349 1 U 4.039E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 313 2.379 0.516 33.349 1 U 1.590E+03 1.196E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 314 9.044 1.982 33.281 1 U 2.242E+03 3.257E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 315 6.642 1.984 33.110 1 U 1.661E+03 3.140E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 316 4.279 1.983 33.065 1 U 2.668E+03 3.144E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 317 1.883 1.987 33.075 1 U 1.708E+05 3.202E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 318 1.733 1.985 33.221 1 U 2.583E+04 4.657E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 319 8.098 1.977 33.140 1 U 1.483E+03 2.616E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 320 8.098 1.905 33.011 1 U 1.029E+03 2.254E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 321 4.284 1.899 33.055 1 U 4.326E+03 2.229E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 322 6.639 1.896 33.181 1 U 6.270E+02 1.930E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 323 2.733 1.896 33.075 1 U 2.176E+03 2.175E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 324 2.904 1.733 33.201 1 U 1.954E+03 1.775E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 325 8.832 1.730 33.291 1 U 1.063E+04 1.626E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 326 4.422 1.732 33.251 1 U 5.205E+03 1.649E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 327 2.700 1.729 33.140 1 U 3.368E+02 1.715E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 328 1.545 1.731 33.256 1 U 9.889E+04 2.471E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 329 1.341 1.730 33.256 1 U 1.565E+04 1.852E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 330 8.832 1.555 33.286 1 U 9.427E+03 2.010E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 331 1.720 1.555 33.286 1 U 1.002E+05 2.723E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 332 1.344 1.555 33.296 1 U 2.170E+04 2.604E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 333 1.156 1.556 33.276 1 U 1.196E+04 2.074E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 334 5.117 1.025 33.281 1 U 4.741E+02 1.364E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 335 3.029 1.022 33.226 1 U 1.004E+03 1.533E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 336 1.916 0.506 33.286 1 U 5.619E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 337 6.764 1.989 33.007 1 U 2.365E+03 2.551E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 338 1.588 1.984 32.992 1 U 2.099E+03 2.808E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 339 6.519 1.973 33.027 1 U 9.947E+02 1.938E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 340 2.926 1.681 32.780 1 U 4.937E+03 1.945E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 341 1.804 1.680 32.810 1 U 1.115E+05 2.047E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 342 1.504 1.680 32.815 1 U 3.553E+04 2.785E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 343 4.032 2.365 32.551 1 U 2.746E+03 1.423E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 344 4.212 1.997 32.697 1 U 1.580E+03 3.362E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 345 4.028 1.991 32.616 1 U 5.759E+03 3.428E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 346 7.648 1.903 32.737 1 U 7.299E+02 2.526E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 347 2.111 1.708 32.611 1 U 7.751E+03 2.067E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 348 4.500 1.683 32.737 1 U 5.508E+03 2.135E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 349 7.666 3.114 32.256 1 U 1.576E+04 1.898E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 350 4.310 3.114 32.311 1 U 1.057E+04 2.100E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 351 3.914 3.114 32.251 1 U 1.682E+04 2.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 352 2.762 3.113 32.372 1 U 7.627E+03 2.754E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 353 1.521 3.111 32.362 1 U 1.071E+03 1.945E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 354 2.523 2.821 32.246 1 U 4.114E+03 2.063E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 355 9.264 2.542 32.266 1 U 1.017E+03 2.495E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 356 8.481 2.543 32.271 1 U 1.030E+03 2.490E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 357 7.991 2.543 32.286 1 U 1.147E+04 2.465E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 358 7.667 2.543 32.291 1 U 8.418E+03 2.506E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 359 6.833 2.542 32.286 1 U 1.878E+03 2.493E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 360 4.311 2.542 32.291 1 U 2.014E+04 2.573E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 361 3.915 2.543 32.276 1 U 1.149E+04 2.554E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 362 3.102 2.543 32.281 1 U 9.355E+04 2.508E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 363 2.902 2.542 32.286 1 U 1.281E+03 2.674E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 364 2.752 2.542 32.392 1 U 4.640E+03 2.643E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 365 4.414 2.363 32.432 1 U 2.389E+04 2.258E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 366 4.213 2.363 32.291 1 U 5.537E+03 2.185E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 367 1.988 2.363 32.372 1 U 1.120E+05 2.276E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 368 3.027 2.226 32.296 1 U 3.240E+03 2.088E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 369 1.600 2.001 32.493 1 U 1.585E+03 3.071E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 370 7.426 1.997 32.412 1 U 1.487E+03 3.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 371 4.414 1.998 32.407 1 U 1.526E+04 3.263E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 372 2.352 1.998 32.412 1 U 1.233E+05 3.272E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 373 1.147 1.995 32.447 1 U 3.191E+03 3.318E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 374 7.656 1.930 32.488 1 U 5.634E+02 2.856E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 375 9.787 1.912 32.463 1 U 2.604E+03 3.008E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 376 5.121 1.911 32.382 1 U 8.823E+03 2.960E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 377 3.921 1.913 32.468 1 U 4.713E+02 3.007E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 378 2.119 1.912 32.503 1 U 1.417E+04 2.995E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 379 1.693 1.912 32.412 1 U 1.153E+05 3.337E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 380 4.326 1.909 32.296 1 U 1.006E+03 2.864E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 381 4.051 1.909 32.347 1 U 4.727E+03 2.705E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 382 3.825 1.908 32.463 1 U 1.270E+03 2.769E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 383 7.503 1.897 32.402 1 U 5.737E+02 2.569E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 384 8.261 1.869 32.246 1 U 1.269E+03 2.213E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 385 3.026 1.870 32.246 1 U 4.732E+03 2.473E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 386 5.119 1.706 32.377 1 U 9.626E+03 1.717E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 387 4.050 1.706 32.412 1 U 5.359E+03 1.737E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 388 9.778 1.705 32.347 1 U 3.718E+03 2.127E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 389 7.662 1.703 32.387 1 U 1.636E+03 2.140E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 390 1.905 1.706 32.402 1 U 1.260E+05 2.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 391 9.270 3.114 32.097 1 U 2.587E+03 2.140E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 392 7.990 3.114 32.133 1 U 1.126E+04 2.354E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 393 4.121 3.113 32.168 1 U 8.675E+02 2.185E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 394 2.542 3.114 32.122 1 U 7.859E+04 2.533E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 395 8.478 3.111 32.188 1 U 8.728E+02 1.775E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 396 9.269 2.821 32.117 1 U 1.449E+03 2.047E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 397 8.883 2.821 32.148 1 U 1.251E+04 1.983E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 398 8.486 2.822 32.163 1 U 8.245E+03 2.085E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 399 7.665 2.822 32.158 1 U 3.111E+03 2.127E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 400 4.429 2.820 31.990 1 U 9.610E+02 2.155E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 401 4.111 2.822 32.133 1 U 9.439E+03 2.029E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 402 2.791 2.821 32.138 1 U 1.459E+05 3.746E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 403 1.999 2.822 32.173 1 U 1.216E+03 2.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 404 1.521 2.824 32.052 1 U 1.234E+03 2.208E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 405 6.892 2.820 32.122 1 U 5.647E+03 2.156E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 406 4.569 2.819 32.117 1 U 4.065E+03 2.477E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 407 4.304 2.818 32.067 1 U 2.232E+03 2.180E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 408 9.269 2.776 32.203 1 U 1.125E+03 2.071E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 409 4.569 2.777 32.133 1 U 5.614E+03 2.243E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 410 4.429 2.777 32.107 1 U 1.036E+03 2.139E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 411 4.303 2.777 32.102 1 U 3.420E+03 2.080E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 412 1.524 2.776 32.067 1 U 1.035E+03 2.408E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 413 8.883 2.776 32.143 1 U 1.433E+04 2.245E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 414 8.486 2.775 32.153 1 U 7.634E+03 2.259E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 415 7.664 2.776 32.133 1 U 2.961E+03 2.216E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 416 6.891 2.775 32.138 1 U 8.568E+03 2.223E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 417 6.634 2.776 32.092 1 U 6.963E+02 2.203E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 418 4.110 2.775 32.122 1 U 8.446E+03 2.212E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 419 2.532 2.776 32.178 1 U 5.457E+03 2.233E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 420 4.888 2.539 32.228 1 U 7.992E+02 3.118E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 421 7.173 2.315 32.042 1 U 3.100E+03 2.234E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 422 4.486 2.315 32.027 1 U 2.186E+04 2.274E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 423 1.742 2.315 32.017 1 U 8.537E+04 2.422E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 424 5.117 2.306 32.193 1 U 9.820E+02 1.698E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 425 3.610 2.310 32.007 1 U 2.378E+03 2.038E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 426 8.250 2.226 32.138 1 U 1.613E+03 1.934E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 427 4.268 2.227 32.092 1 U 2.004E+04 2.352E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 428 3.616 2.228 32.082 1 U 3.976E+03 1.989E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 429 1.864 2.227 32.138 1 U 1.041E+05 2.298E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 430 4.686 2.214 31.981 1 U 1.348E+03 1.614E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 431 4.567 2.214 32.107 1 U 9.688E+03 1.736E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 432 3.867 2.215 32.168 1 U 3.408E+03 1.563E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 433 4.687 2.154 32.067 1 U 1.952E+03 1.802E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 434 4.566 2.156 32.127 1 U 1.273E+04 1.921E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 435 3.866 2.155 32.138 1 U 4.200E+03 1.833E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 436 3.617 2.154 32.007 1 U 8.177E+02 1.988E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 437 1.952 2.157 32.092 1 U 2.352E+04 1.951E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 438 3.611 1.878 32.168 1 U 3.566E+03 2.694E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 439 4.269 1.870 32.228 1 U 8.951E+03 2.272E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 440 2.215 1.870 32.168 1 U 8.276E+04 2.387E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 441 2.062 1.871 32.153 1 U 2.928E+04 2.649E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 442 7.176 1.754 32.037 1 U 3.754E+03 1.690E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 443 4.486 1.754 32.042 1 U 1.181E+04 1.790E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 444 3.903 1.756 32.092 1 U 2.474E+03 1.683E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 445 3.609 1.755 32.022 1 U 4.669E+03 1.713E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 446 2.302 1.754 32.037 1 U 9.182E+04 1.871E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 447 2.031 1.755 31.986 1 U 1.620E+04 1.979E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 448 6.826 3.120 31.777 1 U 2.123E+03 1.543E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 449 2.898 3.118 31.918 1 U 3.319E+03 3.039E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 450 1.158 2.814 31.913 1 U 4.566E+02 1.856E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 451 7.508 2.625 31.698 1 U 9.630E+02 1.681E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 452 7.508 2.608 31.717 1 U 9.086E+02 1.594E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 453 3.901 2.316 31.843 1 U 3.365E+03 1.965E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 454 3.608 2.318 31.933 1 U 2.177E+03 1.996E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 455 2.018 2.314 31.954 1 U 1.762E+04 2.146E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 456 1.528 2.319 31.898 1 U 1.195E+03 2.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 457 9.264 2.150 31.722 1 U 1.106E+03 1.599E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 458 8.265 1.888 31.949 1 U 7.247E+02 1.622E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 459 0.534 1.740 31.878 1 U 1.170E+03 1.987E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 460 6.929 3.178 31.447 1 U 4.903E+02 1.342E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 461 4.882 3.115 31.588 1 U 2.345E+04 1.984E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 462 2.603 3.117 31.598 1 U 1.089E+05 2.639E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 463 2.115 3.116 31.634 1 U 9.983E+02 2.097E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 464 3.306 3.023 31.432 1 U 2.060E+03 1.383E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 465 2.728 2.623 31.563 1 U 5.495E+03 1.698E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 466 8.098 2.610 31.593 1 U 7.057E+03 1.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 467 7.976 2.615 31.558 1 U 3.327E+03 1.604E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 468 6.833 2.616 31.568 1 U 1.430E+03 1.557E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 469 4.882 2.612 31.568 1 U 1.966E+04 1.523E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 470 4.304 2.618 31.413 1 U 6.741E+02 1.551E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 471 3.106 2.616 31.573 1 U 1.080E+05 1.786E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 472 2.901 2.610 31.493 1 U 1.577E+03 1.943E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 473 8.880 2.608 31.639 1 U 8.767E+02 1.636E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 474 4.708 2.497 31.588 1 U 1.893E+03 1.404E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 475 4.431 2.496 31.513 1 U 1.386E+03 1.705E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 476 2.349 2.497 31.548 1 U 1.667E+05 1.436E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 477 8.165 2.495 31.548 1 U 2.178E+03 1.475E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 478 2.701 2.493 31.498 1 U 1.030E+03 1.477E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 479 2.607 2.494 31.518 1 U 6.858E+03 1.839E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 480 1.888 2.496 31.548 1 U 2.470E+04 1.653E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 481 1.582 2.495 31.689 1 U 2.054E+03 1.611E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 482 8.164 2.363 31.588 1 U 1.829E+03 1.902E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 483 4.704 2.363 31.644 1 U 1.617E+03 1.962E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 484 2.482 2.359 31.573 1 U 1.725E+05 2.279E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 485 1.888 2.361 31.669 1 U 2.774E+04 2.267E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 486 4.685 2.136 31.669 1 U 1.841E+03 3.030E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 487 7.350 3.197 31.253 1 U 5.848E+03 1.528E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 488 8.825 3.183 31.273 1 U 6.200E+03 1.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 489 7.218 3.187 31.223 1 U 3.466E+03 1.480E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 490 5.105 3.187 31.253 1 U 1.856E+04 1.548E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 491 3.010 3.188 31.253 1 U 1.143E+05 2.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 492 7.351 3.181 31.243 1 U 6.449E+03 1.530E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 493 7.218 3.028 31.208 1 U 4.081E+03 1.841E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 494 2.700 3.028 31.193 1 U 1.250E+03 2.059E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 495 8.825 3.023 31.253 1 U 6.047E+03 1.940E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 496 7.349 3.023 31.258 1 U 5.201E+03 1.842E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 497 5.105 3.024 31.233 1 U 1.916E+04 1.920E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 498 3.176 3.022 31.238 1 U 1.106E+05 2.511E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 499 7.218 3.016 31.248 1 U 4.170E+03 1.955E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 500 2.822 2.625 31.430 1 U 1.438E+03 1.895E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 501 1.893 2.609 31.374 1 U 7.732E+02 1.525E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 502 4.429 2.503 31.283 1 U 1.478E+03 1.800E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 503 2.701 2.505 31.152 1 U 9.160E+02 1.503E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 504 2.120 2.497 31.319 1 U 1.630E+03 2.136E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 505 9.053 2.359 31.425 1 U 9.293E+02 2.018E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 506 2.612 2.357 31.243 1 U 4.625E+03 2.924E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 507 2.381 3.185 31.069 1 U 2.006E+03 1.483E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 508 -0.851 3.183 31.047 1 U 6.062E+02 1.578E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 509 2.379 3.026 31.094 1 U 1.923E+03 1.570E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 510 2.799 3.019 31.094 1 U 1.852E+03 1.604E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 511 -0.858 3.020 31.059 1 U 7.216E+02 1.642E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 512 4.308 3.115 30.628 1 U 3.245E+03 1.652E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 513 1.886 3.115 30.830 1 U 6.746E+02 1.692E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 514 9.046 1.920 30.704 1 U 3.679E+03 2.414E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 515 8.101 1.920 30.820 1 U 3.809E+03 2.363E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 516 1.720 1.920 30.607 1 U 7.688E+04 3.155E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 517 6.763 1.907 30.885 1 U 1.560E+03 2.420E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 518 6.641 1.905 30.749 1 U 5.701E+02 1.637E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 519 9.045 1.728 30.759 1 U 6.079E+03 1.402E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 520 8.099 1.727 30.724 1 U 6.122E+03 1.330E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 521 6.644 1.726 30.785 1 U 5.029E+02 1.400E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 522 4.289 1.728 30.860 1 U 8.563E+03 1.339E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 523 1.901 1.729 30.724 1 U 1.228E+05 1.588E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 524 2.733 1.723 30.669 1 U 2.077E+03 1.393E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 525 9.779 3.287 30.525 1 U 1.304E+04 1.362E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 526 9.039 3.287 30.515 1 U 1.444E+03 1.446E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 527 8.890 3.288 30.505 1 U 1.923E+04 1.412E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 528 8.441 3.289 30.369 1 U 1.006E+03 1.368E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 529 8.098 3.288 30.480 1 U 4.304E+03 1.296E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 530 7.510 3.287 30.495 1 U 1.172E+04 1.396E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 531 6.923 3.288 30.540 1 U 3.847E+03 1.335E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 532 5.120 3.288 30.480 1 U 1.011E+03 1.381E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 533 4.481 3.288 30.535 1 U 4.229E+02 1.320E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 534 4.049 3.287 30.530 1 U 4.443E+03 1.396E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 535 3.816 3.287 30.555 1 U 6.572E+03 1.882E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 536 3.103 3.287 30.515 1 U 7.487E+04 1.544E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 537 2.798 3.286 30.586 1 U 9.924E+02 1.526E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 538 1.517 3.287 30.505 1 U 7.187E+03 1.412E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 539 9.780 3.114 30.555 1 U 1.571E+04 2.138E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 540 8.890 3.114 30.515 1 U 1.283E+04 2.046E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 541 8.443 3.114 30.455 1 U 1.590E+03 2.071E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 542 7.510 3.114 30.545 1 U 7.600E+03 2.062E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 543 4.044 3.115 30.465 1 U 2.097E+03 2.169E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 544 3.816 3.113 30.530 1 U 1.080E+04 2.232E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 545 3.276 3.114 30.510 1 U 8.987E+04 2.027E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 546 6.922 3.112 30.535 1 U 7.176E+03 1.789E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 547 5.120 3.111 30.596 1 U 1.523E+03 1.880E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 548 1.519 3.113 30.570 1 U 9.183E+03 2.035E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 549 7.675 4.423 30.258 1 U -1.107E+03 2.977E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 550 4.202 4.426 30.089 1 U -1.270E+04 4.074E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 551 4.112 4.427 30.175 1 U -4.156E+03 3.800E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 552 7.436 4.424 30.215 1 U -2.372E+03 3.462E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 553 2.906 4.422 30.301 1 U -7.510E+02 3.364E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 554 9.056 3.112 30.230 1 U 1.268E+03 2.063E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 555 4.065 1.925 30.020 1 U 8.523E+02 3.175E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 556 2.900 1.926 30.140 1 U 4.639E+03 3.222E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 557 1.258 1.926 30.240 1 U 2.286E+03 3.366E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 558 1.095 1.925 30.165 1 U 5.583E+03 3.321E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 559 1.090 1.797 30.145 1 U 3.995E+03 1.613E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 560 8.004 4.425 30.041 1 U -2.978E+03 3.605E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 561 4.886 4.426 30.031 1 U -1.808E+03 3.687E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 562 4.288 4.426 30.036 1 U -2.277E+04 3.804E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 563 4.026 4.425 29.996 1 U -6.191E+03 5.198E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 564 2.352 4.426 29.956 1 U -5.305E+04 3.582E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 565 2.166 4.425 30.046 1 U -1.467E+04 3.641E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 566 1.990 4.426 29.986 1 U -4.212E+04 3.750E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 567 1.624 2.111 29.875 1 U 4.035E+03 2.981E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 568 7.487 1.997 29.880 1 U 1.092E+03 2.690E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 569 7.352 1.937 30.011 1 U 6.277E+02 2.075E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 570 9.659 1.932 29.971 1 U 2.050E+03 3.558E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 571 7.664 1.929 29.976 1 U 4.626E+03 3.512E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 572 6.486 1.931 30.016 1 U 3.791E+03 3.591E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 573 3.005 1.932 30.082 1 U 6.318E+03 3.676E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 574 7.933 1.927 29.875 1 U 3.133E+03 2.666E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 575 1.787 1.928 30.001 1 U 7.233E+04 2.744E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 576 0.530 1.927 29.875 1 U 3.775E+03 2.742E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 577 9.653 1.921 30.041 1 U 2.244E+03 2.946E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 578 4.431 1.907 29.820 1 U 3.135E+03 3.235E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 579 1.586 1.903 29.986 1 U 8.379E+03 2.712E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 580 7.660 1.798 29.951 1 U 2.364E+03 1.558E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 581 4.309 1.797 30.031 1 U 3.585E+03 1.599E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 582 2.900 1.796 30.041 1 U 4.146E+03 1.629E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 583 1.915 1.797 29.936 1 U 5.591E+04 1.935E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 584 9.658 1.791 29.981 1 U 2.940E+03 1.372E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 585 7.933 1.795 29.971 1 U 4.595E+03 1.457E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 586 6.486 1.793 30.067 1 U 2.639E+03 1.449E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 587 3.005 1.795 30.016 1 U 4.090E+03 1.484E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 588 1.254 1.788 30.062 1 U 2.968E+03 1.458E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 589 0.525 1.791 29.981 1 U 3.721E+03 1.499E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 590 4.437 4.162 29.716 1 U -3.784E+03 3.176E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 591 6.770 3.899 29.580 1 U -1.109E+03 2.172E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 592 7.817 3.895 29.605 1 U -1.152E+03 1.898E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 593 7.093 3.895 29.641 1 U -1.601E+03 1.912E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 594 1.927 2.106 29.782 1 U 1.643E+05 2.595E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 595 1.709 2.104 29.616 1 U 7.252E+03 2.036E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 596 1.532 2.105 29.641 1 U 6.711E+03 2.314E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 597 1.711 2.024 29.546 1 U 7.253E+03 2.955E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 598 1.531 2.020 29.565 1 U 6.904E+03 2.909E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 599 8.892 2.012 29.477 1 U 6.386E+02 2.999E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 600 7.492 1.978 29.508 1 U 4.342E+02 2.356E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 601 4.328 1.936 29.807 1 U 1.324E+04 3.296E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 602 8.162 1.903 29.721 1 U 1.186E+04 2.244E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 603 4.703 1.901 29.605 1 U 8.709E+03 2.314E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 604 2.482 1.900 29.807 1 U 1.520E+04 2.654E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 605 2.349 1.902 29.721 1 U 1.798E+04 2.287E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 606 8.475 4.153 29.406 1 U -9.453E+03 1.853E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 607 7.820 4.152 29.527 1 U -1.884E+03 1.643E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 608 6.775 4.152 29.291 1 U -1.283E+03 1.845E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 609 4.790 4.151 29.356 1 U -1.237E+03 1.749E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 610 4.256 4.153 29.411 1 U -2.307E+04 1.985E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 611 3.882 4.154 29.396 1 U -1.343E+05 2.122E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 612 8.476 3.896 29.417 1 U -5.972E+03 2.507E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 613 4.460 3.900 29.477 1 U -1.327E+03 2.543E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 614 4.252 3.896 29.417 1 U -2.398E+04 2.434E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 615 4.141 3.896 29.406 1 U -1.163E+05 2.729E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 616 7.212 3.880 29.311 1 U -9.755E+02 2.024E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 617 1.943 3.878 29.386 1 U -1.879E+03 2.322E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 618 4.049 2.109 29.462 1 U 1.366E+04 3.042E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 619 7.505 2.104 29.457 1 U 2.819E+03 2.274E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 620 1.271 2.106 29.512 1 U 1.214E+04 2.426E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 621 7.510 2.022 29.462 1 U 2.386E+03 2.308E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 622 4.463 2.020 29.286 1 U 4.921E+02 2.338E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 623 4.050 2.024 29.487 1 U 1.570E+04 2.320E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 624 1.268 2.024 29.326 1 U 1.563E+04 2.278E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 625 1.167 1.595 29.321 1 U 1.278E+04 1.989E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 626 4.812 1.049 29.306 1 U 2.895E+03 1.721E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 627 2.824 1.045 29.346 1 U 5.647E+02 1.680E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 628 7.207 4.153 29.268 1 U -8.152E+02 1.735E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 629 3.890 3.179 29.122 1 U 1.125E+03 1.817E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 630 4.415 1.597 29.175 1 U 1.321E+03 1.809E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 631 2.902 1.597 29.248 1 U 1.364E+04 2.489E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 632 2.060 1.595 29.051 1 U 3.520E+03 2.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 633 1.889 1.591 29.127 1 U 3.593E+03 2.343E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 634 1.714 1.596 29.202 1 U 1.967E+04 2.353E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 635 1.365 1.596 29.187 1 U 2.191E+04 2.861E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 636 2.772 1.589 29.142 1 U 9.756E+02 2.442E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 637 0.506 1.069 29.102 1 U 8.209E+03 1.562E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 638 -0.860 1.064 29.238 1 U 9.334E+03 1.555E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 639 9.651 1.055 29.223 1 U 1.828E+03 1.704E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 640 7.191 1.054 29.167 1 U 1.407E+03 1.781E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 641 2.381 1.055 29.248 1 U 1.245E+04 1.695E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 642 0.674 1.054 29.243 1 U 1.034E+04 1.762E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 643 9.267 4.579 28.767 1 U -4.628E+03 4.910E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 644 2.185 4.579 28.761 1 U -5.242E+04 4.914E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 645 1.948 4.579 28.723 1 U -2.382E+03 5.218E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 646 1.341 4.583 28.751 1 U -1.593E+03 5.007E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 647 1.550 4.577 28.710 1 U -9.212E+02 5.305E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 648 7.332 3.700 28.827 1 U 5.985E+03 1.911E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 649 6.771 3.697 28.827 1 U 2.555E+03 1.869E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 650 7.505 3.690 28.923 1 U 3.258E+03 1.396E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 651 4.606 3.693 28.852 1 U 8.505E+03 1.793E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 652 3.164 3.691 28.842 1 U 7.756E+04 2.111E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 653 7.506 3.182 28.918 1 U 7.476E+03 1.678E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 654 7.330 3.179 28.837 1 U 2.496E+03 1.633E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 655 6.772 3.180 28.827 1 U 4.491E+03 1.527E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 656 4.608 3.178 28.867 1 U 9.605E+03 1.575E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 657 3.680 3.178 28.867 1 U 7.580E+04 1.920E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 658 2.157 1.614 28.832 1 U 2.244E+03 1.980E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 659 1.903 1.613 28.785 1 U 2.678E+03 3.629E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 660 1.306 1.609 28.837 1 U 1.391E+04 1.829E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 661 1.198 1.610 28.898 1 U 9.344E+03 1.956E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 662 2.064 1.606 28.740 1 U 3.801E+03 2.053E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 663 8.868 1.591 28.953 1 U 5.718E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 664 2.166 1.067 28.918 1 U 8.443E+02 1.337E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 665 2.840 4.286 28.638 1 U -1.259E+03 2.873E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 666 4.481 3.688 28.653 1 U 4.727E+02 1.355E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 667 4.052 1.614 28.633 1 U 3.290E+03 1.853E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 668 1.996 1.612 28.573 1 U 4.100E+03 2.191E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 669 1.217 1.613 28.628 1 U 9.024E+03 1.971E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 670 1.996 1.544 28.507 1 U 2.751E+03 2.254E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 671 2.086 1.537 28.507 1 U 1.578E+03 2.407E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 672 4.056 1.531 28.573 1 U 2.642E+03 2.180E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 673 2.869 1.530 28.527 1 U 5.965E+03 2.437E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 674 1.299 1.529 28.557 1 U 9.959E+03 2.613E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 675 7.509 1.525 28.588 1 U 5.692E+02 1.610E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 676 1.229 1.524 28.643 1 U 7.822E+03 2.107E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 677 7.615 0.543 28.477 1 U 3.957E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 678 7.339 0.533 28.507 1 U 3.441E+02 1.133E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 679 3.871 4.580 28.353 1 U -2.140E+03 5.105E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 680 8.259 4.281 28.368 1 U -2.755E+04 3.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 681 3.617 4.281 28.273 1 U -4.939E+03 3.072E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 682 3.025 4.281 28.313 1 U -2.653E+03 2.970E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 683 2.216 4.281 28.414 1 U -4.114E+04 3.403E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 684 2.062 4.280 28.384 1 U -5.927E+03 2.890E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 685 1.871 4.281 28.399 1 U -2.401E+04 2.928E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 686 2.090 1.525 28.429 1 U 2.878E+03 1.818E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 687 7.929 1.095 28.217 1 U 2.017E+03 1.337E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 688 7.205 1.100 28.404 1 U 6.412E+02 1.373E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 689 7.112 1.100 28.328 1 U 1.684E+03 1.435E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 690 4.310 1.097 28.333 1 U 6.116E+03 1.447E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 691 3.003 1.100 28.389 1 U 3.872E+03 1.571E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 692 2.901 1.099 28.363 1 U 2.533E+03 1.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 693 1.916 1.101 28.338 1 U 4.434E+03 1.590E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 694 1.784 1.099 28.227 1 U 2.932E+03 1.456E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 695 1.528 1.099 28.449 1 U 7.315E+02 2.065E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 696 0.525 1.099 28.343 1 U 2.961E+04 1.687E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 697 7.331 1.095 28.338 1 U 1.225E+03 1.646E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 698 7.932 0.536 28.298 1 U 3.239E+03 1.232E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 699 7.176 0.540 28.384 1 U 4.983E+02 1.259E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 700 7.111 0.541 28.237 1 U 4.937E+02 1.346E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 701 4.312 0.535 28.288 1 U 2.076E+03 1.243E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 702 3.002 0.535 28.268 1 U 2.216E+03 1.239E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 703 1.914 0.536 28.263 1 U 2.695E+03 1.350E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 704 1.782 0.537 28.303 1 U 4.411E+03 1.254E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 705 1.528 0.535 28.232 1 U 3.354E+03 1.522E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 706 1.088 0.536 28.293 1 U 2.441E+04 1.172E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 707 2.902 0.534 28.288 1 U 3.287E+03 1.225E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 708 2.519 0.533 28.202 1 U 1.249E+03 1.209E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 709 6.947 4.500 27.993 1 U -2.198E+03 4.936E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 710 3.879 4.281 28.164 1 U -3.919E+03 2.858E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 711 4.112 2.103 28.149 1 U 9.640E+03 2.646E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 712 2.908 2.104 27.948 1 U 1.775E+03 2.430E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 713 7.666 2.099 28.038 1 U 1.944E+03 2.431E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 714 8.483 2.052 28.074 1 U 8.112E+02 1.360E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 715 1.515 4.502 27.764 1 U -1.505E+03 4.818E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 716 9.782 4.498 27.779 1 U -3.454E+03 3.623E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 717 7.176 4.499 27.854 1 U -5.454E+04 3.677E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 718 5.120 4.499 27.844 1 U -3.752E+04 3.782E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 719 4.361 4.499 27.779 1 U -2.239E+04 5.983E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 720 3.894 4.500 27.849 1 U -3.371E+03 4.191E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 721 2.304 4.499 27.844 1 U -3.844E+04 4.050E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 722 2.016 4.499 27.870 1 U -6.077E+03 3.776E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 723 1.906 4.499 27.860 1 U -7.391E+03 3.869E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 724 1.735 4.499 27.865 1 U -1.932E+04 3.726E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 725 0.506 4.499 27.849 1 U -3.014E+03 3.665E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 726 2.803 2.110 27.739 1 U 7.094E+02 3.154E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 727 7.671 2.050 27.809 1 U 2.058E+03 1.631E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 728 4.111 2.050 27.875 1 U 8.165E+03 1.790E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 729 2.906 2.052 27.658 1 U 2.494E+03 1.802E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 730 3.598 4.500 27.605 1 U -2.629E+03 3.179E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 731 2.817 4.499 27.514 1 U -2.233E+03 3.200E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 732 4.356 2.109 27.529 1 U 3.289E+03 2.704E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 733 7.994 2.091 27.650 1 U 5.664E+02 1.868E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 734 4.482 2.028 27.384 1 U 5.055E+03 1.746E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 735 7.436 4.298 27.159 1 U -6.748E+03 3.168E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 736 4.407 4.299 27.149 1 U -2.370E+04 5.756E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 737 2.106 4.299 27.295 1 U -1.474E+03 3.295E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 738 1.985 4.298 27.144 1 U -3.761E+03 3.143E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 739 4.873 2.078 27.102 1 U 1.473E+03 2.147E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 740 2.807 2.065 27.215 1 U 6.784E+02 2.243E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 741 3.026 2.061 27.139 1 U 1.051E+04 2.126E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 742 1.893 2.060 27.149 1 U 1.567E+05 1.995E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 743 3.611 2.054 27.260 1 U 2.017E+04 2.379E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 744 7.177 2.046 27.346 1 U 4.772E+02 2.165E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 745 3.897 2.050 27.295 1 U 1.400E+04 2.102E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 746 3.899 2.025 27.320 1 U 1.335E+04 1.376E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 747 7.179 2.023 27.386 1 U 4.366E+02 1.875E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 748 7.430 1.996 27.199 1 U 1.876E+03 1.943E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 749 4.419 1.993 27.078 1 U 3.577E+03 1.911E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 750 3.863 1.910 27.154 1 U 1.622E+03 2.345E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 751 2.815 1.903 27.275 1 U 1.349E+03 2.479E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 752 0.387 1.890 27.230 1 U 5.978E+02 2.727E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 753 1.144 4.298 27.106 1 U -4.001E+04 3.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 754 7.990 4.295 26.975 1 U -5.268E+03 4.009E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 755 2.158 4.293 26.940 1 U -7.098E+02 3.927E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 756 1.965 4.248 26.970 1 U -1.553E+03 2.543E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 757 4.416 2.078 27.091 1 U 3.918E+03 1.961E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 758 4.215 2.078 27.046 1 U 1.024E+04 1.971E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 759 4.029 2.076 27.101 1 U 8.637E+03 1.952E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 760 1.146 2.076 26.995 1 U 3.674E+03 2.083E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 761 7.437 2.075 27.076 1 U 9.125E+02 1.256E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 762 4.702 2.074 27.066 1 U 3.339E+02 1.411E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 763 2.353 2.076 27.076 1 U 1.594E+04 1.846E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 764 -0.849 2.060 26.825 1 U 1.490E+03 1.786E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 765 7.975 1.995 27.031 1 U 6.012E+02 2.284E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 766 4.870 1.996 26.965 1 U 1.637E+03 2.374E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 767 4.216 1.996 26.884 1 U 7.483E+03 2.331E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 768 4.029 1.995 27.005 1 U 1.019E+04 2.309E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 769 2.356 1.997 26.950 1 U 1.393E+04 2.373E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 770 1.146 1.996 26.990 1 U 5.020E+03 2.446E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 771 4.271 1.908 27.041 1 U 3.434E+03 2.490E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 772 3.612 1.906 27.036 1 U 8.588E+03 2.477E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 773 3.026 1.906 27.000 1 U 7.153E+03 2.400E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 774 2.203 1.907 27.101 1 U 2.108E+04 2.691E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 775 2.046 1.907 27.101 1 U 1.178E+05 2.519E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 776 1.145 1.903 27.076 1 U 1.004E+03 2.224E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 777 1.981 4.308 26.776 1 U -4.897E+03 2.424E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 778 9.654 4.248 26.716 1 U -2.982E+03 2.010E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 779 8.805 4.248 26.796 1 U -2.794E+03 2.069E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 780 8.474 4.249 26.771 1 U -1.181E+04 2.020E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 781 7.941 4.248 26.731 1 U -1.413E+03 2.200E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 782 7.820 4.248 26.756 1 U -1.940E+03 1.936E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 783 7.340 4.248 26.701 1 U -8.848E+02 2.094E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 784 7.216 4.248 26.741 1 U -2.709E+04 1.926E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 785 6.771 4.248 26.827 1 U -2.784E+03 2.008E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 786 4.772 4.248 26.701 1 U -7.662E+03 2.449E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 787 4.626 4.249 26.635 1 U -1.673E+03 2.381E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 788 4.452 4.248 26.806 1 U -6.399E+03 4.448E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 789 4.122 4.248 26.756 1 U -4.629E+04 5.737E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 790 3.880 4.248 26.751 1 U -3.590E+04 2.946E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 791 2.377 4.249 26.665 1 U -1.885E+03 2.031E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 792 9.271 2.109 26.355 1 U 1.523E+03 2.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 793 4.673 2.111 26.322 1 U 7.996E+03 2.633E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 794 4.560 2.112 26.502 1 U 3.177E+03 2.260E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 795 3.865 2.109 26.406 1 U 9.688E+03 2.281E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 796 3.614 2.113 26.401 1 U 3.587E+03 2.242E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 797 2.215 2.111 26.386 1 U 2.017E+04 3.038E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 798 1.952 2.111 26.360 1 U 1.099E+05 2.900E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 799 1.728 2.105 26.522 1 U 1.650E+03 2.214E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 800 4.560 1.967 26.426 1 U 1.283E+03 2.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 801 3.864 1.963 26.441 1 U 4.665E+03 2.353E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 802 2.096 1.965 26.426 1 U 9.101E+04 2.395E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 803 1.540 1.958 26.334 1 U 5.429E+03 2.110E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 804 6.935 2.113 26.177 1 U 7.722E+02 1.945E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 805 1.532 2.107 26.161 1 U 3.657E+03 2.547E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 806 9.271 1.963 26.222 1 U 1.844E+03 1.305E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 807 4.672 1.965 26.302 1 U 6.539E+03 1.274E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 808 7.999 4.327 25.683 1 U -8.409E+03 2.218E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 809 7.668 4.324 25.537 1 U -5.492E+03 2.005E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 810 3.103 4.325 25.547 1 U -1.381E+04 2.385E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 811 2.531 4.325 25.597 1 U -2.453E+04 2.608E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 812 2.732 4.308 25.511 1 U -1.773E+03 2.706E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 813 4.884 1.226 25.542 1 U 7.621E+02 1.391E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 814 8.477 4.315 25.438 1 U -1.246E+03 2.551E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 815 7.513 4.307 25.408 1 U -9.343E+02 2.755E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 816 2.777 4.301 25.398 1 U 8.510E+02 2.833E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 817 7.507 1.290 25.282 1 U 2.128E+03 1.327E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 818 4.877 1.292 25.474 1 U 8.363E+02 1.246E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 819 4.049 1.292 25.322 1 U 5.074E+03 1.370E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 820 2.888 1.290 25.154 1 U 1.513E+03 1.276E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 821 2.101 1.291 25.378 1 U 8.551E+03 1.283E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 822 2.009 1.290 25.353 1 U 6.910E+03 2.023E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 823 0.384 1.291 25.327 1 U 6.244E+02 1.381E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 824 2.011 1.223 25.302 1 U 9.040E+03 1.635E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 825 7.509 1.221 25.302 1 U 2.520E+03 1.370E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 826 4.049 1.222 25.322 1 U 5.535E+03 1.279E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 827 2.100 1.222 25.312 1 U 8.510E+03 1.284E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 828 8.096 1.214 25.458 1 U 4.378E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 829 1.587 1.292 25.088 1 U 4.482E+03 1.428E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 830 1.506 1.287 25.189 1 U 6.248E+03 2.949E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 831 1.590 1.224 25.179 1 U 4.733E+03 1.379E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 832 2.880 1.219 25.204 1 U 2.220E+03 1.275E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 833 1.508 1.222 25.169 1 U 6.603E+03 1.981E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 834 9.044 4.895 24.419 1 U -7.826E+02 1.480E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 835 8.893 4.890 24.614 1 U -1.248E+03 1.323E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 836 8.098 4.894 24.569 1 U -1.058E+04 1.315E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 837 7.972 4.892 24.614 1 U -1.269E+03 1.256E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 838 7.510 4.892 24.559 1 U -6.754E+03 1.222E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 839 6.840 4.893 24.660 1 U -4.195E+02 1.327E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 840 4.581 4.892 24.519 1 U -2.770E+03 1.413E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 841 4.496 4.892 24.509 1 U -1.286E+03 1.482E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 842 4.318 4.892 24.549 1 U -1.048E+03 1.301E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 843 4.051 4.892 24.609 1 U -1.104E+03 1.253E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 844 3.107 4.892 24.549 1 U -4.515E+04 1.280E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 845 2.900 4.893 24.574 1 U -6.820E+02 1.330E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 846 2.604 4.892 24.549 1 U -3.373E+04 1.295E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 847 2.102 4.894 24.579 1 U -1.481E+03 1.268E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 848 1.903 4.892 24.554 1 U -2.006E+03 1.251E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 849 1.714 4.892 24.539 1 U -1.028E+03 1.203E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 850 1.231 4.893 24.544 1 U -2.386E+03 1.284E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 851 0.380 3.822 24.458 1 U -6.296E+02 1.517E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 852 4.358 3.848 24.274 1 U -1.072E+04 2.049E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 853 2.110 3.836 24.174 1 U -1.127E+03 2.167E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 854 9.780 3.827 24.340 1 U -8.931E+03 2.105E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 855 9.041 3.829 24.375 1 U -2.317E+03 2.125E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 856 8.440 3.826 24.325 1 U -3.101E+04 2.124E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 857 6.905 3.826 24.315 1 U -1.095E+04 2.095E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 858 6.634 3.828 24.365 1 U -1.501E+03 2.025E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 859 6.477 3.826 24.244 1 U -1.284E+03 2.070E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 860 4.302 3.831 24.305 1 U -3.044E+03 2.153E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 861 3.274 3.827 24.320 1 U -8.256E+03 2.123E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 862 8.889 3.823 24.330 1 U -1.228E+03 1.995E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 863 5.121 3.827 24.165 1 U -1.689E+03 2.006E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 864 3.102 3.825 24.355 1 U -1.666E+04 2.094E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 865 2.316 3.824 24.179 1 U -1.618E+03 2.116E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 866 1.530 3.825 24.390 1 U -1.276E+03 1.998E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 867 2.780 1.348 24.239 1 U 5.953E+02 1.902E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 868 9.780 4.063 23.904 1 U -4.649E+03 2.263E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 869 8.889 4.063 23.959 1 U -4.842E+03 2.232E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 870 7.510 4.063 23.974 1 U -4.368E+04 2.237E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 871 3.925 4.062 24.015 1 U -1.806E+04 2.512E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 872 3.839 4.062 23.944 1 U -4.138E+03 2.976E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 873 3.272 4.063 24.000 1 U -4.312E+03 2.274E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 874 1.909 4.062 23.939 1 U -9.092E+03 2.300E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 875 1.697 4.062 23.939 1 U -4.003E+03 2.404E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 876 1.218 4.062 23.959 1 U -9.481E+03 2.296E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 877 8.093 4.059 23.934 1 U -1.769E+03 2.039E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 878 3.106 4.062 23.915 1 U -1.205E+03 2.144E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 879 2.099 4.062 24.045 1 U -1.724E+04 2.412E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 880 2.009 4.062 23.980 1 U -3.074E+04 2.065E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 881 2.035 1.367 24.065 1 U 1.638E+03 1.869E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 882 8.867 1.359 24.040 1 U 2.376E+03 2.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 883 4.120 1.359 24.045 1 U 3.691E+03 2.237E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 884 4.423 1.351 23.990 1 U 3.575E+03 1.852E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 885 1.725 1.353 23.959 1 U 1.019E+04 2.326E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 886 1.557 1.352 24.045 1 U 2.468E+04 2.380E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 887 1.157 1.351 24.040 1 U 9.817E+04 2.308E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 888 2.907 1.349 24.030 1 U 2.318E+03 1.418E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 889 4.113 1.172 23.995 1 U 2.003E+03 1.567E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 890 2.766 1.174 23.899 1 U 6.492E+02 1.655E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 891 4.421 1.171 24.005 1 U 6.096E+03 1.940E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 892 2.908 1.171 23.949 1 U 2.110E+03 1.938E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 893 1.719 1.170 23.964 1 U 7.899E+03 2.187E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 894 1.556 1.169 24.000 1 U 2.295E+04 2.211E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 895 1.341 1.170 24.005 1 U 1.027E+05 2.134E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 896 8.876 1.159 24.050 1 U 2.203E+03 1.778E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 897 3.106 4.325 23.705 1 U -1.272E+03 3.577E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 898 2.303 4.320 23.680 1 U -5.866E+02 3.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 899 0.526 4.323 23.596 1 U -5.560E+03 3.743E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 900 4.871 4.064 23.886 1 U -5.357E+02 2.019E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 901 5.127 4.060 23.634 1 U -7.329E+02 2.064E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 902 1.088 4.322 23.592 1 U -1.391E+04 3.225E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 903 7.932 4.321 23.531 1 U -5.701E+03 3.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 904 7.663 4.318 23.486 1 U -2.777E+03 3.363E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 905 7.329 4.321 23.581 1 U -6.894E+03 3.380E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 906 6.392 4.320 23.466 1 U -1.194E+03 3.458E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 907 3.005 4.319 23.486 1 U -1.767E+03 3.358E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 908 1.922 4.322 23.435 1 U -1.501E+04 3.361E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 909 1.783 4.322 23.531 1 U -8.499E+03 3.540E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 910 8.878 4.122 23.385 1 U -1.650E+03 2.321E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 911 8.486 4.122 23.375 1 U -5.003E+03 2.407E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 912 7.667 4.124 23.405 1 U -2.540E+04 2.543E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 913 2.800 4.123 23.370 1 U -1.379E+04 2.559E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 914 2.021 4.123 23.370 1 U -3.397E+04 2.342E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 915 1.581 4.124 23.360 1 U -1.693E+03 2.273E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 916 1.341 4.125 23.405 1 U -5.680E+03 2.360E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 917 8.882 4.584 23.125 1 U -6.865E+03 4.067E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 918 7.344 4.588 23.156 1 U -6.484E+03 3.891E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 919 6.932 4.584 23.171 1 U -2.118E+04 4.026E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 920 4.687 4.586 23.130 1 U -1.951E+04 8.729E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 921 4.453 4.584 23.095 1 U -7.276E+03 6.293E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 922 3.864 4.584 23.120 1 U -2.603E+04 4.451E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 923 2.775 4.584 23.171 1 U -1.684E+04 4.259E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 924 9.263 4.581 23.292 1 U -1.255E+03 3.770E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 925 2.207 4.582 23.251 1 U -2.877E+03 3.774E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 926 1.951 4.581 23.297 1 U -1.485E+03 4.301E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 927 3.898 4.122 23.221 1 U -4.665E+03 2.019E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 928 3.806 4.124 23.322 1 U -1.029E+03 2.117E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 929 3.109 4.119 23.241 1 U -1.792E+03 2.092E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 930 1.158 4.124 23.337 1 U -3.510E+03 2.114E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 931 7.176 0.688 23.141 1 U 1.899E+03 1.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 932 3.028 0.690 23.080 1 U 4.374E+03 1.257E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 933 2.830 0.689 23.100 1 U 4.623E+03 1.239E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 934 2.381 0.688 23.100 1 U 5.108E+03 1.394E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 935 0.381 0.689 23.136 1 U 1.677E+03 1.240E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 936 6.929 0.686 23.191 1 U 4.213E+02 1.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 937 4.804 0.687 23.226 1 U 6.932E+02 1.283E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 938 1.026 0.687 23.090 1 U 2.122E+04 1.478E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 939 0.511 0.687 23.090 1 U 2.314E+04 1.277E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 940 -0.860 0.687 23.085 1 U 5.335E+04 1.335E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 941 7.182 -0.847 23.151 1 U 8.890E+02 1.112E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 942 3.026 -0.848 23.085 1 U 7.705E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 943 2.830 -0.849 23.100 1 U 9.075E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 944 2.382 -0.848 23.095 1 U 7.171E+03 1.155E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 945 2.061 -0.851 23.277 1 U 6.368E+02 1.110E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 946 1.030 -0.849 23.085 1 U 1.659E+04 1.122E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 947 0.676 -0.848 23.090 1 U 5.819E+04 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 948 0.510 -0.848 23.090 1 U 1.325E+04 1.131E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 949 9.649 -0.854 23.211 1 U 6.110E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 950 2.049 0.690 22.926 1 U 3.794E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 951 3.610 0.688 23.052 1 U 1.684E+03 1.305E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 952 7.344 -0.847 23.032 1 U 3.976E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 953 6.938 -0.849 22.962 1 U 6.973E+02 1.117E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 954 3.614 -0.846 23.062 1 U 2.507E+03 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 955 1.891 -0.847 23.017 1 U 5.331E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 956 4.807 -0.854 22.846 1 U 4.483E+02 1.104E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 957 9.047 4.300 22.291 1 U -7.730E+03 2.522E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 958 7.495 4.300 22.282 1 U -8.026E+02 2.672E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 959 1.899 4.301 22.302 1 U -3.233E+04 2.462E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 960 1.716 4.300 22.302 1 U -1.373E+04 2.712E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 961 2.624 4.295 22.498 1 U -1.895E+03 3.142E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 962 8.097 4.300 22.042 1 U -4.072E+03 3.151E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 963 4.074 4.301 22.077 1 U -5.456E+03 3.476E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 964 4.484 1.151 21.823 1 U 9.458E+02 2.111E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 965 7.216 4.778 21.454 1 U -4.665E+03 1.969E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 966 8.004 1.153 21.614 1 U 1.994E+03 2.393E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 967 7.432 1.155 21.634 1 U 9.624E+03 2.347E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 968 6.823 1.155 21.624 1 U 7.897E+02 2.405E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 969 4.349 1.155 21.624 1 U 5.401E+04 2.376E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 970 4.041 1.154 21.578 1 U 1.637E+03 2.360E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 971 1.973 1.155 21.614 1 U 1.264E+04 2.423E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 972 8.805 4.779 21.440 1 U -2.152E+04 1.847E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 973 8.473 4.781 21.440 1 U -5.691E+03 1.817E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 974 7.818 4.779 21.435 1 U -6.615E+03 1.730E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 975 4.459 4.782 21.410 1 U -2.692E+03 1.741E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 976 4.238 4.780 21.430 1 U -1.316E+04 1.790E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 977 4.129 4.781 21.410 1 U -3.876E+03 1.848E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 978 3.876 4.774 21.364 1 U -9.248E+02 1.900E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 979 3.006 4.780 21.344 1 U -8.540E+02 1.732E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 980 2.623 4.779 21.425 1 U -1.786E+04 2.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 981 1.871 4.777 21.243 1 U -8.149E+02 1.819E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 982 9.051 4.434 21.039 1 U -1.251E+04 3.108E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 983 8.877 4.435 20.979 1 U -3.349E+04 3.226E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 984 4.707 4.433 20.923 1 U -1.427E+04 5.705E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 985 1.883 4.434 20.923 1 U -2.108E+03 3.143E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 986 1.720 4.435 20.928 1 U -7.823E+03 3.180E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 987 1.548 4.436 20.939 1 U -1.907E+04 3.363E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 988 1.340 4.437 20.934 1 U -5.228E+03 3.203E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 989 1.156 4.435 20.989 1 U -1.667E+04 3.319E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 990 2.362 4.441 20.886 1 U -1.082E+03 3.394E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 991 4.304 4.434 20.795 1 U -1.796E+04 5.326E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 992 2.783 4.432 20.785 1 U -2.511E+03 4.156E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 993 4.553 4.429 20.825 1 U -5.145E+03 4.177E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 994 2.348 4.424 20.755 1 U -9.596E+02 3.112E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 995 4.332 4.345 20.765 1 U -1.420E+06 4.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 996 4.031 4.345 20.755 1 U -9.143E+03 5.182E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 997 2.317 4.367 20.388 1 U -1.495E+04 2.761E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 998 1.539 4.343 20.556 1 U -1.422E+04 3.099E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 999 1.889 4.202 20.404 1 U -2.753E+03 1.845E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1000 9.051 4.367 20.170 1 U -3.416E+03 3.719E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1001 8.440 4.369 20.336 1 U -7.445E+03 3.856E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1002 4.051 4.368 20.316 1 U -3.806E+03 4.213E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1003 2.521 4.203 20.296 1 U -8.415E+03 3.117E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1004 8.486 4.200 20.316 1 U -8.110E+03 2.589E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1005 8.163 4.200 20.326 1 U -3.034E+04 2.125E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1006 6.641 4.202 20.301 1 U -1.463E+03 2.482E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1007 2.735 4.199 20.296 1 U -1.496E+04 2.143E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1008 3.890 4.194 20.377 1 U -2.166E+03 2.200E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1009 4.269 2.845 19.855 1 U -8.238E+02 1.608E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1010 8.485 4.618 19.676 1 U -5.841E+02 1.465E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1011 7.933 4.619 19.727 1 U -3.918E+03 1.386E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1012 7.507 4.618 19.626 1 U -1.661E+03 1.518E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1013 7.316 4.618 19.807 1 U -1.857E+03 1.622E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1014 6.773 4.619 19.712 1 U -8.059E+03 1.504E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1015 3.680 4.619 19.722 1 U -2.913E+04 1.422E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1016 3.165 4.618 19.737 1 U -3.734E+04 1.761E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1017 8.263 4.448 19.822 1 U -7.154E+03 4.451E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1018 7.718 4.448 19.777 1 U -1.027E+04 4.441E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1019 4.225 4.448 19.812 1 U -1.189E+04 5.078E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1020 2.518 4.448 19.782 1 U -1.573E+04 4.561E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1021 6.487 2.846 19.691 1 U -9.659E+02 1.879E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1022 9.778 2.839 19.722 1 U -6.537E+02 1.345E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1023 7.349 2.843 19.676 1 U -6.170E+02 1.319E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1024 7.175 2.844 19.717 1 U -8.536E+03 1.365E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1025 6.938 2.844 19.686 1 U -8.098E+03 1.256E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1026 5.118 2.842 19.817 1 U -8.470E+02 1.310E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1027 4.505 2.846 19.626 1 U -1.371E+03 1.447E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1028 3.613 2.843 19.691 1 U -4.483E+04 1.405E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1029 3.032 2.843 19.712 1 U -2.927E+04 1.613E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1030 2.708 2.843 19.707 1 U -1.434E+04 1.623E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1031 2.620 2.844 19.691 1 U -3.636E+03 1.572E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1032 2.532 2.842 19.581 1 U -1.489E+03 1.549E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1033 2.368 2.842 19.727 1 U -1.352E+03 1.544E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1034 2.068 2.842 19.707 1 U -2.017E+03 1.455E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1035 1.889 2.844 19.717 1 U -2.841E+03 1.384E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1036 1.018 2.843 19.701 1 U -1.174E+04 1.445E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1037 0.676 2.844 19.671 1 U -9.853E+03 1.219E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1038 0.506 2.843 19.707 1 U -1.733E+04 1.458E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1039 -0.860 2.843 19.701 1 U -1.763E+04 1.387E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1040 9.779 5.132 19.311 1 U -3.065E+04 1.299E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1041 7.660 5.133 19.316 1 U -7.196E+03 1.256E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1042 7.176 5.132 19.296 1 U -1.348E+04 1.290E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1043 6.940 5.132 19.301 1 U -1.081E+04 1.226E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1044 4.485 5.132 19.306 1 U -3.151E+04 1.382E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1045 4.049 5.132 19.351 1 U -1.392E+03 1.219E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1046 2.827 5.132 19.346 1 U -6.096E+02 1.310E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1047 2.113 5.132 19.311 1 U -3.490E+03 1.215E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1048 1.905 5.132 19.306 1 U -2.373E+04 1.347E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1049 1.697 5.132 19.301 1 U -1.962E+04 1.280E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1050 6.482 5.130 19.336 1 U -3.390E+03 1.255E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1051 5.116 4.466 19.321 1 U -2.766E+03 4.864E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1052 3.874 4.448 19.553 1 U -3.248E+03 3.860E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1053 3.695 4.447 19.518 1 U -1.625E+03 4.372E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1054 3.829 4.144 19.392 1 U -2.901E+03 2.521E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1055 7.817 4.144 19.387 1 U -1.867E+03 2.659E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1056 4.257 4.141 19.336 1 U -1.217E+04 2.638E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1057 1.352 4.142 19.321 1 U -5.405E+04 2.959E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1058 9.655 5.129 19.243 1 U -1.465E+03 1.162E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1059 4.811 5.127 19.172 1 U -3.851E+03 1.167E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1060 3.821 5.130 19.233 1 U -6.542E+02 1.166E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1061 1.019 5.130 19.258 1 U -1.442E+03 1.242E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1062 0.506 5.129 19.283 1 U -1.935E+03 1.154E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1063 9.043 5.117 19.107 1 U -5.497E+02 1.470E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1064 7.340 5.114 19.102 1 U -7.655E+02 1.545E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1065 5.128 4.555 19.258 1 U -7.711E+03 4.499E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1066 9.050 4.548 19.167 1 U -2.616E+03 4.334E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1067 7.612 4.547 19.198 1 U -2.053E+04 4.314E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1068 1.253 4.546 19.193 1 U -1.163E+04 4.553E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1069 0.380 4.547 19.233 1 U -6.149E+03 4.646E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1070 8.474 4.475 19.132 1 U -2.217E+04 4.255E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1071 6.589 4.472 19.072 1 U -2.595E+03 4.741E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1072 6.393 4.470 19.127 1 U -3.114E+04 4.349E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1073 2.524 4.475 19.182 1 U -9.141E+03 4.918E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1074 7.612 4.468 19.203 1 U -3.344E+03 4.121E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1075 8.621 4.143 19.283 1 U -1.985E+03 3.042E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1076 3.916 4.142 19.198 1 U -6.553E+03 3.324E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1077 1.542 5.120 19.019 1 U -3.102E+03 1.695E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1078 8.828 5.116 18.999 1 U -5.847E+04 1.459E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1079 4.892 5.118 18.973 1 U -5.605E+03 1.480E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1080 3.176 5.116 18.988 1 U -2.988E+04 1.479E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1081 3.009 5.116 18.983 1 U -3.439E+04 1.583E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1082 9.658 4.821 18.873 1 U -7.273E+02 1.633E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1083 7.658 4.820 18.873 1 U -3.990E+03 1.734E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1084 7.178 4.819 18.868 1 U -2.992E+03 1.658E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1085 6.485 4.821 18.797 1 U -2.955E+03 1.633E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1086 4.684 4.820 18.762 1 U -1.742E+04 6.596E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1087 4.592 4.821 18.948 1 U -3.581E+03 1.804E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1088 3.027 4.821 18.807 1 U -9.849E+02 1.703E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1089 2.903 4.820 18.837 1 U -2.427E+04 1.704E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1090 2.801 4.820 18.832 1 U -1.882E+04 1.659E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1091 2.383 4.820 18.863 1 U -2.257E+03 1.659E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1092 1.029 4.821 18.842 1 U -2.041E+04 1.882E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1093 0.676 4.821 18.842 1 U -2.473E+03 1.659E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1094 0.506 4.820 18.832 1 U -1.520E+04 1.670E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1095 -0.858 4.820 18.847 1 U -1.205E+03 1.764E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1096 4.325 4.549 18.978 1 U -3.992E+03 5.662E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1097 2.308 4.546 18.873 1 U -5.947E+02 3.898E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1098 6.646 4.543 18.999 1 U -2.387E+03 3.744E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1099 5.116 4.821 18.543 1 U -1.795E+03 1.831E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1100 4.429 4.817 18.623 1 U -1.267E+03 2.102E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1101 1.905 4.817 18.759 1 U -1.752E+03 2.031E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1102 2.504 4.709 18.512 1 U -7.522E+03 2.407E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1103 4.479 1.529 18.512 1 U 4.596E+04 3.068E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1104 4.057 1.530 18.563 1 U 1.009E+03 2.887E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1105 3.898 1.529 18.497 1 U 1.534E+04 3.004E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1106 2.161 1.530 18.522 1 U 4.662E+03 3.468E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1107 2.343 4.718 18.404 1 U -3.981E+03 6.362E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1108 9.048 4.715 18.399 1 U -2.473E+04 9.890E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1109 4.581 4.715 18.364 1 U -6.464E+03 1.345E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1110 4.419 4.716 18.399 1 U -2.164E+04 1.023E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1111 1.888 4.715 18.424 1 U -3.084E+04 1.027E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1112 9.780 1.529 18.439 1 U 3.741E+03 3.101E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1113 9.270 1.529 18.449 1 U 2.992E+03 3.114E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1114 8.889 1.529 18.454 1 U 3.752E+04 3.095E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1115 6.936 1.529 18.459 1 U 1.554E+03 3.085E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1116 4.677 1.529 18.409 1 U 6.375E+03 3.130E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1117 3.611 1.529 18.464 1 U 1.942E+04 3.164E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1118 3.281 1.529 18.449 1 U 8.099E+03 3.210E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1119 3.105 1.529 18.475 1 U 1.061E+04 3.249E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1120 2.773 1.529 18.439 1 U 1.211E+04 3.073E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1121 2.084 1.529 18.429 1 U 7.565E+03 3.380E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1122 1.988 1.530 18.439 1 U 1.159E+04 3.722E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1123 1.913 1.528 18.429 1 U 1.023E+04 3.426E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1124 1.303 1.529 18.459 1 U 3.609E+04 3.482E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1125 1.220 1.529 18.429 1 U 1.836E+04 3.564E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1126 1.132 1.529 18.444 1 U 1.056E+04 3.717E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1127 1.045 1.530 18.485 1 U 8.002E+03 3.699E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1128 7.973 1.528 18.434 1 U 2.494E+03 1.806E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1129 7.509 1.527 18.354 1 U 7.190E+02 1.831E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1130 4.867 1.527 18.419 1 U 1.012E+03 1.867E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1131 8.508 1.363 18.099 1 U 1.876E+03 3.503E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1132 1.050 1.364 18.074 1 U 1.950E+04 3.767E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1133 4.130 1.362 18.039 1 U 4.371E+04 3.660E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1134 3.901 1.363 18.054 1 U 9.857E+02 3.640E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1135 3.028 3.878 17.494 1 U -2.225E+03 1.793E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1136 6.940 4.682 17.240 1 U -1.095E+04 1.012E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1137 4.563 4.682 17.169 1 U -2.804E+04 1.144E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1138 3.863 4.682 17.169 1 U -7.840E+04 1.063E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1139 2.101 4.682 17.139 1 U -5.826E+03 1.026E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1140 1.946 4.682 17.225 1 U -1.559E+04 1.089E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1141 8.890 4.490 17.366 1 U -1.367E+04 3.760E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1142 4.355 4.489 17.346 1 U -2.389E+04 6.180E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1143 3.900 4.489 17.376 1 U -6.417E+04 4.029E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1144 3.608 4.489 17.376 1 U -3.528E+04 3.771E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1145 2.025 4.489 17.351 1 U -5.228E+03 3.932E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1146 1.734 4.489 17.401 1 U -1.656E+03 3.829E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1147 1.518 4.489 17.303 1 U -4.636E+04 3.790E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1148 7.352 3.874 17.200 1 U -3.176E+03 1.638E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1149 6.933 3.876 17.205 1 U -1.028E+04 1.704E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1150 4.674 3.876 17.174 1 U -5.297E+04 2.036E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1151 4.564 3.876 17.180 1 U -1.836E+04 1.549E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1152 3.629 3.875 17.250 1 U -5.669E+03 1.616E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1153 2.797 3.874 17.159 1 U -2.264E+03 1.434E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1154 2.100 3.875 17.190 1 U -1.830E+04 1.601E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1155 1.940 3.875 17.220 1 U -1.049E+04 1.972E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1156 1.518 3.874 17.215 1 U -3.151E+03 1.626E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1157 4.793 4.681 17.011 1 U -7.363E+03 1.151E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1158 2.769 4.228 17.041 1 U -1.366E+03 2.282E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1159 7.432 4.224 17.046 1 U -1.564E+03 2.851E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1160 4.875 4.225 16.965 1 U -3.774E+04 2.739E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1161 4.424 4.226 16.895 1 U -5.320E+03 4.354E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1162 4.031 4.225 16.965 1 U -1.476E+05 3.672E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1163 3.915 4.225 16.950 1 U -9.283E+03 2.726E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1164 2.354 4.223 16.950 1 U -5.648E+03 2.632E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1165 2.060 4.225 16.975 1 U -1.760E+04 2.638E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1166 1.993 4.225 16.970 1 U -1.682E+04 2.844E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1167 7.433 4.048 16.980 1 U -3.213E+03 1.537E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1168 4.875 4.045 16.965 1 U -3.971E+04 1.650E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1169 4.424 4.046 16.905 1 U -3.904E+03 2.432E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1170 4.213 4.045 16.965 1 U -1.535E+05 2.279E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1171 3.914 4.045 16.925 1 U -1.759E+04 2.232E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1172 2.769 4.043 16.960 1 U -1.497E+03 1.575E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1173 2.354 4.046 16.975 1 U -4.078E+03 1.666E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1174 1.987 4.045 16.950 1 U -2.414E+04 1.707E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1175 1.142 4.045 17.142 1 U -1.766E+03 1.587E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1176 9.271 3.877 17.081 1 U -1.562E+03 1.357E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1177 7.357 3.624 16.935 1 U -2.460E+03 1.835E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1178 4.274 3.624 16.900 1 U -3.588E+03 1.640E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1179 2.207 3.624 16.895 1 U -5.510E+03 1.606E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1180 0.676 3.623 16.890 1 U -3.176E+03 1.560E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1181 0.500 3.626 16.918 1 U -2.206E+03 1.563E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1182 1.030 3.037 16.883 1 U -2.126E+03 1.404E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1183 6.930 3.035 16.885 1 U -2.352E+03 1.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1184 2.050 3.037 16.871 1 U -1.701E+04 1.607E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1185 1.883 3.036 16.880 1 U -1.409E+04 1.583E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1186 9.264 4.043 16.696 1 U -8.086E+02 1.505E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1187 7.182 3.626 16.797 1 U -8.293E+02 1.650E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1188 6.935 3.623 16.857 1 U -4.764E+03 1.743E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1189 3.026 3.624 16.862 1 U -1.088E+05 2.017E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1190 2.829 3.624 16.847 1 U -4.343E+04 1.849E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1191 1.891 3.624 16.857 1 U -1.845E+04 1.701E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1192 1.019 3.624 16.872 1 U -1.398E+03 1.688E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1193 -0.859 3.624 16.862 1 U -5.629E+03 1.588E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1194 4.266 3.038 16.827 1 U -2.337E+03 1.558E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1195 0.512 3.038 16.847 1 U -2.253E+03 1.686E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1196 7.356 3.035 16.827 1 U -2.780E+03 1.625E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1197 3.613 3.037 16.872 1 U -9.755E+04 1.668E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1198 2.825 3.037 16.852 1 U -2.934E+04 1.732E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1199 2.632 3.036 16.746 1 U -5.807E+02 1.649E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1200 2.207 3.036 16.781 1 U -3.210E+03 1.866E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1201 0.676 3.036 16.867 1 U -8.569E+03 1.691E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1202 -0.860 3.037 16.857 1 U -1.256E+04 1.723E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1203 4.411 4.890 16.406 1 U -1.579E+03 1.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1204 9.269 4.888 16.497 1 U -7.485E+03 1.348E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1205 7.990 4.886 16.461 1 U -1.191E+03 1.462E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1206 7.434 4.884 16.517 1 U -1.085E+03 1.406E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1207 4.578 4.888 16.527 1 U -1.601E+03 1.557E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1208 4.213 4.888 16.451 1 U -4.496E+04 1.382E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1209 4.032 4.888 16.446 1 U -4.231E+04 1.389E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1210 3.914 4.888 16.456 1 U -1.149E+04 1.435E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1211 2.773 4.888 16.456 1 U -2.138E+04 1.378E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1212 2.546 4.887 16.456 1 U -4.742E+02 1.392E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1213 2.066 4.888 16.451 1 U -1.314E+03 1.349E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1214 1.980 4.887 16.466 1 U -2.569E+03 1.338E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1215 1.134 4.882 16.456 1 U -8.246E+02 1.386E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1216 7.660 4.879 16.328 1 U -6.778E+02 1.564E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1217 8.887 3.617 16.106 1 U -1.133E+03 2.042E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1218 4.478 3.911 15.816 1 U -5.457E+04 2.948E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1219 3.610 3.911 15.801 1 U -1.364E+05 2.103E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1220 2.022 3.911 15.791 1 U -2.625E+04 4.516E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1221 1.738 3.910 15.837 1 U -3.097E+03 1.743E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1222 1.520 3.911 15.806 1 U -9.610E+03 2.016E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1223 4.275 3.908 15.897 1 U -2.050E+03 2.358E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1224 4.479 3.621 15.816 1 U -3.776E+04 1.625E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1225 3.899 3.621 15.811 1 U -1.322E+05 1.711E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1226 2.303 3.622 15.832 1 U -2.817E+03 1.733E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1227 2.029 3.621 15.937 1 U -2.769E+04 1.827E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1228 1.744 3.621 15.816 1 U -5.510E+03 1.634E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1229 1.518 3.621 15.837 1 U -1.715E+04 1.644E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1230 2.302 3.912 15.789 1 U -4.265E+03 2.487E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1231 5.129 3.626 15.643 1 U -7.299E+02 1.656E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1232 8.896 3.616 15.784 1 U -9.187E+02 1.562E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1233 1.146 1.885 15.628 1 U 6.327E+03 4.050E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1234 1.050 1.886 15.688 1 U 1.953E+03 3.548E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1235 2.680 1.884 15.532 1 U 7.592E+03 3.636E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1236 2.612 1.884 15.522 1 U 1.010E+04 3.686E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1237 4.314 1.886 15.474 1 U 2.601E+03 3.418E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1238 9.043 1.883 15.494 1 U 1.176E+03 3.443E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1239 8.828 1.884 15.459 1 U 7.555E+03 3.661E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1240 5.109 1.883 15.464 1 U 5.789E+03 3.439E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1241 4.701 1.883 15.428 1 U 6.984E+03 3.418E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1242 4.426 1.884 15.514 1 U 5.640E+03 3.458E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1243 3.034 1.882 15.403 1 U 1.818E+03 3.459E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1244 2.504 1.883 15.444 1 U 1.319E+04 3.482E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1245 2.347 1.884 15.509 1 U 2.722E+04 3.592E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 1246 1.571 1.884 15.499 1 U 4.238E+04 3.748E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 ; 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 . . 13 ppm . . . 4.7 . . 34258 1 2 . . C 13 H-aliphatic . aliased 34.5 ppm . . . 30.35 . . 34258 1 3 . . H 1 H-aliphatic . . 8.1 ppm . . . 4.7 . . 34258 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 34258 _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 2 _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 H # INAME 2 HN # INAME 3 N # XEASYFORMAT hHN # SPECTRUM N15NOESY H HN N 1 2.521 8.892 132.087 1 U 8.895E+03 7.747E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 2 7.351 8.897 132.024 1 U 6.557E+03 7.162E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 3 8.491 8.892 132.029 1 U 7.494E+03 7.636E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 4 6.892 8.892 132.029 1 U 1.845E+04 7.122E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 5 4.707 8.892 132.024 1 U 2.048E+04 7.565E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 6 4.581 8.892 132.034 1 U 4.829E+04 7.765E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 7 4.427 8.892 132.034 1 U 2.840E+05 7.596E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 8 4.304 8.892 132.039 1 U 2.732E+04 7.424E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 9 4.115 8.892 132.034 1 U 2.267E+04 7.325E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 10 3.867 8.891 132.039 1 U 3.895E+03 7.354E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 11 2.786 8.892 132.034 1 U 1.902E+05 7.445E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 12 1.722 8.891 132.039 1 U 9.906E+03 7.061E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 13 1.555 8.892 132.039 1 U 2.249E+04 7.591E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 14 1.343 8.892 132.039 1 U 3.552E+04 7.946E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 15 1.158 8.892 132.044 1 U 4.063E+04 7.233E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 16 3.159 10.315 131.680 1 U 5.116E+03 8.062E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 17 7.503 10.312 131.664 1 U 1.249E+05 8.946E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 18 6.771 10.310 131.690 1 U 6.742E+03 9.263E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 19 6.584 10.312 131.664 1 U 6.411E+03 9.315E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 20 6.395 10.311 131.654 1 U 3.577E+04 8.999E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 21 3.692 10.312 131.680 1 U 6.724E+03 9.051E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 22 2.526 10.312 131.654 1 U 2.583E+04 8.436E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 23 1.533 10.312 131.644 1 U 1.035E+04 9.258E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 24 8.812 9.667 130.357 1 U 5.598E+03 9.676E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 25 7.933 9.668 130.402 1 U 3.769E+04 9.894E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 26 7.216 9.668 130.407 1 U 1.413E+05 9.911E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 27 6.934 9.667 130.407 1 U 7.051E+03 9.592E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 28 6.485 9.668 130.402 1 U 7.991E+04 9.947E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 29 4.793 9.668 130.402 1 U 9.951E+03 1.002E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 30 4.245 9.668 130.397 1 U 2.000E+04 1.011E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 31 3.013 9.668 130.397 1 U 1.109E+04 1.010E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 32 2.384 9.667 130.412 1 U 2.622E+04 9.825E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 33 1.916 9.668 130.402 1 U 2.983E+04 9.897E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 34 1.785 9.668 130.402 1 U 9.027E+04 1.003E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 35 1.255 9.668 130.407 1 U 2.722E+04 9.599E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 36 1.039 9.668 130.407 1 U 6.263E+04 9.807E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 37 0.672 9.669 130.387 1 U 4.994E+03 9.971E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 38 0.513 9.668 130.422 1 U 2.014E+04 1.011E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 39 0.383 9.668 130.392 1 U 1.795E+04 9.847E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 40 -0.861 9.668 130.412 1 U 1.264E+04 9.761E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 41 9.782 8.902 127.279 1 U 3.984E+04 9.868E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 42 8.099 8.901 127.274 1 U 2.000E+04 1.013E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 43 7.512 8.901 127.279 1 U 9.750E+04 9.379E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 44 4.883 8.902 127.264 1 U 6.912E+03 9.462E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 45 4.484 8.902 127.279 1 U 1.341E+05 9.851E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 46 4.052 8.902 127.284 1 U 6.589E+04 1.020E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 47 3.902 8.902 127.294 1 U 8.210E+03 9.831E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 48 3.278 8.902 127.279 1 U 2.563E+05 9.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 49 3.105 8.902 127.284 1 U 9.907E+04 9.542E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 50 2.605 8.901 127.284 1 U 6.533E+03 9.664E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 51 2.095 8.902 127.274 1 U 1.447E+04 9.340E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 52 2.015 8.902 127.299 1 U 1.019E+04 1.003E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 53 1.520 8.902 127.279 1 U 3.631E+05 9.621E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 54 0.525 8.901 127.264 1 U 1.459E+04 9.151E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 55 8.819 9.060 126.917 1 U 1.590E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 56 8.168 9.061 126.947 1 U 5.364E+03 7.036E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 57 7.617 9.061 126.922 1 U 3.670E+03 7.272E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 58 6.898 9.060 126.947 1 U 9.411E+03 7.267E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 59 4.711 9.060 126.937 1 U 1.183E+05 7.404E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 60 4.564 9.060 126.932 1 U 3.497E+04 7.545E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 61 4.429 9.060 126.937 1 U 2.796E+04 6.891E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 62 4.305 9.060 126.942 1 U 2.805E+04 7.026E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 63 2.491 9.061 126.937 1 U 6.768E+03 7.508E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 64 1.889 9.060 126.937 1 U 2.570E+04 7.436E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 65 1.256 9.060 126.932 1 U 2.437E+04 7.133E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 66 0.380 9.060 126.937 1 U 8.323E+04 6.914E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 67 8.913 9.059 126.977 1 U 8.845E+03 7.433E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 68 2.348 9.059 126.902 1 U 9.146E+03 7.406E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 69 9.785 8.451 126.881 1 U 1.101E+04 7.430E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 70 9.046 8.451 126.897 1 U 8.771E+04 8.255E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 71 8.096 8.451 126.897 1 U 4.315E+03 7.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 72 7.530 8.451 126.886 1 U 5.094E+03 7.161E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 73 7.185 8.450 126.891 1 U 7.882E+03 8.134E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 74 6.894 8.451 126.897 1 U 2.868E+04 7.934E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 75 6.640 8.451 126.891 1 U 6.741E+04 7.325E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 76 4.548 8.451 126.861 1 U 4.310E+03 7.919E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 77 4.358 8.451 126.897 1 U 8.824E+04 7.700E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 78 3.817 8.451 126.891 1 U 3.693E+05 7.711E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 79 3.281 8.451 126.886 1 U 1.075E+04 7.754E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 80 3.104 8.451 126.886 1 U 2.036E+04 7.703E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 81 3.003 8.451 126.886 1 U 3.206E+04 8.393E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 82 2.904 8.451 126.891 1 U 2.722E+04 7.265E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 83 2.320 8.451 126.891 1 U 1.726E+05 8.454E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 84 2.109 8.451 126.897 1 U 1.151E+05 7.862E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 85 1.902 8.451 126.881 1 U 9.165E+03 8.655E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 86 1.254 8.451 126.871 1 U 7.878E+03 7.545E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 87 0.381 8.450 126.793 1 U 4.559E+03 7.688E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 88 7.982 9.280 126.555 1 U 1.516E+04 7.783E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 89 7.667 9.280 126.549 1 U 1.532E+04 7.708E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 90 4.870 9.280 126.555 1 U 8.746E+04 8.164E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 91 4.585 9.280 126.555 1 U 4.860E+04 7.835E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 92 4.215 9.280 126.565 1 U 8.616E+03 7.640E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 93 3.914 9.280 126.555 1 U 2.415E+05 8.340E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 94 3.104 9.280 126.549 1 U 2.679E+04 8.328E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 95 2.776 9.280 126.555 1 U 1.845E+05 7.843E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 96 2.540 9.280 126.570 1 U 5.950E+03 8.242E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 97 2.129 9.281 126.549 1 U 2.893E+04 7.751E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 98 1.954 9.280 126.549 1 U 5.358E+04 7.666E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 99 1.520 9.280 126.549 1 U 3.281E+04 7.993E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 100 4.305 8.845 126.419 1 U 3.606E+03 7.241E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 101 3.178 8.843 126.434 1 U 6.077E+04 6.843E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 102 7.351 8.840 126.449 1 U 1.149E+04 8.159E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 103 5.103 8.843 126.429 1 U 3.250E+05 8.451E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 104 4.428 8.841 126.429 1 U 6.466E+04 8.407E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 105 3.012 8.843 126.429 1 U 3.628E+04 8.685E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 106 1.868 8.843 126.434 1 U 1.938E+04 8.202E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 107 1.721 8.843 126.429 1 U 1.672E+05 8.593E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 108 1.546 8.843 126.429 1 U 1.543E+05 8.701E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 109 1.345 8.841 126.439 1 U 1.601E+04 7.888E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 110 1.158 8.841 126.439 1 U 1.171E+04 8.527E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 111 9.648 9.791 125.712 1 U 1.546E+04 7.917E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 112 7.662 9.792 125.708 1 U 8.963E+03 8.514E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 113 7.174 9.792 125.717 1 U 9.700E+03 8.251E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 114 6.484 9.793 125.712 1 U 1.072E+04 8.489E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 115 8.890 9.792 125.705 1 U 3.650E+04 7.953E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 116 8.442 9.793 125.684 1 U 9.279E+03 8.057E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 117 7.513 9.792 125.710 1 U 1.888E+04 8.088E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 118 6.939 9.792 125.700 1 U 1.175E+05 7.752E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 119 5.119 9.792 125.705 1 U 2.545E+05 8.314E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 120 4.491 9.792 125.705 1 U 2.969E+04 8.054E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 121 4.052 9.792 125.700 1 U 5.088E+04 8.391E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 122 3.818 9.792 125.705 1 U 6.913E+04 7.507E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 123 3.276 9.792 125.700 1 U 1.307E+05 7.816E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 124 3.104 9.792 125.705 1 U 1.357E+05 8.237E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 125 2.109 9.792 125.689 1 U 1.148E+04 8.297E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 126 1.911 9.792 125.705 1 U 4.573E+04 8.313E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 127 1.698 9.792 125.700 1 U 6.393E+04 8.134E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 128 1.520 9.792 125.705 1 U 3.147E+04 8.469E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 129 8.635 8.526 125.619 1 U 4.559E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 130 4.133 8.523 125.629 1 U 2.545E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 131 1.353 8.523 125.624 1 U 8.198E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 132 9.272 8.016 125.488 1 U 5.058E+03 7.160E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 133 7.667 8.010 125.518 1 U 1.053E+05 7.839E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 134 7.434 8.010 125.513 1 U 2.046E+05 7.274E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 135 6.850 8.010 125.503 1 U 5.709E+03 7.032E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 136 4.864 8.009 125.523 1 U 4.457E+03 7.609E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 137 4.108 8.010 125.503 1 U 1.276E+04 8.048E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 138 3.916 8.009 125.508 1 U 2.722E+04 7.216E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 139 3.104 8.010 125.513 1 U 1.326E+05 7.372E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 140 2.781 8.010 125.523 1 U 9.837E+03 6.546E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 141 2.533 8.010 125.513 1 U 7.154E+04 6.882E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 142 2.165 8.010 125.513 1 U 2.967E+04 6.983E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 143 1.996 8.010 125.518 1 U 2.567E+04 7.339E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 144 1.145 8.011 125.508 1 U 1.676E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 145 4.307 8.009 125.508 1 U 1.109E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 146 8.810 7.829 123.544 1 U 1.048E+04 8.959E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 147 8.626 7.829 123.565 1 U 5.470E+04 9.439E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 148 8.482 7.828 123.549 1 U 1.224E+04 9.479E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 149 4.765 7.828 123.554 1 U 4.451E+04 9.009E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 150 4.495 7.829 123.610 1 U 1.158E+04 9.009E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 151 4.243 7.829 123.549 1 U 7.339E+04 9.126E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 152 4.141 7.829 123.544 1 U 7.141E+04 8.455E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 153 3.790 7.829 123.544 1 U 5.579E+04 8.942E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 154 2.666 7.829 123.544 1 U 2.041E+05 9.113E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 155 1.262 7.829 123.549 1 U 9.498E+03 8.716E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 156 9.046 8.171 122.953 1 U 4.847E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 157 8.486 8.174 122.903 1 U 4.247E+03 6.543E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 158 6.642 8.171 122.928 1 U 7.755E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 159 4.707 8.172 122.928 1 U 3.021E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 160 4.433 8.173 122.938 1 U 7.630E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 161 4.189 8.172 122.923 1 U 2.500E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 162 2.735 8.172 122.923 1 U 1.025E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 163 2.494 8.172 122.918 1 U 3.617E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 164 2.353 8.173 122.918 1 U 1.331E+04 6.820E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 165 1.891 8.172 122.923 1 U 1.787E+05 6.523E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 166 1.598 8.170 122.933 1 U 4.363E+03 6.570E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 167 6.489 7.189 122.750 1 U 1.091E+04 9.483E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 168 9.781 7.188 122.770 1 U 9.390E+03 9.644E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 169 7.657 7.187 122.775 1 U 8.715E+03 9.860E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 170 6.958 7.188 122.755 1 U 2.034E+04 9.329E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 171 5.119 7.187 122.760 1 U 1.125E+05 9.048E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 172 4.801 7.188 122.760 1 U 1.544E+04 9.061E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 173 4.492 7.187 122.760 1 U 3.841E+05 9.467E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 174 3.616 7.187 122.765 1 U 1.409E+04 9.261E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 175 3.028 7.187 122.755 1 U 6.538E+03 9.400E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 176 2.832 7.187 122.760 1 U 1.024E+05 9.655E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 177 2.305 7.187 122.760 1 U 4.698E+04 9.182E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 178 1.910 7.187 122.775 1 U 1.333E+04 9.168E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 179 1.739 7.187 122.765 1 U 4.730E+04 9.891E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 180 1.015 7.188 122.760 1 U 2.223E+05 9.318E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 181 0.508 7.188 122.760 1 U 2.130E+05 8.906E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 182 -0.860 7.187 122.760 1 U 2.270E+04 8.921E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 183 9.658 7.944 122.093 1 U 3.956E+04 8.709E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 184 8.469 7.944 122.093 1 U 7.264E+03 8.882E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 185 7.335 7.944 122.108 1 U 5.780E+03 8.996E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 186 6.774 7.944 122.093 1 U 9.723E+04 8.678E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 187 4.609 7.944 122.093 1 U 1.209E+04 8.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 188 4.312 7.943 122.098 1 U 7.535E+04 8.877E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 189 3.683 7.944 122.103 1 U 6.597E+03 8.587E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 190 3.161 7.944 122.038 1 U 6.850E+03 8.270E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 191 3.003 7.944 122.088 1 U 8.574E+03 9.065E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 192 2.902 7.944 122.098 1 U 1.184E+04 8.230E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 193 2.522 7.944 122.078 1 U 1.070E+04 8.806E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 194 1.915 7.944 122.093 1 U 5.634E+04 8.954E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 195 1.784 7.944 122.093 1 U 1.507E+05 8.842E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 196 1.529 7.943 122.093 1 U 2.073E+04 8.474E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 197 1.251 7.943 122.058 1 U 5.814E+03 8.795E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 198 1.087 7.944 122.103 1 U 4.491E+04 8.337E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 199 0.527 7.944 122.093 1 U 1.038E+05 8.399E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 200 7.718 8.272 121.570 1 U 2.590E+04 9.252E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 201 4.441 8.271 121.548 1 U 1.100E+05 8.713E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 202 4.273 8.272 121.553 1 U 3.720E+05 8.962E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 203 3.028 8.272 121.528 1 U 6.132E+03 8.952E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 204 2.513 8.272 121.548 1 U 9.653E+04 8.719E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 205 2.217 8.272 121.543 1 U 4.201E+04 9.717E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 206 2.049 8.271 121.538 1 U 1.026E+04 8.693E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 207 1.866 8.272 121.548 1 U 4.508E+04 8.980E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 208 0.679 8.273 121.548 1 U 1.167E+04 9.465E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 209 7.663 9.169 119.687 1 U 9.399E+03 6.927E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 210 4.314 9.167 119.677 1 U 1.352E+04 6.522E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 211 2.801 9.167 119.621 1 U 4.310E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 212 2.903 9.166 119.712 1 U 3.875E+03 6.711E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 213 4.790 9.157 119.591 1 U 3.347E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 214 8.883 8.500 119.518 1 U 1.465E+04 7.328E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 215 8.156 8.500 119.513 1 U 5.317E+03 6.787E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 216 7.669 8.500 119.518 1 U 6.934E+04 7.067E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 217 6.888 8.500 119.483 1 U 8.910E+03 7.465E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 218 6.643 8.501 119.483 1 U 1.453E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 219 4.311 8.501 119.513 1 U 1.382E+04 7.009E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 220 4.182 8.500 119.518 1 U 1.000E+05 7.272E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 221 3.105 8.501 119.533 1 U 2.357E+04 6.977E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 222 2.749 8.500 119.518 1 U 2.893E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 223 2.526 8.500 119.518 1 U 1.494E+05 6.602E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 224 2.019 8.500 119.533 1 U 6.942E+03 6.830E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 225 1.719 8.501 119.559 1 U 3.917E+03 6.830E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 226 8.465 7.625 119.408 1 U 4.435E+03 7.846E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 227 6.593 7.624 119.483 1 U 7.360E+03 8.011E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 228 6.397 7.624 119.478 1 U 3.217E+04 7.896E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 229 4.541 7.623 119.483 1 U 1.503E+05 8.206E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 230 2.902 7.623 119.483 1 U 2.351E+04 8.216E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 231 2.525 7.623 119.468 1 U 1.937E+04 7.591E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 232 1.529 7.623 119.478 1 U 5.527E+04 8.227E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 233 1.255 7.623 119.483 1 U 2.199E+04 8.157E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 234 0.525 7.624 119.483 1 U 1.052E+04 7.783E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 235 0.384 7.624 119.513 1 U 7.625E+03 7.799E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 236 9.647 8.816 119.264 1 U 7.234E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 237 9.047 8.816 119.254 1 U 3.075E+04 7.116E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 238 7.821 8.815 119.254 1 U 8.980E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 239 7.216 8.816 119.254 1 U 6.806E+04 6.740E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 240 5.103 8.814 119.259 1 U 5.819E+04 6.880E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 241 4.766 8.816 119.259 1 U 1.275E+05 7.000E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 242 4.242 8.816 119.259 1 U 1.609E+04 7.094E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 243 3.178 8.816 119.254 1 U 1.890E+04 6.845E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 244 3.012 8.815 119.259 1 U 3.431E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 245 2.621 8.816 119.259 1 U 8.863E+04 6.732E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 246 2.357 8.816 119.264 1 U 1.082E+04 7.118E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 247 1.880 8.816 119.249 1 U 1.366E+04 6.565E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 248 1.257 8.816 119.254 1 U 1.051E+04 6.788E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 249 0.380 8.816 119.259 1 U 2.580E+04 7.009E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 250 9.783 8.112 118.603 1 U 5.246E+03 7.146E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 251 9.047 8.110 118.673 1 U 1.879E+05 7.957E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 252 8.899 8.111 118.683 1 U 2.086E+04 7.770E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 253 7.967 8.111 118.678 1 U 1.773E+04 8.893E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 254 7.512 8.111 118.688 1 U 1.949E+05 7.579E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 255 6.650 8.111 118.704 1 U 4.303E+03 7.339E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 256 4.877 8.108 118.673 1 U 6.088E+04 7.751E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 257 4.296 8.110 118.668 1 U 2.951E+04 7.736E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 258 4.054 8.111 118.683 1 U 2.143E+04 8.188E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 259 3.278 8.110 118.673 1 U 5.964E+04 8.029E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 260 3.107 8.110 118.673 1 U 5.445E+04 7.594E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 261 2.605 8.111 118.673 1 U 7.322E+04 8.106E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 262 1.903 8.110 118.683 1 U 8.181E+04 7.854E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 263 1.716 8.110 118.673 1 U 1.203E+05 7.567E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 264 1.522 8.108 118.683 1 U 1.450E+04 8.060E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 265 1.310 8.110 118.673 1 U 1.934E+04 7.732E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 266 9.785 7.671 117.728 1 U 8.346E+03 9.308E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 267 9.159 7.671 117.743 1 U 3.759E+04 8.695E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 268 7.457 7.671 117.758 1 U 4.889E+03 8.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 269 6.486 7.672 117.748 1 U 4.888E+04 9.459E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 270 4.798 7.672 117.748 1 U 3.441E+04 8.958E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 271 4.491 7.674 117.738 1 U 9.094E+03 8.934E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 272 4.314 7.672 117.743 1 U 3.539E+04 8.890E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 273 3.004 7.672 117.753 1 U 9.361E+03 9.055E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 274 2.902 7.672 117.743 1 U 2.399E+04 8.823E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 275 2.804 7.672 117.748 1 U 2.541E+04 9.286E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 276 2.115 7.672 117.748 1 U 6.260E+04 9.384E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 277 1.918 7.672 117.743 1 U 1.707E+05 9.145E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 278 1.724 7.672 117.743 1 U 5.532E+04 8.852E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 279 1.092 7.672 117.753 1 U 2.022E+04 9.142E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 280 0.514 7.674 117.748 1 U 1.145E+04 9.259E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 281 6.932 7.670 117.743 1 U 8.190E+03 7.593E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 282 5.119 7.671 117.738 1 U 7.760E+04 7.743E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 283 8.911 9.056 116.898 1 U 1.933E+04 8.004E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 284 8.442 9.056 116.898 1 U 6.291E+04 7.165E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 285 8.100 9.056 116.898 1 U 1.673E+05 7.720E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 286 7.512 9.057 116.903 1 U 2.764E+04 8.025E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 287 6.899 9.056 116.908 1 U 8.035E+03 7.513E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 288 6.640 9.056 116.893 1 U 3.449E+04 7.850E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 289 4.874 9.057 116.858 1 U 4.246E+03 7.782E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 290 4.299 9.056 116.893 1 U 6.949E+04 7.552E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 291 3.818 9.056 116.883 1 U 1.475E+04 7.974E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 292 3.279 9.056 116.903 1 U 1.530E+04 7.098E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 293 3.108 9.057 116.878 1 U 8.392E+03 7.523E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 294 2.507 9.056 116.913 1 U 1.293E+04 7.527E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 295 2.320 9.057 116.898 1 U 1.497E+04 7.584E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 296 2.107 9.057 116.888 1 U 3.016E+04 7.544E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 297 1.897 9.056 116.898 1 U 9.677E+04 8.325E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 298 1.717 9.057 116.898 1 U 1.192E+05 8.119E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 299 7.220 8.486 116.430 1 U 3.810E+03 7.580E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 300 6.773 8.488 116.425 1 U 2.287E+04 7.402E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 301 6.395 8.487 116.405 1 U 2.016E+04 7.932E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 302 4.763 8.487 116.415 1 U 2.482E+04 8.132E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 303 4.465 8.487 116.410 1 U 2.095E+05 8.180E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 304 4.238 8.487 116.410 1 U 8.066E+04 8.238E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 305 4.146 8.487 116.410 1 U 1.214E+05 8.373E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 306 3.885 8.487 116.410 1 U 4.729E+04 7.664E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 307 2.526 8.487 116.410 1 U 3.995E+04 7.995E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 308 1.915 8.490 116.390 1 U 5.077E+03 7.982E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 309 1.528 8.488 116.415 1 U 1.514E+04 7.332E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 310 9.781 7.523 116.425 1 U 1.785E+04 9.860E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 311 9.046 7.521 116.420 1 U 2.979E+04 9.856E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 312 8.892 7.522 116.435 1 U 8.331E+04 9.472E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 313 8.100 7.522 116.430 1 U 1.894E+05 9.934E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 314 4.877 7.522 116.430 1 U 3.259E+04 1.018E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 315 4.325 7.523 116.470 1 U 5.794E+03 9.628E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 316 4.052 7.522 116.425 1 U 4.589E+05 9.993E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 317 3.922 7.522 116.440 1 U 5.570E+03 9.538E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 318 3.278 7.522 116.430 1 U 1.378E+05 9.916E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 319 3.106 7.522 116.435 1 U 4.789E+04 9.852E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 320 2.604 7.522 116.400 1 U 7.314E+03 9.796E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 321 2.097 7.522 116.425 1 U 3.895E+04 1.016E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 322 2.010 7.522 116.425 1 U 3.841E+04 1.008E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 323 1.913 7.522 116.430 1 U 2.033E+04 1.008E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 324 1.530 7.523 116.420 1 U 2.264E+04 9.493E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 325 1.235 7.522 116.430 1 U 5.042E+04 9.943E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 326 0.524 6.785 116.101 1 U 6.576E+03 7.362E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 327 10.304 6.785 116.048 1 U 8.555E+03 8.078E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 328 8.476 6.784 116.058 1 U 3.653E+04 7.509E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 329 7.933 6.785 116.068 1 U 9.147E+04 7.792E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 330 7.508 6.785 116.053 1 U 1.146E+05 8.579E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 331 7.376 6.784 116.028 1 U 9.238E+03 7.404E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 332 4.613 6.785 116.053 1 U 3.592E+04 8.205E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 333 4.475 6.784 116.078 1 U 5.974E+03 7.836E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 334 4.239 6.785 116.053 1 U 2.246E+04 7.863E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 335 4.146 6.785 116.073 1 U 1.909E+04 7.647E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 336 3.886 6.784 116.048 1 U 1.647E+04 7.656E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 337 3.681 6.784 116.053 1 U 2.931E+04 8.262E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 338 3.166 6.784 116.053 1 U 7.554E+04 8.205E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 339 2.524 6.784 116.043 1 U 4.159E+04 8.188E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 340 1.530 6.785 116.063 1 U 1.673E+04 7.656E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 341 8.254 7.730 114.904 1 U 1.559E+04 8.357E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 342 4.440 7.730 114.899 1 U 1.182E+05 8.650E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 343 4.285 7.730 114.884 1 U 2.538E+04 8.291E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 344 2.583 7.730 114.889 1 U 1.878E+04 8.369E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 345 2.225 7.731 114.884 1 U 7.095E+03 8.397E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 346 1.862 7.730 114.884 1 U 1.503E+04 8.998E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 347 3.671 7.728 114.894 1 U 1.087E+05 1.138E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 348 9.047 6.650 113.998 1 U 2.412E+04 8.179E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 349 8.446 6.650 113.998 1 U 3.815E+04 8.412E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 350 7.185 6.651 114.009 1 U 5.834E+03 8.194E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 351 6.887 6.650 113.993 1 U 2.057E+04 8.072E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 352 6.772 6.650 114.029 1 U 2.228E+04 8.474E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 353 4.542 6.650 114.004 1 U 1.609E+04 9.163E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 354 4.308 6.649 113.998 1 U 1.383E+04 8.243E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 355 4.191 6.649 113.948 1 U 6.320E+03 8.203E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 356 3.817 6.649 114.019 1 U 9.395E+03 8.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 357 2.743 6.650 113.998 1 U 4.513E+04 7.915E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 358 2.525 6.650 113.998 1 U 1.136E+05 8.821E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 359 2.320 6.650 114.009 1 U 1.608E+04 8.143E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 360 2.108 6.650 114.024 1 U 5.114E+04 8.264E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 361 1.891 6.650 114.009 1 U 2.690E+04 8.480E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 362 1.721 6.648 114.024 1 U 8.972E+03 8.099E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 363 9.055 6.896 113.307 1 U 7.758E+03 8.727E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 364 8.883 6.896 113.332 1 U 9.666E+03 8.409E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 365 8.447 6.898 113.297 1 U 1.078E+04 8.380E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 366 6.641 6.897 113.307 1 U 1.783E+04 8.473E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 367 4.581 6.899 113.297 1 U 6.933E+03 8.707E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 368 4.433 6.897 113.317 1 U 4.833E+03 8.389E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 369 4.306 6.897 113.327 1 U 2.705E+05 8.609E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 370 3.819 6.896 113.292 1 U 3.454E+04 8.198E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 371 3.275 6.896 113.282 1 U 7.053E+03 8.566E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 372 3.104 6.897 113.287 1 U 2.399E+04 8.210E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 373 2.769 6.897 113.287 1 U 5.801E+04 8.869E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 374 2.525 6.897 113.287 1 U 2.316E+04 8.334E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 375 1.252 6.896 113.327 1 U 7.259E+03 8.231E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 376 0.379 6.896 113.322 1 U 1.721E+04 8.043E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 377 6.889 4.314 113.322 1 U 3.699E+04 9.475E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 378 0.385 4.314 113.337 1 U 8.675E+03 8.034E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 379 9.273 7.986 113.133 1 U 1.056E+04 8.463E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 380 7.434 7.986 113.068 1 U 4.326E+03 8.580E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 381 6.838 7.986 113.138 1 U 1.218E+06 1.018E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 382 4.870 7.986 113.118 1 U 1.405E+04 8.752E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 383 3.917 7.986 113.113 1 U 9.933E+04 8.714E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 384 3.107 7.986 113.108 1 U 7.872E+04 8.227E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 385 2.775 7.986 113.113 1 U 1.022E+05 8.677E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 386 2.550 7.986 113.108 1 U 5.312E+04 8.830E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 387 1.519 7.986 113.103 1 U 2.738E+04 8.481E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 388 2.793 6.918 113.023 1 U 4.283E+04 8.569E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 389 7.976 6.848 113.143 1 U 9.946E+05 8.575E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 390 4.867 6.847 113.113 1 U 7.268E+03 7.525E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 391 4.682 6.848 113.073 1 U 7.869E+03 7.457E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 392 3.918 6.848 113.154 1 U 3.148E+04 7.837E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 393 3.107 6.848 113.138 1 U 3.349E+04 7.115E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 394 2.775 6.848 113.138 1 U 3.657E+04 7.529E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 395 2.555 6.848 113.123 1 U 2.935E+04 7.591E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 396 1.521 6.847 113.123 1 U 9.565E+03 7.282E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 397 1.144 6.849 113.154 1 U 4.403E+03 7.722E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 398 8.890 7.982 113.010 1 U 4.989E+03 9.667E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 399 6.910 7.635 112.935 1 U 1.807E+06 8.974E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 400 6.778 7.635 112.945 1 U 1.790E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 401 2.902 7.635 112.920 1 U 3.401E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 402 2.802 7.635 112.920 1 U 8.312E+04 6.924E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 403 2.510 7.635 112.910 1 U 4.359E+03 6.683E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 404 1.788 7.635 112.900 1 U 8.172E+03 6.574E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 405 7.624 6.919 112.940 1 U 1.320E+06 9.055E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 406 8.453 7.194 112.147 1 U 6.358E+03 9.406E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 407 6.400 7.194 112.208 1 U 5.566E+05 1.013E+03 e 0 0 0 0 #VC 1.00000 #SUP 0.00 408 3.007 7.195 112.248 1 U 4.693E+03 9.250E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 409 2.320 7.194 112.163 1 U 4.126E+04 9.538E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 410 2.108 7.194 112.158 1 U 9.612E+04 9.014E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 411 4.359 7.193 112.223 1 U 4.354E+03 8.166E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 412 7.184 6.410 112.208 1 U 4.835E+05 9.097E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 413 3.018 6.408 112.208 1 U 6.242E+03 8.530E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 414 2.318 6.411 112.198 1 U 1.174E+04 8.540E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 415 2.109 6.410 112.213 1 U 2.808E+04 8.693E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 416 6.637 7.194 112.145 1 U 1.077E+04 9.340E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 417 6.884 7.566 110.702 1 U -1.113E+04 7.891E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 418 6.396 7.566 110.692 1 U -5.149E+03 8.069E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 419 4.690 7.567 110.677 1 U -1.637E+04 8.511E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 420 3.000 7.566 110.702 1 U -3.378E+04 7.755E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 421 2.904 7.567 110.697 1 U -5.969E+04 8.465E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 422 2.319 7.567 110.692 1 U -1.337E+04 8.012E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 423 1.529 7.569 110.722 1 U -5.921E+03 7.870E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 424 1.083 7.567 110.692 1 U -7.335E+03 7.964E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 425 0.527 7.570 110.707 1 U -9.570E+03 8.982E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 426 6.522 6.778 110.330 1 U 6.405E+05 8.086E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 427 1.889 6.779 110.319 1 U 1.436E+04 7.966E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 428 6.768 6.532 110.335 1 U 9.443E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 429 4.305 6.533 110.345 1 U 4.551E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 430 2.893 6.533 110.309 1 U 8.518E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 431 1.892 6.531 110.350 1 U 1.217E+04 7.343E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 432 7.820 8.635 109.776 1 U 1.887E+04 7.672E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 433 4.760 8.634 109.806 1 U 6.306E+03 7.936E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 434 4.244 8.634 109.761 1 U 2.408E+04 6.925E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 435 4.133 8.635 109.771 1 U 8.499E+04 6.603E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 436 3.791 8.634 109.766 1 U 3.360E+04 6.809E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 437 1.354 8.636 109.771 1 U 2.071E+04 7.485E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 438 9.267 7.679 109.354 1 U 1.202E+04 8.508E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 439 8.490 7.680 109.359 1 U 4.206E+04 8.224E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 440 8.000 7.679 109.354 1 U 8.016E+04 8.219E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 441 4.313 7.679 109.354 1 U 4.303E+04 8.611E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 442 4.113 7.679 109.349 1 U 2.128E+05 9.166E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 443 3.916 7.679 109.359 1 U 2.457E+04 8.738E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 444 3.104 7.679 109.354 1 U 1.784E+05 8.203E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 445 2.797 7.679 109.349 1 U 5.914E+04 8.212E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 446 2.533 7.679 109.354 1 U 5.347E+04 7.978E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 447 2.160 7.679 109.344 1 U 4.966E+04 8.547E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 448 2.012 7.679 109.349 1 U 6.319E+04 8.922E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 449 8.000 7.443 107.088 1 U 1.656E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 450 6.839 7.444 107.033 1 U 6.268E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 451 4.868 7.442 107.103 1 U 9.081E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 452 4.034 7.442 107.078 1 U 4.955E+04 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 453 2.351 7.443 107.073 1 U 7.449E+03 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 454 1.987 7.443 107.078 1 U 1.086E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 455 1.144 7.442 107.078 1 U 1.045E+05 6.510E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 456 4.296 7.441 107.073 1 U 7.702E+04 7.987E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 457 3.919 7.442 107.083 1 U 9.597E+03 8.631E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 458 3.101 7.441 107.068 1 U 1.133E+04 8.209E+02 e 0 0 0 0 #VC 1.00000 #SUP 0.00 ; 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 . . 13 ppm . . . 4.7 . . 34258 2 2 . . N 15 N . . 28 ppm . . . 120 . . 34258 2 3 . . H 1 NH . . 7.3 ppm . . . 4.7 . . 34258 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 34258 _Spectral_peak_list.ID 3 _Spectral_peak_list.Sample_ID 4 _Spectral_peak_list.Sample_label $sample_4 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _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 2 # FORMAT xeasy2D # INAME 1 H # INAME 2 H # CYANAFORMAT hH 1 6.447 6.637 1 U 8.16e+06 0 e 0 19 20 2 6.526 6.980 1 U 4.07e+06 0 e 0 10 9 3 6.525 7.393 1 U 9.89e+04 0 e 0 10 8 4 7.255 6.523 1 U 6.5e+04 0 e 0 7 10 5 7.389 6.522 1 U 1.89e+05 0 e 0 8 10 6 6.977 7.390 1 U 3.45e+06 0 e 0 11 8 7 7.390 6.975 1 U 4.19e+06 0 e 0 8 11 8 7.371 7.148 1 U 3.23e+06 0 e 0 28 31 9 7.226 7.453 1 U 1.6e+06 0 e 0 29 30 10 7.452 7.227 1 U 1.95e+06 0 e 0 30 29 11 7.150 7.222 1 U 3.68e+06 0 e 0 31 29 12 7.147 7.371 1 U 3.06e+06 0 e 0 31 28 13 6.637 7.461 1 U 1.82e+05 0 e 0 20 30 14 6.449 7.458 1 U 1.54e+06 0 e 0 19 30 15 7.458 6.639 1 U 1.48e+05 0 e 0 30 20 16 7.457 6.450 1 U 1.3e+06 0 e 0 30 19 17 7.229 6.454 1 U 1.28e+05 0 e 0 29 19 18 6.448 7.227 1 U 2.06e+05 0 e 0 19 29 19 2.555 6.450 1 U 2.37e+06 0 e 0 16 19 20 1.565 6.450 1 U 2.76e+06 0 e 0 17 19 21 1.564 6.636 1 U 4.04e+05 0 e 0 17 20 22 2.550 6.636 1 U 3.11e+05 0 e 0 16 20 23 2.555 7.537 1 U 4.62e+05 0 e 0 16 27 24 2.555 7.461 1 U 1.78e+05 0 e 0 16 30 25 3.204 7.536 1 U 1.94e+06 0 e 0 26 27 26 0.416 6.526 1 U 2.52e+05 0 e 0 15 10 27 0.547 6.979 1 U 9.68e+05 0 e 0 45 9 28 0.582 7.147 1 U 2.82e+05 0 e 0 36 31 29 0.419 7.392 1 U 1.23e+05 0 e 0 15 8 30 0.418 7.257 1 U 1.73e+05 0 e 0 15 7 31 0.418 6.977 1 U 1.3e+05 0 e 0 15 9 32 0.549 7.391 1 U 9.72e+04 0 e 0 0 0 33 0.582 7.372 1 U 2.75e+05 0 e 0 36 28 34 0.547 6.526 1 U 1.86e+06 0 e 0 45 10 35 1.057 6.980 1 U 7.39e+05 0 e 0 44 9 36 1.288 6.983 1 U 7.62e+04 0 e 0 14 9 37 1.737 6.980 1 U 2.57e+05 0 e 0 39 9 38 1.938 6.978 1 U 8.23e+05 0 e 0 0 0 39 2.086 6.974 1 U 2.7e+05 0 e 0 0 0 40 2.141 6.975 1 U 6.93e+05 0 e 0 0 0 41 2.243 6.974 1 U 2.03e+05 0 e 0 0 0 42 2.422 6.980 1 U 1.19e+05 0 e 0 49 0 43 2.858 6.977 1 U 3.42e+06 0 e 0 0 0 44 3.064 6.975 1 U 1.41e+06 0 e 0 51 11 45 3.142 6.980 1 U 2.08e+06 0 e 0 42 9 46 3.214 6.976 1 U 2.02e+05 0 e 0 5 11 47 3.310 6.980 1 U 9.02e+05 0 e 0 41 9 48 0.717 7.391 1 U 2.06e+05 0 e 0 46 8 49 0.717 7.256 1 U 8.58e+04 0 e 0 46 7 50 1.086 7.256 1 U 7.86e+05 0 e 0 48 7 51 1.136 7.372 1 U 6.82e+05 0 e 0 35 28 52 1.137 7.147 1 U 8.84e+05 0 e 0 35 31 53 1.127 7.236 1 U 1.23e+07 0 e 0 35 29 54 1.288 7.397 1 U 5.05e+04 0 e 0 14 8 55 1.288 7.255 1 U 1.04e+05 0 e 0 14 7 56 1.289 6.526 1 U 4.57e+05 0 e 0 14 10 57 0.714 6.527 1 U 1.79e+05 0 e 0 46 10 58 1.063 6.526 1 U 1.62e+06 0 e 0 44 10 59 1.084 6.526 1 U 1.75e+06 0 e 0 48 10 60 1.566 7.537 1 U 2.35e+05 0 e 0 17 27 61 1.564 7.459 1 U 1.8e+05 0 e 0 17 30 62 1.737 6.526 1 U 1.84e+05 0 e 0 39 10 63 1.830 6.526 1 U 1.37e+06 0 e 0 34 10 64 1.955 6.526 1 U 1.36e+06 0 e 0 33 10 65 2.245 7.393 1 U 1.21e+05 0 e 0 0 0 66 2.422 7.256 1 U 2.07e+06 0 e 0 49 7 67 2.422 7.390 1 U 2.06e+05 0 e 0 49 8 68 2.423 6.526 1 U 2.33e+05 0 e 0 49 10 69 2.856 6.526 1 U 5.77e+05 0 e 0 43 10 70 2.943 6.526 1 U 2.81e+05 0 e 0 0 0 71 3.049 6.526 1 U 3.22e+05 0 e 0 51 10 72 3.143 6.527 1 U 2.1e+05 0 e 0 42 10 73 1.835 7.374 1 U 1.08e+05 0 e 0 34 28 74 1.558 6.977 1 U 1.71e+06 0 e 0 0 0 75 1.957 7.147 1 U 1.53e+05 0 e 0 33 31 76 1.927 7.392 1 U 3.12e+05 0 e 0 0 0 77 1.950 7.376 1 U 7.79e+05 0 e 0 33 28 78 3.212 7.389 1 U 3.2e+06 0 e 0 5 8 79 3.050 7.256 1 U 1.67e+06 0 e 0 6 7 80 3.214 7.252 1 U 1.37e+06 0 e 0 5 7 81 3.058 7.391 1 U 2.63e+06 0 e 0 0 0 82 3.307 6.529 1 U 1.3e+05 0 e 0 5 10 83 2.857 7.391 1 U 7.76e+05 0 e 0 43 8 84 -0.813 7.391 1 U -6.57e+05 0 e 0 47 8 85 -0.813 7.256 1 U -2.87e+05 0 e 0 47 7 86 -0.814 6.977 1 U -6.74e+05 0 e 0 47 11 87 -0.813 6.526 1 U -4.35e+05 0 e 0 47 10 88 2.088 7.391 1 U 4.09e+05 0 e 0 0 0 89 2.141 7.390 1 U 2.26e+05 0 e 0 0 0 90 1.992 6.976 1 U 5.73e+05 0 e 0 0 0 91 2.806 7.389 1 U 2.86e+05 0 e 0 0 0 92 2.805 6.974 1 U 9.44e+05 0 e 0 0 0 93 7.455 7.148 1 U 2.89e+05 0 e 0 0 0 94 0.584 6.455 1 U 1.91e+05 0 e 0 36 19 95 4.640 7.537 1 U 2.32e+05 0 e 0 24 27 96 4.183 7.255 1 U 3.8e+05 0 e 0 22 7 97 4.270 7.256 1 U 3.23e+06 0 e 0 21 7 98 3.858 6.526 1 U 4.88e+05 0 e 0 40 10 99 3.651 6.526 1 U 1.3e+05 0 e 0 50 10 100 4.844 6.981 1 U 1.23e+05 0 e 0 37 9 101 5.137 7.391 1 U 2.92e+05 0 e 0 4 8 102 5.135 7.256 1 U 2.02e+05 0 e 0 4 7 103 5.163 6.981 1 U 2.96e+06 0 e 0 38 9 104 5.163 6.526 1 U 1.1e+06 0 e 0 38 10 105 4.613 6.974 1 U 5.59e+06 0 e 0 12 11 106 3.715 7.537 1 U 7.93e+05 0 e 0 25 27 107 3.651 6.975 1 U 2.19e+06 0 e 0 50 31 108 3.901 6.974 1 U 3.44e+06 0 e 0 13 11 109 3.651 7.391 1 U 1.27e+06 0 e 0 50 8 110 3.715 7.373 1 U 2.1e+06 0 e 0 25 28 111 3.716 7.147 1 U 2.17e+05 0 e 0 25 31 112 3.900 7.391 1 U 1.2e+06 0 e 0 13 8 113 3.913 7.256 1 U 3.18e+05 0 e 0 23 7 114 3.857 6.980 1 U 1.26e+06 0 e 0 40 9 115 3.917 7.537 1 U 1.02e+05 0 e 0 23 27 116 4.844 6.526 1 U 8.17e+05 0 e 0 37 10 117 4.806 7.256 1 U 9.16e+05 0 e 0 3 7 118 4.352 7.147 1 U 3.86e+05 0 e 0 32 31 119 0.716 6.978 1 U 2.91e+05 0 e 0 46 9 120 4.715 6.975 1 U 2.03e+06 0 e 0 0 0 121 4.530 6.980 1 U 6.92e+05 0 e 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 . . 12 ppm . . . 4.7 . . 34258 3 2 . . H 1 H . . 12 ppm . . . 4.7 . . 34258 3 stop_ save_