data_25565 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25565 _Entry.Title ; Solution structure of the BCOR PUFD ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-04-06 _Entry.Accession_date 2015-04-06 _Entry.Last_release_date 2016-04-04 _Entry.Original_release_date 2016-04-04 _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 . 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 Sarah Wong . J. . . 25565 2 Micah Gearhart . D. . . 25565 3 Daniel Ha . J. . . 25565 4 Connie Corcoran . M. . . 25565 5 Victoria Diaz . . . . 25565 6 Alexander Taylor . B. . . 25565 7 Virgil Schirf . . . . 25565 8 Udayar Ilangovan . . . . 25565 9 Andrew Hinck . P. . . 25565 10 Borries Demeler . . . . 25565 11 P Hart . J. . . 25565 12 Vivian Bardwell . J. . . 25565 13 Chongwoo Kim . A. . . 25565 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25565 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PRC1 . 25565 PcG . 25565 Polycomb . 25565 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25565 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 446 25565 '15N chemical shifts' 102 25565 '1H chemical shifts' 690 25565 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 . . 2016-04-04 . original BMRB . 25565 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N1L 'BMRB Entry Tracking System' 25565 PDB 4HPM . 25565 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25565 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Structural basis for the hierarchical assembly of the core of PRC1.1 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Sarah Wong . J. . . 25565 1 2 Micah Gearhart . D. . . 25565 1 3 Daniel Ha . J. . . 25565 1 4 Connie Corcoran . M. . . 25565 1 5 Victoria Diaz . . . . 25565 1 6 Alexander Taylor . B. . . 25565 1 7 Virgil Schirf . . . . 25565 1 8 Udayar Ilangovan . . . . 25565 1 9 Andrew Hinck . P. . . 25565 1 10 Borries Demeler . . . . 25565 1 11 John Hart . P. . . 25565 1 12 Vivian Bardwell . J. . . 25565 1 13 Chongwoo Kim . A. . . 25565 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25565 _Assembly.ID 1 _Assembly.Name 'BCOR PUFD' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 $entity A . yes native no no . . . 25565 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 25565 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name BCOR_PUFD _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SDVFEFEFSETPLLPSYNIQ VSVAQGPRNWLLLSDVLKKL KMSSRIFRSNFPNVEIVTIA EAEFYRQVSASLLFSSSKDL EAFNPESKELLDLVEFTNEI QTLLGSSVEWLHPSD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 115 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13112.839 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . SER . 25565 1 2 . ASP . 25565 1 3 . VAL . 25565 1 4 . PHE . 25565 1 5 . GLU . 25565 1 6 . PHE . 25565 1 7 . GLU . 25565 1 8 . PHE . 25565 1 9 . SER . 25565 1 10 . GLU . 25565 1 11 . THR . 25565 1 12 . PRO . 25565 1 13 . LEU . 25565 1 14 . LEU . 25565 1 15 . PRO . 25565 1 16 . SER . 25565 1 17 . TYR . 25565 1 18 . ASN . 25565 1 19 . ILE . 25565 1 20 . GLN . 25565 1 21 . VAL . 25565 1 22 . SER . 25565 1 23 . VAL . 25565 1 24 . ALA . 25565 1 25 . GLN . 25565 1 26 . GLY . 25565 1 27 . PRO . 25565 1 28 . ARG . 25565 1 29 . ASN . 25565 1 30 . TRP . 25565 1 31 . LEU . 25565 1 32 . LEU . 25565 1 33 . LEU . 25565 1 34 . SER . 25565 1 35 . ASP . 25565 1 36 . VAL . 25565 1 37 . LEU . 25565 1 38 . LYS . 25565 1 39 . LYS . 25565 1 40 . LEU . 25565 1 41 . LYS . 25565 1 42 . MET . 25565 1 43 . SER . 25565 1 44 . SER . 25565 1 45 . ARG . 25565 1 46 . ILE . 25565 1 47 . PHE . 25565 1 48 . ARG . 25565 1 49 . SER . 25565 1 50 . ASN . 25565 1 51 . PHE . 25565 1 52 . PRO . 25565 1 53 . ASN . 25565 1 54 . VAL . 25565 1 55 . GLU . 25565 1 56 . ILE . 25565 1 57 . VAL . 25565 1 58 . THR . 25565 1 59 . ILE . 25565 1 60 . ALA . 25565 1 61 . GLU . 25565 1 62 . ALA . 25565 1 63 . GLU . 25565 1 64 . PHE . 25565 1 65 . TYR . 25565 1 66 . ARG . 25565 1 67 . GLN . 25565 1 68 . VAL . 25565 1 69 . SER . 25565 1 70 . ALA . 25565 1 71 . SER . 25565 1 72 . LEU . 25565 1 73 . LEU . 25565 1 74 . PHE . 25565 1 75 . SER . 25565 1 76 . SER . 25565 1 77 . SER . 25565 1 78 . LYS . 25565 1 79 . ASP . 25565 1 80 . LEU . 25565 1 81 . GLU . 25565 1 82 . ALA . 25565 1 83 . PHE . 25565 1 84 . ASN . 25565 1 85 . PRO . 25565 1 86 . GLU . 25565 1 87 . SER . 25565 1 88 . LYS . 25565 1 89 . GLU . 25565 1 90 . LEU . 25565 1 91 . LEU . 25565 1 92 . ASP . 25565 1 93 . LEU . 25565 1 94 . VAL . 25565 1 95 . GLU . 25565 1 96 . PHE . 25565 1 97 . THR . 25565 1 98 . ASN . 25565 1 99 . GLU . 25565 1 100 . ILE . 25565 1 101 . GLN . 25565 1 102 . THR . 25565 1 103 . LEU . 25565 1 104 . LEU . 25565 1 105 . GLY . 25565 1 106 . SER . 25565 1 107 . SER . 25565 1 108 . VAL . 25565 1 109 . GLU . 25565 1 110 . TRP . 25565 1 111 . LEU . 25565 1 112 . HIS . 25565 1 113 . PRO . 25565 1 114 . SER . 25565 1 115 . ASP . 25565 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 25565 1 . ASP 2 2 25565 1 . VAL 3 3 25565 1 . PHE 4 4 25565 1 . GLU 5 5 25565 1 . PHE 6 6 25565 1 . GLU 7 7 25565 1 . PHE 8 8 25565 1 . SER 9 9 25565 1 . GLU 10 10 25565 1 . THR 11 11 25565 1 . PRO 12 12 25565 1 . LEU 13 13 25565 1 . LEU 14 14 25565 1 . PRO 15 15 25565 1 . SER 16 16 25565 1 . TYR 17 17 25565 1 . ASN 18 18 25565 1 . ILE 19 19 25565 1 . GLN 20 20 25565 1 . VAL 21 21 25565 1 . SER 22 22 25565 1 . VAL 23 23 25565 1 . ALA 24 24 25565 1 . GLN 25 25 25565 1 . GLY 26 26 25565 1 . PRO 27 27 25565 1 . ARG 28 28 25565 1 . ASN 29 29 25565 1 . TRP 30 30 25565 1 . LEU 31 31 25565 1 . LEU 32 32 25565 1 . LEU 33 33 25565 1 . SER 34 34 25565 1 . ASP 35 35 25565 1 . VAL 36 36 25565 1 . LEU 37 37 25565 1 . LYS 38 38 25565 1 . LYS 39 39 25565 1 . LEU 40 40 25565 1 . LYS 41 41 25565 1 . MET 42 42 25565 1 . SER 43 43 25565 1 . SER 44 44 25565 1 . ARG 45 45 25565 1 . ILE 46 46 25565 1 . PHE 47 47 25565 1 . ARG 48 48 25565 1 . SER 49 49 25565 1 . ASN 50 50 25565 1 . PHE 51 51 25565 1 . PRO 52 52 25565 1 . ASN 53 53 25565 1 . VAL 54 54 25565 1 . GLU 55 55 25565 1 . ILE 56 56 25565 1 . VAL 57 57 25565 1 . THR 58 58 25565 1 . ILE 59 59 25565 1 . ALA 60 60 25565 1 . GLU 61 61 25565 1 . ALA 62 62 25565 1 . GLU 63 63 25565 1 . PHE 64 64 25565 1 . TYR 65 65 25565 1 . ARG 66 66 25565 1 . GLN 67 67 25565 1 . VAL 68 68 25565 1 . SER 69 69 25565 1 . ALA 70 70 25565 1 . SER 71 71 25565 1 . LEU 72 72 25565 1 . LEU 73 73 25565 1 . PHE 74 74 25565 1 . SER 75 75 25565 1 . SER 76 76 25565 1 . SER 77 77 25565 1 . LYS 78 78 25565 1 . ASP 79 79 25565 1 . LEU 80 80 25565 1 . GLU 81 81 25565 1 . ALA 82 82 25565 1 . PHE 83 83 25565 1 . ASN 84 84 25565 1 . PRO 85 85 25565 1 . GLU 86 86 25565 1 . SER 87 87 25565 1 . LYS 88 88 25565 1 . GLU 89 89 25565 1 . LEU 90 90 25565 1 . LEU 91 91 25565 1 . ASP 92 92 25565 1 . LEU 93 93 25565 1 . VAL 94 94 25565 1 . GLU 95 95 25565 1 . PHE 96 96 25565 1 . THR 97 97 25565 1 . ASN 98 98 25565 1 . GLU 99 99 25565 1 . ILE 100 100 25565 1 . GLN 101 101 25565 1 . THR 102 102 25565 1 . LEU 103 103 25565 1 . LEU 104 104 25565 1 . GLY 105 105 25565 1 . SER 106 106 25565 1 . SER 107 107 25565 1 . VAL 108 108 25565 1 . GLU 109 109 25565 1 . TRP 110 110 25565 1 . LEU 111 111 25565 1 . HIS 112 112 25565 1 . PRO 113 113 25565 1 . SER 114 114 25565 1 . ASP 115 115 25565 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25565 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25565 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 25565 _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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . 'pET-30a, pET-3c, pCDF-Duet-1' . . 'Plasmids were all modified' 25565 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25565 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity '[U-13C; U-15N]' . . 1 $entity . . 3 . . mM . . . . 25565 1 2 TRIS 'natural abundance' . . . . . . 10 . . mM . . . . 25565 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 25565 1 4 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 25565 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 25565 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 25565 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25565 _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' 30 . mM 25565 1 pH 8 . pH 25565 1 pressure 1 . atm 25565 1 temperature 300 . K 25565 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 25565 _Software.ID 2 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 25565 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25565 2 'chemical shift calculation' 25565 2 'data analysis' 25565 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25565 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25565 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25565 3 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 25565 _Software.ID 4 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 25565 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25565 4 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25565 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25565 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25565 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25565 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25565 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 25565 _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 spectrometer_1 Bruker Avance . 700 . . . 25565 1 2 spectrometer_2 Bruker Avance . 600 . . . 25565 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 25565 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 3 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 4 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 6 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 8 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25565 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25565 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 na indirect 1.0 . . . . . 25565 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25565 _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 $chemical_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 7 '3D 1H-15N NOESY' . . . 25565 1 8 '3D 1H-13C NOESY' . . . 25565 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER HA H 1 4.395 . . . . . . . A 4 SER HA . 25565 1 2 . 1 1 1 1 SER HB2 H 1 3.810 . . . . . . . A 4 SER HB2 . 25565 1 3 . 1 1 1 1 SER HB3 H 1 3.810 . . . . . . . A 4 SER HB3 . 25565 1 4 . 1 1 1 1 SER C C 13 174.123 . . . . . . . A 4 SER C . 25565 1 5 . 1 1 1 1 SER CA C 13 58.527 . . . . . . . A 4 SER CA . 25565 1 6 . 1 1 1 1 SER CB C 13 64.004 . . . . . . . A 4 SER CB . 25565 1 7 . 1 1 2 2 ASP H H 1 8.375 . . . . . . . A 5 ASP H . 25565 1 8 . 1 1 2 2 ASP HA H 1 4.505 . . . . . . . A 5 ASP HA . 25565 1 9 . 1 1 2 2 ASP HB2 H 1 2.582 . . . . . . . A 5 ASP HB2 . 25565 1 10 . 1 1 2 2 ASP HB3 H 1 2.582 . . . . . . . A 5 ASP HB3 . 25565 1 11 . 1 1 2 2 ASP C C 13 175.792 . . . . . . . A 5 ASP C . 25565 1 12 . 1 1 2 2 ASP CA C 13 54.577 . . . . . . . A 5 ASP CA . 25565 1 13 . 1 1 2 2 ASP CB C 13 41.102 . . . . . . . A 5 ASP CB . 25565 1 14 . 1 1 2 2 ASP N N 15 121.971 . . . . . . . A 5 ASP N . 25565 1 15 . 1 1 3 3 VAL H H 1 7.741 . . . . . . . A 6 VAL HN . 25565 1 16 . 1 1 3 3 VAL HA H 1 3.986 . . . . . . . A 6 VAL HA . 25565 1 17 . 1 1 3 3 VAL HB H 1 1.914 . . . . . . . A 6 VAL HB . 25565 1 18 . 1 1 3 3 VAL HG11 H 1 0.734 . . . . . . . A 6 VAL HG11 . 25565 1 19 . 1 1 3 3 VAL HG12 H 1 0.734 . . . . . . . A 6 VAL HG12 . 25565 1 20 . 1 1 3 3 VAL HG13 H 1 0.734 . . . . . . . A 6 VAL HG13 . 25565 1 21 . 1 1 3 3 VAL HG21 H 1 0.762 . . . . . . . A 6 VAL HG21 . 25565 1 22 . 1 1 3 3 VAL HG22 H 1 0.762 . . . . . . . A 6 VAL HG22 . 25565 1 23 . 1 1 3 3 VAL HG23 H 1 0.762 . . . . . . . A 6 VAL HG23 . 25565 1 24 . 1 1 3 3 VAL C C 13 175.550 . . . . . . . A 6 VAL C . 25565 1 25 . 1 1 3 3 VAL CA C 13 62.309 . . . . . . . A 6 VAL CA . 25565 1 26 . 1 1 3 3 VAL CB C 13 32.800 . . . . . . . A 6 VAL CB . 25565 1 27 . 1 1 3 3 VAL CG1 C 13 20.330 . . . . . . . A 6 VAL CG1 . 25565 1 28 . 1 1 3 3 VAL CG2 C 13 21.226 . . . . . . . A 6 VAL CG2 . 25565 1 29 . 1 1 3 3 VAL N N 15 118.333 . . . . . . . A 6 VAL N . 25565 1 30 . 1 1 4 4 PHE H H 1 8.133 . . . . . . . A 7 PHE H . 25565 1 31 . 1 1 4 4 PHE HA H 1 4.550 . . . . . . . A 7 PHE HA . 25565 1 32 . 1 1 4 4 PHE HB2 H 1 2.978 . . . . . . . A 7 PHE HB2 . 25565 1 33 . 1 1 4 4 PHE HB3 H 1 2.877 . . . . . . . A 7 PHE HB3 . 25565 1 34 . 1 1 4 4 PHE C C 13 175.330 . . . . . . . A 7 PHE C . 25565 1 35 . 1 1 4 4 PHE CA C 13 57.686 . . . . . . . A 7 PHE CA . 25565 1 36 . 1 1 4 4 PHE CB C 13 39.704 . . . . . . . A 7 PHE CB . 25565 1 37 . 1 1 4 4 PHE N N 15 123.230 . . . . . . . A 7 PHE N . 25565 1 38 . 1 1 5 5 GLU H H 1 8.106 . . . . . . . A 8 GLU H . 25565 1 39 . 1 1 5 5 GLU HA H 1 4.135 . . . . . . . A 8 GLU HA . 25565 1 40 . 1 1 5 5 GLU HB2 H 1 1.750 . . . . . . . A 8 GLU HB2 . 25565 1 41 . 1 1 5 5 GLU HB3 H 1 1.815 . . . . . . . A 8 GLU HB3 . 25565 1 42 . 1 1 5 5 GLU HG2 H 1 2.055 . . . . . . . A 8 GLU HG2 . 25565 1 43 . 1 1 5 5 GLU HG3 H 1 1.978 . . . . . . . A 8 GLU HG3 . 25565 1 44 . 1 1 5 5 GLU C C 13 175.554 . . . . . . . A 8 GLU C . 25565 1 45 . 1 1 5 5 GLU CA C 13 56.521 . . . . . . . A 8 GLU CA . 25565 1 46 . 1 1 5 5 GLU CB C 13 30.515 . . . . . . . A 8 GLU CB . 25565 1 47 . 1 1 5 5 GLU CG C 13 36.359 . . . . . . . A 8 GLU CG . 25565 1 48 . 1 1 5 5 GLU N N 15 122.400 . . . . . . . A 8 GLU N . 25565 1 49 . 1 1 6 6 PHE H H 1 7.944 . . . . . . . A 9 PHE H . 25565 1 50 . 1 1 6 6 PHE HA H 1 4.486 . . . . . . . A 9 PHE HA . 25565 1 51 . 1 1 6 6 PHE HB2 H 1 2.981 . . . . . . . A 9 PHE HB2 . 25565 1 52 . 1 1 6 6 PHE HB3 H 1 2.863 . . . . . . . A 9 PHE HB3 . 25565 1 53 . 1 1 6 6 PHE C C 13 175.357 . . . . . . . A 9 PHE C . 25565 1 54 . 1 1 6 6 PHE CA C 13 57.731 . . . . . . . A 9 PHE CA . 25565 1 55 . 1 1 6 6 PHE CB C 13 39.806 . . . . . . . A 9 PHE CB . 25565 1 56 . 1 1 6 6 PHE N N 15 120.265 . . . . . . . A 9 PHE N . 25565 1 57 . 1 1 7 7 GLU H H 1 8.202 . . . . . . . A 10 GLU H . 25565 1 58 . 1 1 7 7 GLU HA H 1 4.146 . . . . . . . A 10 GLU HA . 25565 1 59 . 1 1 7 7 GLU HB2 H 1 1.795 . . . . . . . A 10 GLU HB2 . 25565 1 60 . 1 1 7 7 GLU HB3 H 1 1.795 . . . . . . . A 10 GLU HB3 . 25565 1 61 . 1 1 7 7 GLU C C 13 175.743 . . . . . . . A 10 GLU C . 25565 1 62 . 1 1 7 7 GLU CA C 13 56.631 . . . . . . . A 10 GLU CA . 25565 1 63 . 1 1 7 7 GLU CB C 13 30.502 . . . . . . . A 10 GLU CB . 25565 1 64 . 1 1 7 7 GLU CG C 13 36.488 . . . . . . . A 10 GLU CG . 25565 1 65 . 1 1 7 7 GLU N N 15 122.230 . . . . . . . A 10 GLU N . 25565 1 66 . 1 1 8 8 PHE H H 1 8.115 . . . . . . . A 11 PHE H . 25565 1 67 . 1 1 8 8 PHE HA H 1 4.581 . . . . . . . A 11 PHE HA . 25565 1 68 . 1 1 8 8 PHE HB2 H 1 3.085 . . . . . . . A 11 PHE HB2 . 25565 1 69 . 1 1 8 8 PHE HB3 H 1 2.953 . . . . . . . A 11 PHE HB3 . 25565 1 70 . 1 1 8 8 PHE C C 13 175.595 . . . . . . . A 11 PHE C . 25565 1 71 . 1 1 8 8 PHE CA C 13 58.031 . . . . . . . A 11 PHE CA . 25565 1 72 . 1 1 8 8 PHE CB C 13 39.628 . . . . . . . A 11 PHE CB . 25565 1 73 . 1 1 8 8 PHE N N 15 121.046 . . . . . . . A 11 PHE N . 25565 1 74 . 1 1 9 9 SER H H 1 8.077 . . . . . . . A 12 SER H . 25565 1 75 . 1 1 9 9 SER HA H 1 4.349 . . . . . . . A 12 SER HA . 25565 1 76 . 1 1 9 9 SER HB2 H 1 3.772 . . . . . . . A 12 SER HB2 . 25565 1 77 . 1 1 9 9 SER HB3 H 1 3.772 . . . . . . . A 12 SER HB3 . 25565 1 78 . 1 1 9 9 SER CA C 13 58.313 . . . . . . . A 12 SER CA . 25565 1 79 . 1 1 9 9 SER CB C 13 64.191 . . . . . . . A 12 SER CB . 25565 1 80 . 1 1 9 9 SER N N 15 117.340 . . . . . . . A 12 SER N . 25565 1 81 . 1 1 10 10 GLU H H 1 8.297 . . . . . . . A 13 GLU H . 25565 1 82 . 1 1 10 10 GLU HA H 1 4.260 . . . . . . . A 13 GLU HA . 25565 1 83 . 1 1 10 10 GLU HB2 H 1 1.877 . . . . . . . A 13 GLU HB2 . 25565 1 84 . 1 1 10 10 GLU HB3 H 1 2.009 . . . . . . . A 13 GLU HB3 . 25565 1 85 . 1 1 10 10 GLU HG2 H 1 2.073 . . . . . . . A 13 GLU HG2 . 25565 1 86 . 1 1 10 10 GLU C C 13 176.140 . . . . . . . A 13 GLU C . 25565 1 87 . 1 1 10 10 GLU CA C 13 56.589 . . . . . . . A 13 GLU CA . 25565 1 88 . 1 1 10 10 GLU CB C 13 30.526 . . . . . . . A 13 GLU CB . 25565 1 89 . 1 1 10 10 GLU CG C 13 36.478 . . . . . . . A 13 GLU CG . 25565 1 90 . 1 1 10 10 GLU N N 15 122.633 . . . . . . . A 13 GLU N . 25565 1 91 . 1 1 11 11 THR H H 1 8.163 . . . . . . . A 14 THR HN . 25565 1 92 . 1 1 11 11 THR HA H 1 4.501 . . . . . . . A 14 THR HA . 25565 1 93 . 1 1 11 11 THR HB H 1 4.050 . . . . . . . A 14 THR HB . 25565 1 94 . 1 1 11 11 THR HG21 H 1 1.164 . . . . . . . A 14 THR HG21 . 25565 1 95 . 1 1 11 11 THR HG22 H 1 1.164 . . . . . . . A 14 THR HG22 . 25565 1 96 . 1 1 11 11 THR HG23 H 1 1.164 . . . . . . . A 14 THR HG23 . 25565 1 97 . 1 1 11 11 THR C C 13 172.680 . . . . . . . A 14 THR C . 25565 1 98 . 1 1 11 11 THR CA C 13 59.769 . . . . . . . A 14 THR CA . 25565 1 99 . 1 1 11 11 THR CB C 13 70.027 . . . . . . . A 14 THR CB . 25565 1 100 . 1 1 11 11 THR CG2 C 13 21.431 . . . . . . . A 14 THR CG2 . 25565 1 101 . 1 1 11 11 THR N N 15 117.548 . . . . . . . A 14 THR N . 25565 1 102 . 1 1 12 12 PRO HA H 1 4.351 . . . . . . . A 15 PRO HA . 25565 1 103 . 1 1 12 12 PRO HB2 H 1 2.143 . . . . . . . A 15 PRO HB2 . 25565 1 104 . 1 1 12 12 PRO HB3 H 1 1.823 . . . . . . . A 15 PRO HB3 . 25565 1 105 . 1 1 12 12 PRO HG2 H 1 1.894 . . . . . . . A 15 PRO HG2 . 25565 1 106 . 1 1 12 12 PRO HD2 H 1 3.721 . . . . . . . A 15 PRO HD2 . 25565 1 107 . 1 1 12 12 PRO HD3 H 1 3.600 . . . . . . . A 15 PRO HD3 . 25565 1 108 . 1 1 12 12 PRO C C 13 176.642 . . . . . . . A 15 PRO C . 25565 1 109 . 1 1 12 12 PRO CA C 13 63.241 . . . . . . . A 15 PRO CA . 25565 1 110 . 1 1 12 12 PRO CB C 13 32.168 . . . . . . . A 15 PRO CB . 25565 1 111 . 1 1 12 12 PRO CG C 13 27.539 . . . . . . . A 15 PRO CG . 25565 1 112 . 1 1 12 12 PRO CD C 13 51.200 . . . . . . . A 15 PRO CD . 25565 1 113 . 1 1 13 13 LEU H H 1 8.249 . . . . . . . A 16 LEU HN . 25565 1 114 . 1 1 13 13 LEU HA H 1 4.221 . . . . . . . A 16 LEU HA . 25565 1 115 . 1 1 13 13 LEU HB2 H 1 1.547 . . . . . . . A 16 LEU HB2 . 25565 1 116 . 1 1 13 13 LEU HB3 H 1 1.408 . . . . . . . A 16 LEU HB3 . 25565 1 117 . 1 1 13 13 LEU HD11 H 1 0.800 . . . . . . . A 16 LEU HD11 . 25565 1 118 . 1 1 13 13 LEU HD12 H 1 0.800 . . . . . . . A 16 LEU HD12 . 25565 1 119 . 1 1 13 13 LEU HD13 H 1 0.800 . . . . . . . A 16 LEU HD13 . 25565 1 120 . 1 1 13 13 LEU HD21 H 1 0.825 . . . . . . . A 16 LEU HD21 . 25565 1 121 . 1 1 13 13 LEU HD22 H 1 0.825 . . . . . . . A 16 LEU HD22 . 25565 1 122 . 1 1 13 13 LEU HD23 H 1 0.825 . . . . . . . A 16 LEU HD23 . 25565 1 123 . 1 1 13 13 LEU C C 13 176.754 . . . . . . . A 16 LEU C . 25565 1 124 . 1 1 13 13 LEU CA C 13 55.452 . . . . . . . A 16 LEU CA . 25565 1 125 . 1 1 13 13 LEU CB C 13 42.967 . . . . . . . A 16 LEU CB . 25565 1 126 . 1 1 13 13 LEU CG C 13 27.182 . . . . . . . A 16 LEU CG . 25565 1 127 . 1 1 13 13 LEU CD1 C 13 24.052 . . . . . . . A 16 LEU CD1 . 25565 1 128 . 1 1 13 13 LEU CD2 C 13 25.279 . . . . . . . A 16 LEU CD2 . 25565 1 129 . 1 1 13 13 LEU N N 15 122.173 . . . . . . . A 16 LEU N . 25565 1 130 . 1 1 14 14 LEU H H 1 7.900 . . . . . . . A 17 LEU HN . 25565 1 131 . 1 1 14 14 LEU HA H 1 4.561 . . . . . . . A 17 LEU HA . 25565 1 132 . 1 1 14 14 LEU HB2 H 1 1.359 . . . . . . . A 17 LEU HB2 . 25565 1 133 . 1 1 14 14 LEU HB3 H 1 1.450 . . . . . . . A 17 LEU HB3 . 25565 1 134 . 1 1 14 14 LEU HG H 1 1.603 . . . . . . . A 17 LEU HG . 25565 1 135 . 1 1 14 14 LEU HD11 H 1 0.779 . . . . . . . A 17 LEU HD11 . 25565 1 136 . 1 1 14 14 LEU HD12 H 1 0.779 . . . . . . . A 17 LEU HD12 . 25565 1 137 . 1 1 14 14 LEU HD13 H 1 0.779 . . . . . . . A 17 LEU HD13 . 25565 1 138 . 1 1 14 14 LEU HD21 H 1 0.844 . . . . . . . A 17 LEU HD21 . 25565 1 139 . 1 1 14 14 LEU HD22 H 1 0.844 . . . . . . . A 17 LEU HD22 . 25565 1 140 . 1 1 14 14 LEU HD23 H 1 0.844 . . . . . . . A 17 LEU HD23 . 25565 1 141 . 1 1 14 14 LEU CA C 13 52.532 . . . . . . . A 17 LEU CA . 25565 1 142 . 1 1 14 14 LEU CB C 13 43.274 . . . . . . . A 17 LEU CB . 25565 1 143 . 1 1 14 14 LEU CG C 13 27.544 . . . . . . . A 17 LEU CG . 25565 1 144 . 1 1 14 14 LEU N N 15 121.891 . . . . . . . A 17 LEU N . 25565 1 145 . 1 1 15 15 PRO HA H 1 4.186 . . . . . . . A 18 PRO HA . 25565 1 146 . 1 1 15 15 PRO HB2 H 1 2.019 . . . . . . . A 18 PRO HB2 . 25565 1 147 . 1 1 15 15 PRO HB3 H 1 1.566 . . . . . . . A 18 PRO HB3 . 25565 1 148 . 1 1 15 15 PRO HD2 H 1 3.544 . . . . . . . A 18 PRO HD2 . 25565 1 149 . 1 1 15 15 PRO HD3 H 1 3.675 . . . . . . . A 18 PRO HD3 . 25565 1 150 . 1 1 15 15 PRO C C 13 173.612 . . . . . . . A 18 PRO C . 25565 1 151 . 1 1 15 15 PRO CA C 13 62.698 . . . . . . . A 18 PRO CA . 25565 1 152 . 1 1 15 15 PRO CB C 13 32.011 . . . . . . . A 18 PRO CB . 25565 1 153 . 1 1 15 15 PRO CG C 13 27.952 . . . . . . . A 18 PRO CG . 25565 1 154 . 1 1 15 15 PRO CD C 13 50.684 . . . . . . . A 18 PRO CD . 25565 1 155 . 1 1 16 16 SER H H 1 7.349 . . . . . . . A 19 SER H . 25565 1 156 . 1 1 16 16 SER HA H 1 4.922 . . . . . . . A 19 SER HA . 25565 1 157 . 1 1 16 16 SER HB2 H 1 3.483 . . . . . . . A 19 SER HB2 . 25565 1 158 . 1 1 16 16 SER HB3 H 1 3.220 . . . . . . . A 19 SER HB3 . 25565 1 159 . 1 1 16 16 SER C C 13 173.333 . . . . . . . A 19 SER C . 25565 1 160 . 1 1 16 16 SER CA C 13 55.864 . . . . . . . A 19 SER CA . 25565 1 161 . 1 1 16 16 SER CB C 13 66.580 . . . . . . . A 19 SER CB . 25565 1 162 . 1 1 16 16 SER N N 15 111.841 . . . . . . . A 19 SER N . 25565 1 163 . 1 1 17 17 TYR H H 1 9.250 . . . . . . . A 20 TYR H . 25565 1 164 . 1 1 17 17 TYR HA H 1 4.712 . . . . . . . A 20 TYR HA . 25565 1 165 . 1 1 17 17 TYR HB2 H 1 2.646 . . . . . . . A 20 TYR HB2 . 25565 1 166 . 1 1 17 17 TYR HB3 H 1 2.525 . . . . . . . A 20 TYR HB3 . 25565 1 167 . 1 1 17 17 TYR C C 13 174.757 . . . . . . . A 20 TYR C . 25565 1 168 . 1 1 17 17 TYR CA C 13 57.448 . . . . . . . A 20 TYR CA . 25565 1 169 . 1 1 17 17 TYR CB C 13 42.114 . . . . . . . A 20 TYR CB . 25565 1 170 . 1 1 17 17 TYR N N 15 119.886 . . . . . . . A 20 TYR N . 25565 1 171 . 1 1 18 18 ASN H H 1 9.054 . . . . . . . A 21 ASN HN . 25565 1 172 . 1 1 18 18 ASN HA H 1 5.716 . . . . . . . A 21 ASN HA . 25565 1 173 . 1 1 18 18 ASN HB2 H 1 2.752 . . . . . . . A 21 ASN HB2 . 25565 1 174 . 1 1 18 18 ASN HB3 H 1 2.585 . . . . . . . A 21 ASN HB3 . 25565 1 175 . 1 1 18 18 ASN HD21 H 1 6.543 . . . . . . . A 21 ASN HD21 . 25565 1 176 . 1 1 18 18 ASN HD22 H 1 7.124 . . . . . . . A 21 ASN HD22 . 25565 1 177 . 1 1 18 18 ASN C C 13 174.185 . . . . . . . A 21 ASN C . 25565 1 178 . 1 1 18 18 ASN CA C 13 53.060 . . . . . . . A 21 ASN CA . 25565 1 179 . 1 1 18 18 ASN CB C 13 39.572 . . . . . . . A 21 ASN CB . 25565 1 180 . 1 1 18 18 ASN N N 15 126.035 . . . . . . . A 21 ASN N . 25565 1 181 . 1 1 19 19 ILE H H 1 8.686 . . . . . . . A 22 ILE HN . 25565 1 182 . 1 1 19 19 ILE HA H 1 4.569 . . . . . . . A 22 ILE HA . 25565 1 183 . 1 1 19 19 ILE HB H 1 1.756 . . . . . . . A 22 ILE HB . 25565 1 184 . 1 1 19 19 ILE HG12 H 1 1.089 . . . . . . . A 22 ILE HG12 . 25565 1 185 . 1 1 19 19 ILE HG13 H 1 0.954 . . . . . . . A 22 ILE HG13 . 25565 1 186 . 1 1 19 19 ILE HG21 H 1 0.416 . . . . . . . A 22 ILE HG21 . 25565 1 187 . 1 1 19 19 ILE HG22 H 1 0.416 . . . . . . . A 22 ILE HG22 . 25565 1 188 . 1 1 19 19 ILE HG23 H 1 0.416 . . . . . . . A 22 ILE HG23 . 25565 1 189 . 1 1 19 19 ILE HD11 H 1 0.346 . . . . . . . A 22 ILE HD11 . 25565 1 190 . 1 1 19 19 ILE HD12 H 1 0.346 . . . . . . . A 22 ILE HD12 . 25565 1 191 . 1 1 19 19 ILE HD13 H 1 0.346 . . . . . . . A 22 ILE HD13 . 25565 1 192 . 1 1 19 19 ILE C C 13 175.302 . . . . . . . A 22 ILE C . 25565 1 193 . 1 1 19 19 ILE CA C 13 58.731 . . . . . . . A 22 ILE CA . 25565 1 194 . 1 1 19 19 ILE CB C 13 42.138 . . . . . . . A 22 ILE CB . 25565 1 195 . 1 1 19 19 ILE CG1 C 13 26.788 . . . . . . . A 22 ILE CG1 . 25565 1 196 . 1 1 19 19 ILE CG2 C 13 18.417 . . . . . . . A 22 ILE CG2 . 25565 1 197 . 1 1 19 19 ILE CD1 C 13 13.701 . . . . . . . A 22 ILE CD1 . 25565 1 198 . 1 1 19 19 ILE N N 15 120.746 . . . . . . . A 22 ILE N . 25565 1 199 . 1 1 20 20 GLN H H 1 9.694 . . . . . . . A 23 GLN HN . 25565 1 200 . 1 1 20 20 GLN HA H 1 4.719 . . . . . . . A 23 GLN HA . 25565 1 201 . 1 1 20 20 GLN HB2 H 1 1.952 . . . . . . . A 23 GLN HB2 . 25565 1 202 . 1 1 20 20 GLN HB3 H 1 1.636 . . . . . . . A 23 GLN HB3 . 25565 1 203 . 1 1 20 20 GLN HG2 H 1 1.795 . . . . . . . A 23 GLN HG2 . 25565 1 204 . 1 1 20 20 GLN HG3 H 1 1.843 . . . . . . . A 23 GLN HG3 . 25565 1 205 . 1 1 20 20 GLN HE21 H 1 8.333 . . . . . . . A 23 GLN HE21 . 25565 1 206 . 1 1 20 20 GLN HE22 H 1 7.284 . . . . . . . A 23 GLN HE22 . 25565 1 207 . 1 1 20 20 GLN C C 13 174.729 . . . . . . . A 23 GLN C . 25565 1 208 . 1 1 20 20 GLN CA C 13 54.916 . . . . . . . A 23 GLN CA . 25565 1 209 . 1 1 20 20 GLN CB C 13 31.214 . . . . . . . A 23 GLN CB . 25565 1 210 . 1 1 20 20 GLN CG C 13 35.417 . . . . . . . A 23 GLN CG . 25565 1 211 . 1 1 20 20 GLN N N 15 127.442 . . . . . . . A 23 GLN N . 25565 1 212 . 1 1 20 20 GLN NE2 N 15 113.658 . . . . . . . A 23 GLN NE2 . 25565 1 213 . 1 1 21 21 VAL H H 1 9.503 . . . . . . . A 24 VAL HN . 25565 1 214 . 1 1 21 21 VAL HA H 1 3.892 . . . . . . . A 24 VAL HA . 25565 1 215 . 1 1 21 21 VAL HB H 1 1.955 . . . . . . . A 24 VAL HB . 25565 1 216 . 1 1 21 21 VAL HG11 H 1 0.500 . . . . . . . A 24 VAL HG11 . 25565 1 217 . 1 1 21 21 VAL HG12 H 1 0.500 . . . . . . . A 24 VAL HG12 . 25565 1 218 . 1 1 21 21 VAL HG13 H 1 0.500 . . . . . . . A 24 VAL HG13 . 25565 1 219 . 1 1 21 21 VAL HG21 H 1 0.383 . . . . . . . A 24 VAL HG21 . 25565 1 220 . 1 1 21 21 VAL HG22 H 1 0.383 . . . . . . . A 24 VAL HG22 . 25565 1 221 . 1 1 21 21 VAL HG23 H 1 0.383 . . . . . . . A 24 VAL HG23 . 25565 1 222 . 1 1 21 21 VAL C C 13 175.595 . . . . . . . A 24 VAL C . 25565 1 223 . 1 1 21 21 VAL CA C 13 63.633 . . . . . . . A 24 VAL CA . 25565 1 224 . 1 1 21 21 VAL CB C 13 32.063 . . . . . . . A 24 VAL CB . 25565 1 225 . 1 1 21 21 VAL CG1 C 13 21.255 . . . . . . . A 24 VAL CG1 . 25565 1 226 . 1 1 21 21 VAL CG2 C 13 21.107 . . . . . . . A 24 VAL CG2 . 25565 1 227 . 1 1 21 21 VAL N N 15 126.892 . . . . . . . A 24 VAL N . 25565 1 228 . 1 1 22 22 SER H H 1 7.812 . . . . . . . A 25 SER H . 25565 1 229 . 1 1 22 22 SER HA H 1 4.780 . . . . . . . A 25 SER HA . 25565 1 230 . 1 1 22 22 SER HB2 H 1 3.992 . . . . . . . A 25 SER HB2 . 25565 1 231 . 1 1 22 22 SER HB3 H 1 3.684 . . . . . . . A 25 SER HB3 . 25565 1 232 . 1 1 22 22 SER CA C 13 56.175 . . . . . . . A 25 SER CA . 25565 1 233 . 1 1 22 22 SER CB C 13 65.548 . . . . . . . A 25 SER CB . 25565 1 234 . 1 1 22 22 SER N N 15 113.779 . . . . . . . A 25 SER N . 25565 1 235 . 1 1 23 23 VAL HA H 1 3.677 . . . . . . . A 26 VAL HA . 25565 1 236 . 1 1 23 23 VAL HB H 1 2.017 . . . . . . . A 26 VAL HB . 25565 1 237 . 1 1 23 23 VAL HG11 H 1 0.972 . . . . . . . A 26 VAL HG11 . 25565 1 238 . 1 1 23 23 VAL HG12 H 1 0.972 . . . . . . . A 26 VAL HG12 . 25565 1 239 . 1 1 23 23 VAL HG13 H 1 0.972 . . . . . . . A 26 VAL HG13 . 25565 1 240 . 1 1 23 23 VAL HG21 H 1 0.908 . . . . . . . A 26 VAL HG21 . 25565 1 241 . 1 1 23 23 VAL HG22 H 1 0.908 . . . . . . . A 26 VAL HG22 . 25565 1 242 . 1 1 23 23 VAL HG23 H 1 0.908 . . . . . . . A 26 VAL HG23 . 25565 1 243 . 1 1 23 23 VAL C C 13 177.103 . . . . . . . A 26 VAL C . 25565 1 244 . 1 1 23 23 VAL CA C 13 65.245 . . . . . . . A 26 VAL CA . 25565 1 245 . 1 1 23 23 VAL CB C 13 31.445 . . . . . . . A 26 VAL CB . 25565 1 246 . 1 1 23 23 VAL CG1 C 13 21.613 . . . . . . . A 26 VAL CG1 . 25565 1 247 . 1 1 23 23 VAL CG2 C 13 20.845 . . . . . . . A 26 VAL CG2 . 25565 1 248 . 1 1 24 24 ALA H H 1 8.038 . . . . . . . A 27 ALA H . 25565 1 249 . 1 1 24 24 ALA HA H 1 4.115 . . . . . . . A 27 ALA HA . 25565 1 250 . 1 1 24 24 ALA HB1 H 1 1.356 . . . . . . . A 27 ALA HB1 . 25565 1 251 . 1 1 24 24 ALA HB2 H 1 1.356 . . . . . . . A 27 ALA HB2 . 25565 1 252 . 1 1 24 24 ALA HB3 H 1 1.356 . . . . . . . A 27 ALA HB3 . 25565 1 253 . 1 1 24 24 ALA C C 13 178.544 . . . . . . . A 27 ALA C . 25565 1 254 . 1 1 24 24 ALA CA C 13 54.127 . . . . . . . A 27 ALA CA . 25565 1 255 . 1 1 24 24 ALA CB C 13 18.797 . . . . . . . A 27 ALA CB . 25565 1 256 . 1 1 24 24 ALA N N 15 120.963 . . . . . . . A 27 ALA N . 25565 1 257 . 1 1 25 25 GLN H H 1 7.351 . . . . . . . A 28 GLN HN . 25565 1 258 . 1 1 25 25 GLN HA H 1 4.289 . . . . . . . A 28 GLN HA . 25565 1 259 . 1 1 25 25 GLN HB2 H 1 2.280 . . . . . . . A 28 GLN HB2 . 25565 1 260 . 1 1 25 25 GLN HB3 H 1 2.073 . . . . . . . A 28 GLN HB3 . 25565 1 261 . 1 1 25 25 GLN HG2 H 1 2.374 . . . . . . . A 28 GLN HG2 . 25565 1 262 . 1 1 25 25 GLN HE21 H 1 7.451 . . . . . . . A 28 GLN HE21 . 25565 1 263 . 1 1 25 25 GLN HE22 H 1 6.904 . . . . . . . A 28 GLN HE22 . 25565 1 264 . 1 1 25 25 GLN C C 13 177.327 . . . . . . . A 28 GLN C . 25565 1 265 . 1 1 25 25 GLN CA C 13 56.841 . . . . . . . A 28 GLN CA . 25565 1 266 . 1 1 25 25 GLN CB C 13 31.383 . . . . . . . A 28 GLN CB . 25565 1 267 . 1 1 25 25 GLN CG C 13 34.284 . . . . . . . A 28 GLN CG . 25565 1 268 . 1 1 25 25 GLN N N 15 115.836 . . . . . . . A 28 GLN N . 25565 1 269 . 1 1 25 25 GLN NE2 N 15 112.401 . . . . . . . A 28 GLN NE2 . 25565 1 270 . 1 1 26 26 GLY H H 1 7.884 . . . . . . . A 29 GLY H . 25565 1 271 . 1 1 26 26 GLY HA2 H 1 4.273 . . . . . . . A 29 GLY HA2 . 25565 1 272 . 1 1 26 26 GLY HA3 H 1 4.137 . . . . . . . A 29 GLY HA3 . 25565 1 273 . 1 1 26 26 GLY C C 13 182.773 . . . . . . . A 29 GLY C . 25565 1 274 . 1 1 26 26 GLY CA C 13 44.559 . . . . . . . A 29 GLY CA . 25565 1 275 . 1 1 26 26 GLY N N 15 106.159 . . . . . . . A 29 GLY N . 25565 1 276 . 1 1 27 27 PRO HA H 1 4.442 . . . . . . . A 30 PRO HA . 25565 1 277 . 1 1 27 27 PRO HB2 H 1 2.608 . . . . . . . A 30 PRO HB2 . 25565 1 278 . 1 1 27 27 PRO HB3 H 1 1.898 . . . . . . . A 30 PRO HB3 . 25565 1 279 . 1 1 27 27 PRO C C 13 176.935 . . . . . . . A 30 PRO C . 25565 1 280 . 1 1 27 27 PRO CA C 13 63.657 . . . . . . . A 30 PRO CA . 25565 1 281 . 1 1 27 27 PRO CB C 13 31.672 . . . . . . . A 30 PRO CB . 25565 1 282 . 1 1 27 27 PRO CG C 13 28.007 . . . . . . . A 30 PRO CG . 25565 1 283 . 1 1 27 27 PRO CD C 13 49.570 . . . . . . . A 30 PRO CD . 25565 1 284 . 1 1 28 28 ARG H H 1 8.183 . . . . . . . A 31 ARG HN . 25565 1 285 . 1 1 28 28 ARG HA H 1 4.459 . . . . . . . A 31 ARG HA . 25565 1 286 . 1 1 28 28 ARG HB2 H 1 1.283 . . . . . . . A 31 ARG HB2 . 25565 1 287 . 1 1 28 28 ARG HB3 H 1 1.283 . . . . . . . A 31 ARG HB3 . 25565 1 288 . 1 1 28 28 ARG HG2 H 1 1.379 . . . . . . . A 31 ARG HG2 . 25565 1 289 . 1 1 28 28 ARG HG3 H 1 1.589 . . . . . . . A 31 ARG HG3 . 25565 1 290 . 1 1 28 28 ARG HD2 H 1 3.019 . . . . . . . A 31 ARG HD2 . 25565 1 291 . 1 1 28 28 ARG HD3 H 1 3.158 . . . . . . . A 31 ARG HD3 . 25565 1 292 . 1 1 28 28 ARG C C 13 172.771 . . . . . . . A 31 ARG C . 25565 1 293 . 1 1 28 28 ARG CA C 13 53.490 . . . . . . . A 31 ARG CA . 25565 1 294 . 1 1 28 28 ARG CB C 13 33.822 . . . . . . . A 31 ARG CB . 25565 1 295 . 1 1 28 28 ARG CG C 13 26.674 . . . . . . . A 31 ARG CG . 25565 1 296 . 1 1 28 28 ARG CD C 13 43.281 . . . . . . . A 31 ARG CD . 25565 1 297 . 1 1 28 28 ARG N N 15 122.795 . . . . . . . A 31 ARG N . 25565 1 298 . 1 1 29 29 ASN H H 1 8.208 . . . . . . . A 32 ASN HN . 25565 1 299 . 1 1 29 29 ASN HA H 1 5.416 . . . . . . . A 32 ASN HA . 25565 1 300 . 1 1 29 29 ASN HB2 H 1 2.734 . . . . . . . A 32 ASN HB2 . 25565 1 301 . 1 1 29 29 ASN HB3 H 1 2.450 . . . . . . . A 32 ASN HB3 . 25565 1 302 . 1 1 29 29 ASN HD21 H 1 7.381 . . . . . . . A 32 ASN HD21 . 25565 1 303 . 1 1 29 29 ASN HD22 H 1 6.881 . . . . . . . A 32 ASN HD22 . 25565 1 304 . 1 1 29 29 ASN C C 13 174.336 . . . . . . . A 32 ASN C . 25565 1 305 . 1 1 29 29 ASN CA C 13 52.832 . . . . . . . A 32 ASN CA . 25565 1 306 . 1 1 29 29 ASN CB C 13 40.520 . . . . . . . A 32 ASN CB . 25565 1 307 . 1 1 29 29 ASN N N 15 117.113 . . . . . . . A 32 ASN N . 25565 1 308 . 1 1 29 29 ASN ND2 N 15 113.429 . . . . . . . A 32 ASN ND2 . 25565 1 309 . 1 1 30 30 TRP H H 1 9.347 . . . . . . . A 33 TRP H . 25565 1 310 . 1 1 30 30 TRP HA H 1 5.142 . . . . . . . A 33 TRP HA . 25565 1 311 . 1 1 30 30 TRP HB2 H 1 3.360 . . . . . . . A 33 TRP HB2 . 25565 1 312 . 1 1 30 30 TRP HB3 H 1 2.906 . . . . . . . A 33 TRP HB3 . 25565 1 313 . 1 1 30 30 TRP C C 13 175.351 . . . . . . . A 33 TRP C . 25565 1 314 . 1 1 30 30 TRP CA C 13 56.451 . . . . . . . A 33 TRP CA . 25565 1 315 . 1 1 30 30 TRP CB C 13 34.359 . . . . . . . A 33 TRP CB . 25565 1 316 . 1 1 30 30 TRP N N 15 122.912 . . . . . . . A 33 TRP N . 25565 1 317 . 1 1 31 31 LEU H H 1 9.547 . . . . . . . A 34 LEU HN . 25565 1 318 . 1 1 31 31 LEU HA H 1 4.980 . . . . . . . A 34 LEU HA . 25565 1 319 . 1 1 31 31 LEU HB2 H 1 1.434 . . . . . . . A 34 LEU HB2 . 25565 1 320 . 1 1 31 31 LEU HB3 H 1 1.448 . . . . . . . A 34 LEU HB3 . 25565 1 321 . 1 1 31 31 LEU HG H 1 1.316 . . . . . . . A 34 LEU HG . 25565 1 322 . 1 1 31 31 LEU HD11 H 1 0.466 . . . . . . . A 34 LEU HD11 . 25565 1 323 . 1 1 31 31 LEU HD12 H 1 0.466 . . . . . . . A 34 LEU HD12 . 25565 1 324 . 1 1 31 31 LEU HD13 H 1 0.466 . . . . . . . A 34 LEU HD13 . 25565 1 325 . 1 1 31 31 LEU HD21 H 1 0.359 . . . . . . . A 34 LEU HD21 . 25565 1 326 . 1 1 31 31 LEU HD22 H 1 0.359 . . . . . . . A 34 LEU HD22 . 25565 1 327 . 1 1 31 31 LEU HD23 H 1 0.359 . . . . . . . A 34 LEU HD23 . 25565 1 328 . 1 1 31 31 LEU C C 13 177.526 . . . . . . . A 34 LEU C . 25565 1 329 . 1 1 31 31 LEU CA C 13 52.755 . . . . . . . A 34 LEU CA . 25565 1 330 . 1 1 31 31 LEU CB C 13 44.174 . . . . . . . A 34 LEU CB . 25565 1 331 . 1 1 31 31 LEU CD1 C 13 27.323 . . . . . . . A 34 LEU CD1 . 25565 1 332 . 1 1 31 31 LEU CD2 C 13 23.010 . . . . . . . A 34 LEU CD2 . 25565 1 333 . 1 1 31 31 LEU N N 15 118.860 . . . . . . . A 34 LEU N . 25565 1 334 . 1 1 32 32 LEU H H 1 9.898 . . . . . . . A 35 LEU HN . 25565 1 335 . 1 1 32 32 LEU HA H 1 4.492 . . . . . . . A 35 LEU HA . 25565 1 336 . 1 1 32 32 LEU HB2 H 1 1.750 . . . . . . . A 35 LEU HB2 . 25565 1 337 . 1 1 32 32 LEU HB3 H 1 1.637 . . . . . . . A 35 LEU HB3 . 25565 1 338 . 1 1 32 32 LEU HD11 H 1 0.481 . . . . . . . A 35 LEU HD11 . 25565 1 339 . 1 1 32 32 LEU HD12 H 1 0.481 . . . . . . . A 35 LEU HD12 . 25565 1 340 . 1 1 32 32 LEU HD13 H 1 0.481 . . . . . . . A 35 LEU HD13 . 25565 1 341 . 1 1 32 32 LEU HD21 H 1 0.888 . . . . . . . A 35 LEU HD21 . 25565 1 342 . 1 1 32 32 LEU HD22 H 1 0.888 . . . . . . . A 35 LEU HD22 . 25565 1 343 . 1 1 32 32 LEU HD23 H 1 0.888 . . . . . . . A 35 LEU HD23 . 25565 1 344 . 1 1 32 32 LEU C C 13 178.809 . . . . . . . A 35 LEU C . 25565 1 345 . 1 1 32 32 LEU CA C 13 55.126 . . . . . . . A 35 LEU CA . 25565 1 346 . 1 1 32 32 LEU CB C 13 41.187 . . . . . . . A 35 LEU CB . 25565 1 347 . 1 1 32 32 LEU CG C 13 27.694 . . . . . . . A 35 LEU CG . 25565 1 348 . 1 1 32 32 LEU CD1 C 13 24.271 . . . . . . . A 35 LEU CD1 . 25565 1 349 . 1 1 32 32 LEU CD2 C 13 26.012 . . . . . . . A 35 LEU CD2 . 25565 1 350 . 1 1 32 32 LEU N N 15 122.217 . . . . . . . A 35 LEU N . 25565 1 351 . 1 1 33 33 LEU H H 1 8.639 . . . . . . . A 36 LEU HN . 25565 1 352 . 1 1 33 33 LEU HA H 1 3.729 . . . . . . . A 36 LEU HA . 25565 1 353 . 1 1 33 33 LEU HB2 H 1 1.786 . . . . . . . A 36 LEU HB2 . 25565 1 354 . 1 1 33 33 LEU HB3 H 1 0.859 . . . . . . . A 36 LEU HB3 . 25565 1 355 . 1 1 33 33 LEU HG H 1 1.292 . . . . . . . A 36 LEU HG . 25565 1 356 . 1 1 33 33 LEU HD11 H 1 0.771 . . . . . . . A 36 LEU HD11 . 25565 1 357 . 1 1 33 33 LEU HD12 H 1 0.771 . . . . . . . A 36 LEU HD12 . 25565 1 358 . 1 1 33 33 LEU HD13 H 1 0.771 . . . . . . . A 36 LEU HD13 . 25565 1 359 . 1 1 33 33 LEU HD21 H 1 0.109 . . . . . . . A 36 LEU HD21 . 25565 1 360 . 1 1 33 33 LEU HD22 H 1 0.109 . . . . . . . A 36 LEU HD22 . 25565 1 361 . 1 1 33 33 LEU HD23 H 1 0.109 . . . . . . . A 36 LEU HD23 . 25565 1 362 . 1 1 33 33 LEU C C 13 178.055 . . . . . . . A 36 LEU C . 25565 1 363 . 1 1 33 33 LEU CA C 13 58.109 . . . . . . . A 36 LEU CA . 25565 1 364 . 1 1 33 33 LEU CB C 13 41.613 . . . . . . . A 36 LEU CB . 25565 1 365 . 1 1 33 33 LEU CG C 13 26.309 . . . . . . . A 36 LEU CG . 25565 1 366 . 1 1 33 33 LEU CD1 C 13 26.289 . . . . . . . A 36 LEU CD1 . 25565 1 367 . 1 1 33 33 LEU CD2 C 13 22.009 . . . . . . . A 36 LEU CD2 . 25565 1 368 . 1 1 33 33 LEU N N 15 127.885 . . . . . . . A 36 LEU N . 25565 1 369 . 1 1 34 34 SER H H 1 9.160 . . . . . . . A 37 SER H . 25565 1 370 . 1 1 34 34 SER HA H 1 3.785 . . . . . . . A 37 SER HA . 25565 1 371 . 1 1 34 34 SER HB2 H 1 3.781 . . . . . . . A 37 SER HB2 . 25565 1 372 . 1 1 34 34 SER HB3 H 1 3.781 . . . . . . . A 37 SER HB3 . 25565 1 373 . 1 1 34 34 SER C C 13 177.131 . . . . . . . A 37 SER C . 25565 1 374 . 1 1 34 34 SER CA C 13 61.931 . . . . . . . A 37 SER CA . 25565 1 375 . 1 1 34 34 SER CB C 13 61.637 . . . . . . . A 37 SER CB . 25565 1 376 . 1 1 34 34 SER N N 15 112.295 . . . . . . . A 37 SER N . 25565 1 377 . 1 1 35 35 ASP H H 1 6.924 . . . . . . . A 38 ASP H . 25565 1 378 . 1 1 35 35 ASP HA H 1 4.529 . . . . . . . A 38 ASP HA . 25565 1 379 . 1 1 35 35 ASP HB2 H 1 3.101 . . . . . . . A 38 ASP HB2 . 25565 1 380 . 1 1 35 35 ASP HB3 H 1 2.644 . . . . . . . A 38 ASP HB3 . 25565 1 381 . 1 1 35 35 ASP C C 13 178.591 . . . . . . . A 38 ASP C . 25565 1 382 . 1 1 35 35 ASP CA C 13 57.771 . . . . . . . A 38 ASP CA . 25565 1 383 . 1 1 35 35 ASP CB C 13 40.793 . . . . . . . A 38 ASP CB . 25565 1 384 . 1 1 35 35 ASP N N 15 121.314 . . . . . . . A 38 ASP N . 25565 1 385 . 1 1 36 36 VAL H H 1 7.432 . . . . . . . A 39 VAL HN . 25565 1 386 . 1 1 36 36 VAL HA H 1 3.284 . . . . . . . A 39 VAL HA . 25565 1 387 . 1 1 36 36 VAL HB H 1 2.125 . . . . . . . A 39 VAL HB . 25565 1 388 . 1 1 36 36 VAL HG11 H 1 0.797 . . . . . . . A 39 VAL HG11 . 25565 1 389 . 1 1 36 36 VAL HG12 H 1 0.797 . . . . . . . A 39 VAL HG12 . 25565 1 390 . 1 1 36 36 VAL HG13 H 1 0.797 . . . . . . . A 39 VAL HG13 . 25565 1 391 . 1 1 36 36 VAL HG21 H 1 0.617 . . . . . . . A 39 VAL HG21 . 25565 1 392 . 1 1 36 36 VAL HG22 H 1 0.617 . . . . . . . A 39 VAL HG22 . 25565 1 393 . 1 1 36 36 VAL HG23 H 1 0.617 . . . . . . . A 39 VAL HG23 . 25565 1 394 . 1 1 36 36 VAL C C 13 177.372 . . . . . . . A 39 VAL C . 25565 1 395 . 1 1 36 36 VAL CA C 13 67.032 . . . . . . . A 39 VAL CA . 25565 1 396 . 1 1 36 36 VAL CB C 13 31.697 . . . . . . . A 39 VAL CB . 25565 1 397 . 1 1 36 36 VAL CG1 C 13 24.166 . . . . . . . A 39 VAL CG1 . 25565 1 398 . 1 1 36 36 VAL CG2 C 13 21.747 . . . . . . . A 39 VAL CG2 . 25565 1 399 . 1 1 36 36 VAL N N 15 122.556 . . . . . . . A 39 VAL N . 25565 1 400 . 1 1 37 37 LEU H H 1 8.678 . . . . . . . A 40 LEU HN . 25565 1 401 . 1 1 37 37 LEU HA H 1 3.748 . . . . . . . A 40 LEU HA . 25565 1 402 . 1 1 37 37 LEU HB2 H 1 1.623 . . . . . . . A 40 LEU HB2 . 25565 1 403 . 1 1 37 37 LEU HB3 H 1 1.973 . . . . . . . A 40 LEU HB3 . 25565 1 404 . 1 1 37 37 LEU HG H 1 1.773 . . . . . . . A 40 LEU HG . 25565 1 405 . 1 1 37 37 LEU HD11 H 1 0.656 . . . . . . . A 40 LEU HD11 . 25565 1 406 . 1 1 37 37 LEU HD12 H 1 0.656 . . . . . . . A 40 LEU HD12 . 25565 1 407 . 1 1 37 37 LEU HD13 H 1 0.656 . . . . . . . A 40 LEU HD13 . 25565 1 408 . 1 1 37 37 LEU HD21 H 1 0.346 . . . . . . . A 40 LEU HD21 . 25565 1 409 . 1 1 37 37 LEU HD22 H 1 0.346 . . . . . . . A 40 LEU HD22 . 25565 1 410 . 1 1 37 37 LEU HD23 H 1 0.346 . . . . . . . A 40 LEU HD23 . 25565 1 411 . 1 1 37 37 LEU C C 13 177.372 . . . . . . . A 40 LEU C . 25565 1 412 . 1 1 37 37 LEU CA C 13 58.284 . . . . . . . A 40 LEU CA . 25565 1 413 . 1 1 37 37 LEU CB C 13 39.078 . . . . . . . A 40 LEU CB . 25565 1 414 . 1 1 37 37 LEU CD1 C 13 25.630 . . . . . . . A 40 LEU CD1 . 25565 1 415 . 1 1 37 37 LEU CD2 C 13 21.936 . . . . . . . A 40 LEU CD2 . 25565 1 416 . 1 1 37 37 LEU N N 15 117.369 . . . . . . . A 40 LEU N . 25565 1 417 . 1 1 38 38 LYS H H 1 7.465 . . . . . . . A 41 LYS H . 25565 1 418 . 1 1 38 38 LYS HA H 1 4.056 . . . . . . . A 41 LYS HA . 25565 1 419 . 1 1 38 38 LYS HB2 H 1 1.923 . . . . . . . A 41 LYS HB2 . 25565 1 420 . 1 1 38 38 LYS HB3 H 1 1.923 . . . . . . . A 41 LYS HB3 . 25565 1 421 . 1 1 38 38 LYS C C 13 179.316 . . . . . . . A 41 LYS C . 25565 1 422 . 1 1 38 38 LYS CA C 13 59.524 . . . . . . . A 41 LYS CA . 25565 1 423 . 1 1 38 38 LYS CB C 13 32.619 . . . . . . . A 41 LYS CB . 25565 1 424 . 1 1 38 38 LYS CG C 13 25.661 . . . . . . . A 41 LYS CG . 25565 1 425 . 1 1 38 38 LYS CD C 13 29.948 . . . . . . . A 41 LYS CD . 25565 1 426 . 1 1 38 38 LYS CE C 13 42.390 . . . . . . . A 41 LYS CE . 25565 1 427 . 1 1 38 38 LYS N N 15 117.428 . . . . . . . A 41 LYS N . 25565 1 428 . 1 1 39 39 LYS H H 1 7.530 . . . . . . . A 42 LYS H . 25565 1 429 . 1 1 39 39 LYS HA H 1 4.132 . . . . . . . A 42 LYS HA . 25565 1 430 . 1 1 39 39 LYS HB2 H 1 1.950 . . . . . . . A 42 LYS HB2 . 25565 1 431 . 1 1 39 39 LYS HB3 H 1 1.950 . . . . . . . A 42 LYS HB3 . 25565 1 432 . 1 1 39 39 LYS HE2 H 1 2.924 . . . . . . . A 42 LYS HE2 . 25565 1 433 . 1 1 39 39 LYS C C 13 178.037 . . . . . . . A 42 LYS C . 25565 1 434 . 1 1 39 39 LYS CA C 13 58.215 . . . . . . . A 42 LYS CA . 25565 1 435 . 1 1 39 39 LYS CB C 13 32.116 . . . . . . . A 42 LYS CB . 25565 1 436 . 1 1 39 39 LYS CG C 13 25.300 . . . . . . . A 42 LYS CG . 25565 1 437 . 1 1 39 39 LYS CD C 13 28.850 . . . . . . . A 42 LYS CD . 25565 1 438 . 1 1 39 39 LYS CE C 13 42.630 . . . . . . . A 42 LYS CE . 25565 1 439 . 1 1 39 39 LYS N N 15 119.394 . . . . . . . A 42 LYS N . 25565 1 440 . 1 1 40 40 LEU H H 1 8.118 . . . . . . . A 43 LEU HN . 25565 1 441 . 1 1 40 40 LEU HA H 1 4.211 . . . . . . . A 43 LEU HA . 25565 1 442 . 1 1 40 40 LEU HB2 H 1 1.703 . . . . . . . A 43 LEU HB2 . 25565 1 443 . 1 1 40 40 LEU HB3 H 1 1.703 . . . . . . . A 43 LEU HB3 . 25565 1 444 . 1 1 40 40 LEU HG H 1 1.366 . . . . . . . A 43 LEU HG . 25565 1 445 . 1 1 40 40 LEU HD11 H 1 0.883 . . . . . . . A 43 LEU HD11 . 25565 1 446 . 1 1 40 40 LEU HD12 H 1 0.883 . . . . . . . A 43 LEU HD12 . 25565 1 447 . 1 1 40 40 LEU HD13 H 1 0.883 . . . . . . . A 43 LEU HD13 . 25565 1 448 . 1 1 40 40 LEU HD21 H 1 0.836 . . . . . . . A 43 LEU HD21 . 25565 1 449 . 1 1 40 40 LEU HD22 H 1 0.836 . . . . . . . A 43 LEU HD22 . 25565 1 450 . 1 1 40 40 LEU HD23 H 1 0.836 . . . . . . . A 43 LEU HD23 . 25565 1 451 . 1 1 40 40 LEU C C 13 175.698 . . . . . . . A 43 LEU C . 25565 1 452 . 1 1 40 40 LEU CA C 13 55.342 . . . . . . . A 43 LEU CA . 25565 1 453 . 1 1 40 40 LEU CB C 13 42.696 . . . . . . . A 43 LEU CB . 25565 1 454 . 1 1 40 40 LEU CD1 C 13 26.628 . . . . . . . A 43 LEU CD1 . 25565 1 455 . 1 1 40 40 LEU CD2 C 13 22.647 . . . . . . . A 43 LEU CD2 . 25565 1 456 . 1 1 40 40 LEU N N 15 115.467 . . . . . . . A 43 LEU N . 25565 1 457 . 1 1 41 41 LYS H H 1 7.845 . . . . . . . A 44 LYS H . 25565 1 458 . 1 1 41 41 LYS HA H 1 3.789 . . . . . . . A 44 LYS HA . 25565 1 459 . 1 1 41 41 LYS HB2 H 1 2.116 . . . . . . . A 44 LYS HB2 . 25565 1 460 . 1 1 41 41 LYS HB3 H 1 1.791 . . . . . . . A 44 LYS HB3 . 25565 1 461 . 1 1 41 41 LYS C C 13 175.182 . . . . . . . A 44 LYS C . 25565 1 462 . 1 1 41 41 LYS CA C 13 56.997 . . . . . . . A 44 LYS CA . 25565 1 463 . 1 1 41 41 LYS CB C 13 29.063 . . . . . . . A 44 LYS CB . 25565 1 464 . 1 1 41 41 LYS CG C 13 25.100 . . . . . . . A 44 LYS CG . 25565 1 465 . 1 1 41 41 LYS CE C 13 42.672 . . . . . . . A 44 LYS CE . 25565 1 466 . 1 1 41 41 LYS N N 15 116.448 . . . . . . . A 44 LYS N . 25565 1 467 . 1 1 42 42 MET H H 1 7.676 . . . . . . . A 45 MET H . 25565 1 468 . 1 1 42 42 MET HA H 1 4.829 . . . . . . . A 45 MET HA . 25565 1 469 . 1 1 42 42 MET HB2 H 1 2.102 . . . . . . . A 45 MET HB2 . 25565 1 470 . 1 1 42 42 MET HB3 H 1 1.661 . . . . . . . A 45 MET HB3 . 25565 1 471 . 1 1 42 42 MET C C 13 174.425 . . . . . . . A 45 MET C . 25565 1 472 . 1 1 42 42 MET CA C 13 54.637 . . . . . . . A 45 MET CA . 25565 1 473 . 1 1 42 42 MET CB C 13 38.197 . . . . . . . A 45 MET CB . 25565 1 474 . 1 1 42 42 MET CG C 13 32.474 . . . . . . . A 45 MET CG . 25565 1 475 . 1 1 42 42 MET N N 15 115.910 . . . . . . . A 45 MET N . 25565 1 476 . 1 1 43 43 SER H H 1 7.620 . . . . . . . A 46 SER H . 25565 1 477 . 1 1 43 43 SER HA H 1 4.612 . . . . . . . A 46 SER HA . 25565 1 478 . 1 1 43 43 SER HB2 H 1 4.325 . . . . . . . A 46 SER HB2 . 25565 1 479 . 1 1 43 43 SER HB3 H 1 3.981 . . . . . . . A 46 SER HB3 . 25565 1 480 . 1 1 43 43 SER C C 13 178.972 . . . . . . . A 46 SER C . 25565 1 481 . 1 1 43 43 SER CA C 13 56.580 . . . . . . . A 46 SER CA . 25565 1 482 . 1 1 43 43 SER CB C 13 65.540 . . . . . . . A 46 SER CB . 25565 1 483 . 1 1 43 43 SER N N 15 115.168 . . . . . . . A 46 SER N . 25565 1 484 . 1 1 45 45 ARG HA H 1 4.010 . . . . . . . A 48 ARG HA . 25565 1 485 . 1 1 45 45 ARG HB2 H 1 1.870 . . . . . . . A 48 ARG HB2 . 25565 1 486 . 1 1 45 45 ARG HB3 H 1 1.721 . . . . . . . A 48 ARG HB3 . 25565 1 487 . 1 1 45 45 ARG HD2 H 1 3.144 . . . . . . . A 48 ARG HD2 . 25565 1 488 . 1 1 45 45 ARG HD3 H 1 3.144 . . . . . . . A 48 ARG HD3 . 25565 1 489 . 1 1 45 45 ARG C C 13 178.972 . . . . . . . A 48 ARG C . 25565 1 490 . 1 1 45 45 ARG CA C 13 59.566 . . . . . . . A 48 ARG CA . 25565 1 491 . 1 1 45 45 ARG CB C 13 30.248 . . . . . . . A 48 ARG CB . 25565 1 492 . 1 1 45 45 ARG CG C 13 26.944 . . . . . . . A 48 ARG CG . 25565 1 493 . 1 1 45 45 ARG CD C 13 43.544 . . . . . . . A 48 ARG CD . 25565 1 494 . 1 1 46 46 ILE H H 1 7.422 . . . . . . . A 49 ILE HN . 25565 1 495 . 1 1 46 46 ILE HA H 1 3.766 . . . . . . . A 49 ILE HA . 25565 1 496 . 1 1 46 46 ILE HB H 1 1.946 . . . . . . . A 49 ILE HB . 25565 1 497 . 1 1 46 46 ILE HG12 H 1 1.237 . . . . . . . A 49 ILE HG12 . 25565 1 498 . 1 1 46 46 ILE HG13 H 1 1.485 . . . . . . . A 49 ILE HG13 . 25565 1 499 . 1 1 46 46 ILE HG21 H 1 0.935 . . . . . . . A 49 ILE HG21 . 25565 1 500 . 1 1 46 46 ILE HG22 H 1 0.935 . . . . . . . A 49 ILE HG22 . 25565 1 501 . 1 1 46 46 ILE HG23 H 1 0.935 . . . . . . . A 49 ILE HG23 . 25565 1 502 . 1 1 46 46 ILE HD11 H 1 0.806 . . . . . . . A 49 ILE HD11 . 25565 1 503 . 1 1 46 46 ILE HD12 H 1 0.806 . . . . . . . A 49 ILE HD12 . 25565 1 504 . 1 1 46 46 ILE HD13 H 1 0.806 . . . . . . . A 49 ILE HD13 . 25565 1 505 . 1 1 46 46 ILE C C 13 178.134 . . . . . . . A 49 ILE C . 25565 1 506 . 1 1 46 46 ILE CA C 13 63.195 . . . . . . . A 49 ILE CA . 25565 1 507 . 1 1 46 46 ILE CB C 13 37.064 . . . . . . . A 49 ILE CB . 25565 1 508 . 1 1 46 46 ILE CG1 C 13 29.136 . . . . . . . A 49 ILE CG1 . 25565 1 509 . 1 1 46 46 ILE CG2 C 13 17.192 . . . . . . . A 49 ILE CG2 . 25565 1 510 . 1 1 46 46 ILE CD1 C 13 11.239 . . . . . . . A 49 ILE CD1 . 25565 1 511 . 1 1 46 46 ILE N N 15 121.216 . . . . . . . A 49 ILE N . 25565 1 512 . 1 1 47 47 PHE H H 1 8.666 . . . . . . . A 50 PHE H . 25565 1 513 . 1 1 47 47 PHE HA H 1 4.157 . . . . . . . A 50 PHE HA . 25565 1 514 . 1 1 47 47 PHE HB2 H 1 3.138 . . . . . . . A 50 PHE HB2 . 25565 1 515 . 1 1 47 47 PHE HB3 H 1 2.873 . . . . . . . A 50 PHE HB3 . 25565 1 516 . 1 1 47 47 PHE C C 13 176.754 . . . . . . . A 50 PHE C . 25565 1 517 . 1 1 47 47 PHE CA C 13 62.970 . . . . . . . A 50 PHE CA . 25565 1 518 . 1 1 47 47 PHE CB C 13 40.405 . . . . . . . A 50 PHE CB . 25565 1 519 . 1 1 47 47 PHE N N 15 123.372 . . . . . . . A 50 PHE N . 25565 1 520 . 1 1 48 48 ARG H H 1 8.335 . . . . . . . A 51 ARG HN . 25565 1 521 . 1 1 48 48 ARG HA H 1 3.861 . . . . . . . A 51 ARG HA . 25565 1 522 . 1 1 48 48 ARG HB2 H 1 1.862 . . . . . . . A 51 ARG HB2 . 25565 1 523 . 1 1 48 48 ARG HB3 H 1 1.754 . . . . . . . A 51 ARG HB3 . 25565 1 524 . 1 1 48 48 ARG HG2 H 1 1.526 . . . . . . . A 51 ARG HG2 . 25565 1 525 . 1 1 48 48 ARG C C 13 178.469 . . . . . . . A 51 ARG C . 25565 1 526 . 1 1 48 48 ARG CA C 13 59.235 . . . . . . . A 51 ARG CA . 25565 1 527 . 1 1 48 48 ARG CB C 13 30.249 . . . . . . . A 51 ARG CB . 25565 1 528 . 1 1 48 48 ARG CG C 13 29.212 . . . . . . . A 51 ARG CG . 25565 1 529 . 1 1 48 48 ARG CD C 13 43.973 . . . . . . . A 51 ARG CD . 25565 1 530 . 1 1 48 48 ARG N N 15 116.185 . . . . . . . A 51 ARG N . 25565 1 531 . 1 1 49 49 SER H H 1 7.487 . . . . . . . A 52 SER H . 25565 1 532 . 1 1 49 49 SER HA H 1 4.117 . . . . . . . A 52 SER HA . 25565 1 533 . 1 1 49 49 SER HB2 H 1 3.808 . . . . . . . A 52 SER HB2 . 25565 1 534 . 1 1 49 49 SER HB3 H 1 3.858 . . . . . . . A 52 SER HB3 . 25565 1 535 . 1 1 49 49 SER C C 13 177.397 . . . . . . . A 52 SER C . 25565 1 536 . 1 1 49 49 SER CA C 13 60.692 . . . . . . . A 52 SER CA . 25565 1 537 . 1 1 49 49 SER CB C 13 63.492 . . . . . . . A 52 SER CB . 25565 1 538 . 1 1 49 49 SER N N 15 111.319 . . . . . . . A 52 SER N . 25565 1 539 . 1 1 50 50 ASN H H 1 7.891 . . . . . . . A 53 ASN HN . 25565 1 540 . 1 1 50 50 ASN HA H 1 4.111 . . . . . . . A 53 ASN HA . 25565 1 541 . 1 1 50 50 ASN HB2 H 1 2.075 . . . . . . . A 53 ASN HB2 . 25565 1 542 . 1 1 50 50 ASN HB3 H 1 1.370 . . . . . . . A 53 ASN HB3 . 25565 1 543 . 1 1 50 50 ASN HD21 H 1 6.478 . . . . . . . A 53 ASN HD21 . 25565 1 544 . 1 1 50 50 ASN HD22 H 1 7.036 . . . . . . . A 53 ASN HD22 . 25565 1 545 . 1 1 50 50 ASN C C 13 174.836 . . . . . . . A 53 ASN C . 25565 1 546 . 1 1 50 50 ASN CA C 13 55.087 . . . . . . . A 53 ASN CA . 25565 1 547 . 1 1 50 50 ASN CB C 13 39.204 . . . . . . . A 53 ASN CB . 25565 1 548 . 1 1 50 50 ASN N N 15 119.027 . . . . . . . A 53 ASN N . 25565 1 549 . 1 1 50 50 ASN ND2 N 15 111.787 . . . . . . . A 53 ASN ND2 . 25565 1 550 . 1 1 51 51 PHE H H 1 7.716 . . . . . . . A 54 PHE H . 25565 1 551 . 1 1 51 51 PHE HA H 1 4.929 . . . . . . . A 54 PHE HA . 25565 1 552 . 1 1 51 51 PHE HB2 H 1 2.648 . . . . . . . A 54 PHE HB2 . 25565 1 553 . 1 1 51 51 PHE HB3 H 1 2.037 . . . . . . . A 54 PHE HB3 . 25565 1 554 . 1 1 51 51 PHE HD1 H 1 6.563 . . . . . . . A 54 PHE HD1 . 25565 1 555 . 1 1 51 51 PHE HD2 H 1 6.563 . . . . . . . A 54 PHE HD2 . 25565 1 556 . 1 1 51 51 PHE HE1 H 1 7.239 . . . . . . . A 54 PHE HE1 . 25565 1 557 . 1 1 51 51 PHE HE2 H 1 7.239 . . . . . . . A 54 PHE HE2 . 25565 1 558 . 1 1 51 51 PHE CA C 13 54.900 . . . . . . . A 54 PHE CA . 25565 1 559 . 1 1 51 51 PHE CB C 13 37.460 . . . . . . . A 54 PHE CB . 25565 1 560 . 1 1 51 51 PHE N N 15 117.185 . . . . . . . A 54 PHE N . 25565 1 561 . 1 1 52 52 PRO HA H 1 4.489 . . . . . . . A 55 PRO HA . 25565 1 562 . 1 1 52 52 PRO HB2 H 1 2.254 . . . . . . . A 55 PRO HB2 . 25565 1 563 . 1 1 52 52 PRO HB3 H 1 1.928 . . . . . . . A 55 PRO HB3 . 25565 1 564 . 1 1 52 52 PRO HG2 H 1 1.754 . . . . . . . A 55 PRO HG2 . 25565 1 565 . 1 1 52 52 PRO HG3 H 1 1.754 . . . . . . . A 55 PRO HG3 . 25565 1 566 . 1 1 52 52 PRO HD2 H 1 3.681 . . . . . . . A 55 PRO HD2 . 25565 1 567 . 1 1 52 52 PRO HD3 H 1 3.461 . . . . . . . A 55 PRO HD3 . 25565 1 568 . 1 1 52 52 PRO C C 13 177.225 . . . . . . . A 55 PRO C . 25565 1 569 . 1 1 52 52 PRO CA C 13 64.783 . . . . . . . A 55 PRO CA . 25565 1 570 . 1 1 52 52 PRO CB C 13 32.068 . . . . . . . A 55 PRO CB . 25565 1 571 . 1 1 52 52 PRO CG C 13 27.280 . . . . . . . A 55 PRO CG . 25565 1 572 . 1 1 52 52 PRO CD C 13 50.495 . . . . . . . A 55 PRO CD . 25565 1 573 . 1 1 53 53 ASN H H 1 8.649 . . . . . . . A 56 ASN HN . 25565 1 574 . 1 1 53 53 ASN HA H 1 4.752 . . . . . . . A 56 ASN HA . 25565 1 575 . 1 1 53 53 ASN HB2 H 1 2.898 . . . . . . . A 56 ASN HB2 . 25565 1 576 . 1 1 53 53 ASN HB3 H 1 2.775 . . . . . . . A 56 ASN HB3 . 25565 1 577 . 1 1 53 53 ASN HD21 H 1 6.958 . . . . . . . A 56 ASN HD21 . 25565 1 578 . 1 1 53 53 ASN HD22 H 1 7.641 . . . . . . . A 56 ASN HD22 . 25565 1 579 . 1 1 53 53 ASN C C 13 175.190 . . . . . . . A 56 ASN C . 25565 1 580 . 1 1 53 53 ASN CA C 13 53.298 . . . . . . . A 56 ASN CA . 25565 1 581 . 1 1 53 53 ASN CB C 13 38.418 . . . . . . . A 56 ASN CB . 25565 1 582 . 1 1 53 53 ASN N N 15 114.706 . . . . . . . A 56 ASN N . 25565 1 583 . 1 1 53 53 ASN ND2 N 15 114.083 . . . . . . . A 56 ASN ND2 . 25565 1 584 . 1 1 54 54 VAL H H 1 7.236 . . . . . . . A 57 VAL HN . 25565 1 585 . 1 1 54 54 VAL HA H 1 3.985 . . . . . . . A 57 VAL HA . 25565 1 586 . 1 1 54 54 VAL HB H 1 2.165 . . . . . . . A 57 VAL HB . 25565 1 587 . 1 1 54 54 VAL HG11 H 1 1.093 . . . . . . . A 57 VAL HG11 . 25565 1 588 . 1 1 54 54 VAL HG12 H 1 1.093 . . . . . . . A 57 VAL HG12 . 25565 1 589 . 1 1 54 54 VAL HG13 H 1 1.093 . . . . . . . A 57 VAL HG13 . 25565 1 590 . 1 1 54 54 VAL HG21 H 1 0.875 . . . . . . . A 57 VAL HG21 . 25565 1 591 . 1 1 54 54 VAL HG22 H 1 0.875 . . . . . . . A 57 VAL HG22 . 25565 1 592 . 1 1 54 54 VAL HG23 H 1 0.875 . . . . . . . A 57 VAL HG23 . 25565 1 593 . 1 1 54 54 VAL C C 13 175.085 . . . . . . . A 57 VAL C . 25565 1 594 . 1 1 54 54 VAL CA C 13 62.840 . . . . . . . A 57 VAL CA . 25565 1 595 . 1 1 54 54 VAL CB C 13 31.992 . . . . . . . A 57 VAL CB . 25565 1 596 . 1 1 54 54 VAL CG1 C 13 21.933 . . . . . . . A 57 VAL CG1 . 25565 1 597 . 1 1 54 54 VAL CG2 C 13 22.222 . . . . . . . A 57 VAL CG2 . 25565 1 598 . 1 1 54 54 VAL N N 15 121.975 . . . . . . . A 57 VAL N . 25565 1 599 . 1 1 55 55 GLU H H 1 8.851 . . . . . . . A 58 GLU H . 25565 1 600 . 1 1 55 55 GLU HA H 1 4.259 . . . . . . . A 58 GLU HA . 25565 1 601 . 1 1 55 55 GLU HB2 H 1 2.035 . . . . . . . A 58 GLU HB2 . 25565 1 602 . 1 1 55 55 GLU HB3 H 1 2.035 . . . . . . . A 58 GLU HB3 . 25565 1 603 . 1 1 55 55 GLU HG2 H 1 2.190 . . . . . . . A 58 GLU HG2 . 25565 1 604 . 1 1 55 55 GLU HG3 H 1 2.300 . . . . . . . A 58 GLU HG3 . 25565 1 605 . 1 1 55 55 GLU C C 13 175.042 . . . . . . . A 58 GLU C . 25565 1 606 . 1 1 55 55 GLU CA C 13 57.040 . . . . . . . A 58 GLU CA . 25565 1 607 . 1 1 55 55 GLU CB C 13 30.436 . . . . . . . A 58 GLU CB . 25565 1 608 . 1 1 55 55 GLU CG C 13 36.743 . . . . . . . A 58 GLU CG . 25565 1 609 . 1 1 55 55 GLU N N 15 130.503 . . . . . . . A 58 GLU N . 25565 1 610 . 1 1 56 56 ILE H H 1 8.426 . . . . . . . A 59 ILE HN . 25565 1 611 . 1 1 56 56 ILE HA H 1 4.921 . . . . . . . A 59 ILE HA . 25565 1 612 . 1 1 56 56 ILE HB H 1 1.706 . . . . . . . A 59 ILE HB . 25565 1 613 . 1 1 56 56 ILE HG12 H 1 1.018 . . . . . . . A 59 ILE HG12 . 25565 1 614 . 1 1 56 56 ILE HG13 H 1 1.047 . . . . . . . A 59 ILE HG13 . 25565 1 615 . 1 1 56 56 ILE HG21 H 1 0.782 . . . . . . . A 59 ILE HG21 . 25565 1 616 . 1 1 56 56 ILE HG22 H 1 0.782 . . . . . . . A 59 ILE HG22 . 25565 1 617 . 1 1 56 56 ILE HG23 H 1 0.782 . . . . . . . A 59 ILE HG23 . 25565 1 618 . 1 1 56 56 ILE HD11 H 1 0.911 . . . . . . . A 59 ILE HD11 . 25565 1 619 . 1 1 56 56 ILE HD12 H 1 0.911 . . . . . . . A 59 ILE HD12 . 25565 1 620 . 1 1 56 56 ILE HD13 H 1 0.911 . . . . . . . A 59 ILE HD13 . 25565 1 621 . 1 1 56 56 ILE C C 13 176.705 . . . . . . . A 59 ILE C . 25565 1 622 . 1 1 56 56 ILE CA C 13 60.349 . . . . . . . A 59 ILE CA . 25565 1 623 . 1 1 56 56 ILE CB C 13 39.155 . . . . . . . A 59 ILE CB . 25565 1 624 . 1 1 56 56 ILE CG1 C 13 28.339 . . . . . . . A 59 ILE CG1 . 25565 1 625 . 1 1 56 56 ILE CG2 C 13 18.454 . . . . . . . A 59 ILE CG2 . 25565 1 626 . 1 1 56 56 ILE CD1 C 13 13.827 . . . . . . . A 59 ILE CD1 . 25565 1 627 . 1 1 56 56 ILE N N 15 127.188 . . . . . . . A 59 ILE N . 25565 1 628 . 1 1 57 57 VAL H H 1 8.940 . . . . . . . A 60 VAL HN . 25565 1 629 . 1 1 57 57 VAL HA H 1 4.454 . . . . . . . A 60 VAL HA . 25565 1 630 . 1 1 57 57 VAL HB H 1 1.709 . . . . . . . A 60 VAL HB . 25565 1 631 . 1 1 57 57 VAL HG11 H 1 0.681 . . . . . . . A 60 VAL HG11 . 25565 1 632 . 1 1 57 57 VAL HG12 H 1 0.681 . . . . . . . A 60 VAL HG12 . 25565 1 633 . 1 1 57 57 VAL HG13 H 1 0.681 . . . . . . . A 60 VAL HG13 . 25565 1 634 . 1 1 57 57 VAL HG21 H 1 0.675 . . . . . . . A 60 VAL HG21 . 25565 1 635 . 1 1 57 57 VAL HG22 H 1 0.675 . . . . . . . A 60 VAL HG22 . 25565 1 636 . 1 1 57 57 VAL HG23 H 1 0.675 . . . . . . . A 60 VAL HG23 . 25565 1 637 . 1 1 57 57 VAL C C 13 174.033 . . . . . . . A 60 VAL C . 25565 1 638 . 1 1 57 57 VAL CA C 13 60.526 . . . . . . . A 60 VAL CA . 25565 1 639 . 1 1 57 57 VAL CB C 13 34.476 . . . . . . . A 60 VAL CB . 25565 1 640 . 1 1 57 57 VAL CG1 C 13 21.341 . . . . . . . A 60 VAL CG1 . 25565 1 641 . 1 1 57 57 VAL CG2 C 13 21.429 . . . . . . . A 60 VAL CG2 . 25565 1 642 . 1 1 57 57 VAL N N 15 128.437 . . . . . . . A 60 VAL N . 25565 1 643 . 1 1 58 58 THR H H 1 8.048 . . . . . . . A 61 THR HN . 25565 1 644 . 1 1 58 58 THR HA H 1 5.452 . . . . . . . A 61 THR HA . 25565 1 645 . 1 1 58 58 THR HB H 1 3.772 . . . . . . . A 61 THR HB . 25565 1 646 . 1 1 58 58 THR HG21 H 1 1.105 . . . . . . . A 61 THR HG21 . 25565 1 647 . 1 1 58 58 THR HG22 H 1 1.105 . . . . . . . A 61 THR HG22 . 25565 1 648 . 1 1 58 58 THR HG23 H 1 1.105 . . . . . . . A 61 THR HG23 . 25565 1 649 . 1 1 58 58 THR C C 13 173.955 . . . . . . . A 61 THR C . 25565 1 650 . 1 1 58 58 THR CA C 13 60.243 . . . . . . . A 61 THR CA . 25565 1 651 . 1 1 58 58 THR CB C 13 71.966 . . . . . . . A 61 THR CB . 25565 1 652 . 1 1 58 58 THR CG2 C 13 22.635 . . . . . . . A 61 THR CG2 . 25565 1 653 . 1 1 58 58 THR N N 15 116.448 . . . . . . . A 61 THR N . 25565 1 654 . 1 1 59 59 ILE H H 1 8.565 . . . . . . . A 62 ILE HN . 25565 1 655 . 1 1 59 59 ILE HA H 1 4.436 . . . . . . . A 62 ILE HA . 25565 1 656 . 1 1 59 59 ILE HB H 1 1.416 . . . . . . . A 62 ILE HB . 25565 1 657 . 1 1 59 59 ILE HG12 H 1 1.223 . . . . . . . A 62 ILE HG12 . 25565 1 658 . 1 1 59 59 ILE HG13 H 1 1.545 . . . . . . . A 62 ILE HG13 . 25565 1 659 . 1 1 59 59 ILE HG21 H 1 0.595 . . . . . . . A 62 ILE HG21 . 25565 1 660 . 1 1 59 59 ILE HG22 H 1 0.595 . . . . . . . A 62 ILE HG22 . 25565 1 661 . 1 1 59 59 ILE HG23 H 1 0.595 . . . . . . . A 62 ILE HG23 . 25565 1 662 . 1 1 59 59 ILE HD11 H 1 0.624 . . . . . . . A 62 ILE HD11 . 25565 1 663 . 1 1 59 59 ILE HD12 H 1 0.624 . . . . . . . A 62 ILE HD12 . 25565 1 664 . 1 1 59 59 ILE HD13 H 1 0.624 . . . . . . . A 62 ILE HD13 . 25565 1 665 . 1 1 59 59 ILE C C 13 172.532 . . . . . . . A 62 ILE C . 25565 1 666 . 1 1 59 59 ILE CA C 13 58.689 . . . . . . . A 62 ILE CA . 25565 1 667 . 1 1 59 59 ILE CB C 13 42.534 . . . . . . . A 62 ILE CB . 25565 1 668 . 1 1 59 59 ILE CG1 C 13 27.856 . . . . . . . A 62 ILE CG1 . 25565 1 669 . 1 1 59 59 ILE CG2 C 13 16.569 . . . . . . . A 62 ILE CG2 . 25565 1 670 . 1 1 59 59 ILE CD1 C 13 15.055 . . . . . . . A 62 ILE CD1 . 25565 1 671 . 1 1 59 59 ILE N N 15 120.523 . . . . . . . A 62 ILE N . 25565 1 672 . 1 1 60 60 ALA H H 1 8.665 . . . . . . . A 63 ALA H . 25565 1 673 . 1 1 60 60 ALA HA H 1 4.370 . . . . . . . A 63 ALA HA . 25565 1 674 . 1 1 60 60 ALA HB1 H 1 1.439 . . . . . . . A 63 ALA HB1 . 25565 1 675 . 1 1 60 60 ALA HB2 H 1 1.439 . . . . . . . A 63 ALA HB2 . 25565 1 676 . 1 1 60 60 ALA HB3 H 1 1.439 . . . . . . . A 63 ALA HB3 . 25565 1 677 . 1 1 60 60 ALA C C 13 178.963 . . . . . . . A 63 ALA C . 25565 1 678 . 1 1 60 60 ALA CA C 13 52.948 . . . . . . . A 63 ALA CA . 25565 1 679 . 1 1 60 60 ALA CB C 13 18.391 . . . . . . . A 63 ALA CB . 25565 1 680 . 1 1 60 60 ALA N N 15 128.353 . . . . . . . A 63 ALA N . 25565 1 681 . 1 1 61 61 GLU H H 1 9.316 . . . . . . . A 64 GLU H . 25565 1 682 . 1 1 61 61 GLU HA H 1 3.717 . . . . . . . A 64 GLU HA . 25565 1 683 . 1 1 61 61 GLU HB2 H 1 1.898 . . . . . . . A 64 GLU HB2 . 25565 1 684 . 1 1 61 61 GLU HB3 H 1 1.979 . . . . . . . A 64 GLU HB3 . 25565 1 685 . 1 1 61 61 GLU HG2 H 1 2.261 . . . . . . . A 64 GLU HG2 . 25565 1 686 . 1 1 61 61 GLU HG3 H 1 2.620 . . . . . . . A 64 GLU HG3 . 25565 1 687 . 1 1 61 61 GLU C C 13 177.911 . . . . . . . A 64 GLU C . 25565 1 688 . 1 1 61 61 GLU CA C 13 60.510 . . . . . . . A 64 GLU CA . 25565 1 689 . 1 1 61 61 GLU CB C 13 29.142 . . . . . . . A 64 GLU CB . 25565 1 690 . 1 1 61 61 GLU CG C 13 36.177 . . . . . . . A 64 GLU CG . 25565 1 691 . 1 1 61 61 GLU N N 15 127.925 . . . . . . . A 64 GLU N . 25565 1 692 . 1 1 62 62 ALA H H 1 8.661 . . . . . . . A 65 ALA H . 25565 1 693 . 1 1 62 62 ALA HA H 1 4.011 . . . . . . . A 65 ALA HA . 25565 1 694 . 1 1 62 62 ALA HB1 H 1 1.386 . . . . . . . A 65 ALA HB1 . 25565 1 695 . 1 1 62 62 ALA HB2 H 1 1.386 . . . . . . . A 65 ALA HB2 . 25565 1 696 . 1 1 62 62 ALA HB3 H 1 1.386 . . . . . . . A 65 ALA HB3 . 25565 1 697 . 1 1 62 62 ALA C C 13 180.170 . . . . . . . A 65 ALA C . 25565 1 698 . 1 1 62 62 ALA CA C 13 55.713 . . . . . . . A 65 ALA CA . 25565 1 699 . 1 1 62 62 ALA CB C 13 19.232 . . . . . . . A 65 ALA CB . 25565 1 700 . 1 1 62 62 ALA N N 15 117.868 . . . . . . . A 65 ALA N . 25565 1 701 . 1 1 63 63 GLU H H 1 6.908 . . . . . . . A 66 GLU H . 25565 1 702 . 1 1 63 63 GLU HA H 1 4.390 . . . . . . . A 66 GLU HA . 25565 1 703 . 1 1 63 63 GLU HB2 H 1 2.144 . . . . . . . A 66 GLU HB2 . 25565 1 704 . 1 1 63 63 GLU HB3 H 1 2.038 . . . . . . . A 66 GLU HB3 . 25565 1 705 . 1 1 63 63 GLU HG2 H 1 2.478 . . . . . . . A 66 GLU HG2 . 25565 1 706 . 1 1 63 63 GLU HG3 H 1 2.478 . . . . . . . A 66 GLU HG3 . 25565 1 707 . 1 1 63 63 GLU C C 13 177.641 . . . . . . . A 66 GLU C . 25565 1 708 . 1 1 63 63 GLU CA C 13 57.965 . . . . . . . A 66 GLU CA . 25565 1 709 . 1 1 63 63 GLU CB C 13 29.150 . . . . . . . A 66 GLU CB . 25565 1 710 . 1 1 63 63 GLU CG C 13 35.398 . . . . . . . A 66 GLU CG . 25565 1 711 . 1 1 63 63 GLU N N 15 118.699 . . . . . . . A 66 GLU N . 25565 1 712 . 1 1 64 64 PHE H H 1 8.268 . . . . . . . A 67 PHE H . 25565 1 713 . 1 1 64 64 PHE HA H 1 3.596 . . . . . . . A 67 PHE HA . 25565 1 714 . 1 1 64 64 PHE HB2 H 1 3.129 . . . . . . . A 67 PHE HB2 . 25565 1 715 . 1 1 64 64 PHE HB3 H 1 2.574 . . . . . . . A 67 PHE HB3 . 25565 1 716 . 1 1 64 64 PHE C C 13 175.834 . . . . . . . A 67 PHE C . 25565 1 717 . 1 1 64 64 PHE CA C 13 62.037 . . . . . . . A 67 PHE CA . 25565 1 718 . 1 1 64 64 PHE CB C 13 39.475 . . . . . . . A 67 PHE CB . 25565 1 719 . 1 1 64 64 PHE N N 15 121.543 . . . . . . . A 67 PHE N . 25565 1 720 . 1 1 65 65 TYR H H 1 8.876 . . . . . . . A 68 TYR H . 25565 1 721 . 1 1 65 65 TYR HA H 1 3.391 . . . . . . . A 68 TYR HA . 25565 1 722 . 1 1 65 65 TYR HB2 H 1 3.243 . . . . . . . A 68 TYR HB2 . 25565 1 723 . 1 1 65 65 TYR HB3 H 1 2.780 . . . . . . . A 68 TYR HB3 . 25565 1 724 . 1 1 65 65 TYR HD1 H 1 6.869 . . . . . . . A 68 TYR HD1 . 25565 1 725 . 1 1 65 65 TYR HD2 H 1 6.869 . . . . . . . A 68 TYR HD2 . 25565 1 726 . 1 1 65 65 TYR C C 13 178.149 . . . . . . . A 68 TYR C . 25565 1 727 . 1 1 65 65 TYR CA C 13 62.068 . . . . . . . A 68 TYR CA . 25565 1 728 . 1 1 65 65 TYR CB C 13 39.075 . . . . . . . A 68 TYR CB . 25565 1 729 . 1 1 65 65 TYR N N 15 117.704 . . . . . . . A 68 TYR N . 25565 1 730 . 1 1 66 66 ARG H H 1 7.915 . . . . . . . A 69 ARG HN . 25565 1 731 . 1 1 66 66 ARG HA H 1 3.869 . . . . . . . A 69 ARG HA . 25565 1 732 . 1 1 66 66 ARG HB2 H 1 1.999 . . . . . . . A 69 ARG HB2 . 25565 1 733 . 1 1 66 66 ARG HB3 H 1 1.999 . . . . . . . A 69 ARG HB3 . 25565 1 734 . 1 1 66 66 ARG HG2 H 1 1.525 . . . . . . . A 69 ARG HG2 . 25565 1 735 . 1 1 66 66 ARG HG3 H 1 1.788 . . . . . . . A 69 ARG HG3 . 25565 1 736 . 1 1 66 66 ARG HD2 H 1 3.300 . . . . . . . A 69 ARG HD2 . 25565 1 737 . 1 1 66 66 ARG HD3 H 1 3.161 . . . . . . . A 69 ARG HD3 . 25565 1 738 . 1 1 66 66 ARG C C 13 178.878 . . . . . . . A 69 ARG C . 25565 1 739 . 1 1 66 66 ARG CA C 13 60.172 . . . . . . . A 69 ARG CA . 25565 1 740 . 1 1 66 66 ARG CB C 13 30.688 . . . . . . . A 69 ARG CB . 25565 1 741 . 1 1 66 66 ARG CG C 13 27.756 . . . . . . . A 69 ARG CG . 25565 1 742 . 1 1 66 66 ARG CD C 13 43.384 . . . . . . . A 69 ARG CD . 25565 1 743 . 1 1 66 66 ARG N N 15 119.604 . . . . . . . A 69 ARG N . 25565 1 744 . 1 1 67 67 GLN H H 1 7.931 . . . . . . . A 70 GLN HN . 25565 1 745 . 1 1 67 67 GLN HA H 1 3.974 . . . . . . . A 70 GLN HA . 25565 1 746 . 1 1 67 67 GLN HB2 H 1 2.187 . . . . . . . A 70 GLN HB2 . 25565 1 747 . 1 1 67 67 GLN HB3 H 1 1.666 . . . . . . . A 70 GLN HB3 . 25565 1 748 . 1 1 67 67 GLN HG2 H 1 2.576 . . . . . . . A 70 GLN HG2 . 25565 1 749 . 1 1 67 67 GLN HG3 H 1 2.576 . . . . . . . A 70 GLN HG3 . 25565 1 750 . 1 1 67 67 GLN HE21 H 1 7.282 . . . . . . . A 70 GLN HE21 . 25565 1 751 . 1 1 67 67 GLN HE22 H 1 8.332 . . . . . . . A 70 GLN HE22 . 25565 1 752 . 1 1 67 67 GLN C C 13 179.355 . . . . . . . A 70 GLN C . 25565 1 753 . 1 1 67 67 GLN CA C 13 60.117 . . . . . . . A 70 GLN CA . 25565 1 754 . 1 1 67 67 GLN CB C 13 29.620 . . . . . . . A 70 GLN CB . 25565 1 755 . 1 1 67 67 GLN CG C 13 34.267 . . . . . . . A 70 GLN CG . 25565 1 756 . 1 1 67 67 GLN N N 15 116.376 . . . . . . . A 70 GLN N . 25565 1 757 . 1 1 67 67 GLN NE2 N 15 113.726 . . . . . . . A 70 GLN NE2 . 25565 1 758 . 1 1 68 68 VAL H H 1 8.343 . . . . . . . A 71 VAL HN . 25565 1 759 . 1 1 68 68 VAL HA H 1 3.636 . . . . . . . A 71 VAL HA . 25565 1 760 . 1 1 68 68 VAL HB H 1 1.381 . . . . . . . A 71 VAL HB . 25565 1 761 . 1 1 68 68 VAL HG11 H 1 0.528 . . . . . . . A 71 VAL HG11 . 25565 1 762 . 1 1 68 68 VAL HG12 H 1 0.528 . . . . . . . A 71 VAL HG12 . 25565 1 763 . 1 1 68 68 VAL HG13 H 1 0.528 . . . . . . . A 71 VAL HG13 . 25565 1 764 . 1 1 68 68 VAL HG21 H 1 -0.007 . . . . . . . A 71 VAL HG21 . 25565 1 765 . 1 1 68 68 VAL HG22 H 1 -0.007 . . . . . . . A 71 VAL HG22 . 25565 1 766 . 1 1 68 68 VAL HG23 H 1 -0.007 . . . . . . . A 71 VAL HG23 . 25565 1 767 . 1 1 68 68 VAL C C 13 178.923 . . . . . . . A 71 VAL C . 25565 1 768 . 1 1 68 68 VAL CA C 13 65.877 . . . . . . . A 71 VAL CA . 25565 1 769 . 1 1 68 68 VAL CB C 13 31.354 . . . . . . . A 71 VAL CB . 25565 1 770 . 1 1 68 68 VAL CG1 C 13 21.868 . . . . . . . A 71 VAL CG1 . 25565 1 771 . 1 1 68 68 VAL CG2 C 13 22.141 . . . . . . . A 71 VAL CG2 . 25565 1 772 . 1 1 68 68 VAL N N 15 119.611 . . . . . . . A 71 VAL N . 25565 1 773 . 1 1 69 69 SER H H 1 8.183 . . . . . . . A 72 SER H . 25565 1 774 . 1 1 69 69 SER HA H 1 3.733 . . . . . . . A 72 SER HA . 25565 1 775 . 1 1 69 69 SER HB2 H 1 3.445 . . . . . . . A 72 SER HB2 . 25565 1 776 . 1 1 69 69 SER HB3 H 1 3.445 . . . . . . . A 72 SER HB3 . 25565 1 777 . 1 1 69 69 SER C C 13 175.645 . . . . . . . A 72 SER C . 25565 1 778 . 1 1 69 69 SER CA C 13 61.602 . . . . . . . A 72 SER CA . 25565 1 779 . 1 1 69 69 SER CB C 13 62.909 . . . . . . . A 72 SER CB . 25565 1 780 . 1 1 69 69 SER N N 15 114.966 . . . . . . . A 72 SER N . 25565 1 781 . 1 1 70 70 ALA H H 1 7.250 . . . . . . . A 73 ALA H . 25565 1 782 . 1 1 70 70 ALA HA H 1 4.175 . . . . . . . A 73 ALA HA . 25565 1 783 . 1 1 70 70 ALA HB1 H 1 1.433 . . . . . . . A 73 ALA HB1 . 25565 1 784 . 1 1 70 70 ALA HB2 H 1 1.433 . . . . . . . A 73 ALA HB2 . 25565 1 785 . 1 1 70 70 ALA HB3 H 1 1.433 . . . . . . . A 73 ALA HB3 . 25565 1 786 . 1 1 70 70 ALA C C 13 178.517 . . . . . . . A 73 ALA C . 25565 1 787 . 1 1 70 70 ALA CA C 13 53.719 . . . . . . . A 73 ALA CA . 25565 1 788 . 1 1 70 70 ALA CB C 13 18.755 . . . . . . . A 73 ALA CB . 25565 1 789 . 1 1 70 70 ALA N N 15 121.762 . . . . . . . A 73 ALA N . 25565 1 790 . 1 1 71 71 SER H H 1 7.562 . . . . . . . A 74 SER H . 25565 1 791 . 1 1 71 71 SER HA H 1 4.410 . . . . . . . A 74 SER HA . 25565 1 792 . 1 1 71 71 SER HB2 H 1 4.042 . . . . . . . A 74 SER HB2 . 25565 1 793 . 1 1 71 71 SER HB3 H 1 4.042 . . . . . . . A 74 SER HB3 . 25565 1 794 . 1 1 71 71 SER C C 13 175.130 . . . . . . . A 74 SER C . 25565 1 795 . 1 1 71 71 SER CA C 13 59.105 . . . . . . . A 74 SER CA . 25565 1 796 . 1 1 71 71 SER CB C 13 64.327 . . . . . . . A 74 SER CB . 25565 1 797 . 1 1 71 71 SER N N 15 112.785 . . . . . . . A 74 SER N . 25565 1 798 . 1 1 72 72 LEU H H 1 7.905 . . . . . . . A 75 LEU HN . 25565 1 799 . 1 1 72 72 LEU HA H 1 4.286 . . . . . . . A 75 LEU HA . 25565 1 800 . 1 1 72 72 LEU HB2 H 1 1.703 . . . . . . . A 75 LEU HB2 . 25565 1 801 . 1 1 72 72 LEU HB3 H 1 1.572 . . . . . . . A 75 LEU HB3 . 25565 1 802 . 1 1 72 72 LEU HD21 H 1 0.865 . . . . . . . A 75 LEU HD21 . 25565 1 803 . 1 1 72 72 LEU HD22 H 1 0.865 . . . . . . . A 75 LEU HD22 . 25565 1 804 . 1 1 72 72 LEU HD23 H 1 0.865 . . . . . . . A 75 LEU HD23 . 25565 1 805 . 1 1 72 72 LEU C C 13 177.464 . . . . . . . A 75 LEU C . 25565 1 806 . 1 1 72 72 LEU CA C 13 55.084 . . . . . . . A 75 LEU CA . 25565 1 807 . 1 1 72 72 LEU CB C 13 41.835 . . . . . . . A 75 LEU CB . 25565 1 808 . 1 1 72 72 LEU CD1 C 13 23.362 . . . . . . . A 75 LEU CD1 . 25565 1 809 . 1 1 72 72 LEU CD2 C 13 25.581 . . . . . . . A 75 LEU CD2 . 25565 1 810 . 1 1 72 72 LEU N N 15 122.908 . . . . . . . A 75 LEU N . 25565 1 811 . 1 1 73 73 LEU H H 1 7.917 . . . . . . . A 76 LEU HN . 25565 1 812 . 1 1 73 73 LEU HA H 1 4.094 . . . . . . . A 76 LEU HA . 25565 1 813 . 1 1 73 73 LEU HB2 H 1 1.498 . . . . . . . A 76 LEU HB2 . 25565 1 814 . 1 1 73 73 LEU HB3 H 1 1.312 . . . . . . . A 76 LEU HB3 . 25565 1 815 . 1 1 73 73 LEU C C 13 177.466 . . . . . . . A 76 LEU C . 25565 1 816 . 1 1 73 73 LEU CA C 13 56.274 . . . . . . . A 76 LEU CA . 25565 1 817 . 1 1 73 73 LEU CB C 13 41.846 . . . . . . . A 76 LEU CB . 25565 1 818 . 1 1 73 73 LEU CG C 13 27.251 . . . . . . . A 76 LEU CG . 25565 1 819 . 1 1 73 73 LEU CD1 C 13 23.789 . . . . . . . A 76 LEU CD1 . 25565 1 820 . 1 1 73 73 LEU CD2 C 13 24.975 . . . . . . . A 76 LEU CD2 . 25565 1 821 . 1 1 73 73 LEU N N 15 120.203 . . . . . . . A 76 LEU N . 25565 1 822 . 1 1 74 74 PHE H H 1 7.927 . . . . . . . A 77 PHE H . 25565 1 823 . 1 1 74 74 PHE HA H 1 4.589 . . . . . . . A 77 PHE HA . 25565 1 824 . 1 1 74 74 PHE C C 13 175.987 . . . . . . . A 77 PHE C . 25565 1 825 . 1 1 74 74 PHE CA C 13 58.176 . . . . . . . A 77 PHE CA . 25565 1 826 . 1 1 74 74 PHE CB C 13 39.264 . . . . . . . A 77 PHE CB . 25565 1 827 . 1 1 74 74 PHE N N 15 117.954 . . . . . . . A 77 PHE N . 25565 1 828 . 1 1 78 78 LYS HA H 1 4.248 . . . . . . . A 81 LYS HA . 25565 1 829 . 1 1 78 78 LYS HB2 H 1 1.819 . . . . . . . A 81 LYS HB2 . 25565 1 830 . 1 1 78 78 LYS HB3 H 1 1.759 . . . . . . . A 81 LYS HB3 . 25565 1 831 . 1 1 78 78 LYS HG2 H 1 1.411 . . . . . . . A 81 LYS HG2 . 25565 1 832 . 1 1 78 78 LYS HG3 H 1 1.411 . . . . . . . A 81 LYS HG3 . 25565 1 833 . 1 1 78 78 LYS HD2 H 1 1.622 . . . . . . . A 81 LYS HD2 . 25565 1 834 . 1 1 78 78 LYS HD3 H 1 1.622 . . . . . . . A 81 LYS HD3 . 25565 1 835 . 1 1 78 78 LYS HE2 H 1 2.950 . . . . . . . A 81 LYS HE2 . 25565 1 836 . 1 1 78 78 LYS HE3 H 1 2.950 . . . . . . . A 81 LYS HE3 . 25565 1 837 . 1 1 78 78 LYS C C 13 177.648 . . . . . . . A 81 LYS C . 25565 1 838 . 1 1 78 78 LYS CA C 13 57.623 . . . . . . . A 81 LYS CA . 25565 1 839 . 1 1 78 78 LYS CB C 13 32.249 . . . . . . . A 81 LYS CB . 25565 1 840 . 1 1 78 78 LYS CG C 13 24.805 . . . . . . . A 81 LYS CG . 25565 1 841 . 1 1 78 78 LYS CD C 13 29.210 . . . . . . . A 81 LYS CD . 25565 1 842 . 1 1 78 78 LYS CE C 13 42.412 . . . . . . . A 81 LYS CE . 25565 1 843 . 1 1 79 79 ASP H H 1 8.133 . . . . . . . A 82 ASP H . 25565 1 844 . 1 1 79 79 ASP HA H 1 4.504 . . . . . . . A 82 ASP HA . 25565 1 845 . 1 1 79 79 ASP HB2 H 1 2.811 . . . . . . . A 82 ASP HB2 . 25565 1 846 . 1 1 79 79 ASP HB3 H 1 2.625 . . . . . . . A 82 ASP HB3 . 25565 1 847 . 1 1 79 79 ASP C C 13 177.397 . . . . . . . A 82 ASP C . 25565 1 848 . 1 1 79 79 ASP CA C 13 56.453 . . . . . . . A 82 ASP CA . 25565 1 849 . 1 1 79 79 ASP CB C 13 41.007 . . . . . . . A 82 ASP CB . 25565 1 850 . 1 1 79 79 ASP N N 15 119.206 . . . . . . . A 82 ASP N . 25565 1 851 . 1 1 80 80 LEU H H 1 7.895 . . . . . . . A 83 LEU HN . 25565 1 852 . 1 1 80 80 LEU HA H 1 4.600 . . . . . . . A 83 LEU HA . 25565 1 853 . 1 1 80 80 LEU HB2 H 1 1.842 . . . . . . . A 83 LEU HB2 . 25565 1 854 . 1 1 80 80 LEU HB3 H 1 1.600 . . . . . . . A 83 LEU HB3 . 25565 1 855 . 1 1 80 80 LEU HG H 1 1.482 . . . . . . . A 83 LEU HG . 25565 1 856 . 1 1 80 80 LEU HD11 H 1 0.431 . . . . . . . A 83 LEU HD11 . 25565 1 857 . 1 1 80 80 LEU HD12 H 1 0.431 . . . . . . . A 83 LEU HD12 . 25565 1 858 . 1 1 80 80 LEU HD13 H 1 0.431 . . . . . . . A 83 LEU HD13 . 25565 1 859 . 1 1 80 80 LEU HD21 H 1 0.502 . . . . . . . A 83 LEU HD21 . 25565 1 860 . 1 1 80 80 LEU HD22 H 1 0.502 . . . . . . . A 83 LEU HD22 . 25565 1 861 . 1 1 80 80 LEU HD23 H 1 0.502 . . . . . . . A 83 LEU HD23 . 25565 1 862 . 1 1 80 80 LEU C C 13 177.692 . . . . . . . A 83 LEU C . 25565 1 863 . 1 1 80 80 LEU CA C 13 55.264 . . . . . . . A 83 LEU CA . 25565 1 864 . 1 1 80 80 LEU CB C 13 42.146 . . . . . . . A 83 LEU CB . 25565 1 865 . 1 1 80 80 LEU CG C 13 27.079 . . . . . . . A 83 LEU CG . 25565 1 866 . 1 1 80 80 LEU CD1 C 13 24.927 . . . . . . . A 83 LEU CD1 . 25565 1 867 . 1 1 80 80 LEU CD2 C 13 23.289 . . . . . . . A 83 LEU CD2 . 25565 1 868 . 1 1 80 80 LEU N N 15 118.961 . . . . . . . A 83 LEU N . 25565 1 869 . 1 1 81 81 GLU H H 1 7.708 . . . . . . . A 84 GLU H . 25565 1 870 . 1 1 81 81 GLU HA H 1 4.154 . . . . . . . A 84 GLU HA . 25565 1 871 . 1 1 81 81 GLU HB2 H 1 2.073 . . . . . . . A 84 GLU HB2 . 25565 1 872 . 1 1 81 81 GLU HB3 H 1 2.073 . . . . . . . A 84 GLU HB3 . 25565 1 873 . 1 1 81 81 GLU HG2 H 1 2.336 . . . . . . . A 84 GLU HG2 . 25565 1 874 . 1 1 81 81 GLU HG3 H 1 2.382 . . . . . . . A 84 GLU HG3 . 25565 1 875 . 1 1 81 81 GLU C C 13 176.761 . . . . . . . A 84 GLU C . 25565 1 876 . 1 1 81 81 GLU CA C 13 58.784 . . . . . . . A 84 GLU CA . 25565 1 877 . 1 1 81 81 GLU CB C 13 29.624 . . . . . . . A 84 GLU CB . 25565 1 878 . 1 1 81 81 GLU CG C 13 36.811 . . . . . . . A 84 GLU CG . 25565 1 879 . 1 1 81 81 GLU N N 15 118.747 . . . . . . . A 84 GLU N . 25565 1 880 . 1 1 82 82 ALA H H 1 7.767 . . . . . . . A 85 ALA H . 25565 1 881 . 1 1 82 82 ALA HA H 1 4.047 . . . . . . . A 85 ALA HA . 25565 1 882 . 1 1 82 82 ALA HB1 H 1 0.863 . . . . . . . A 85 ALA HB1 . 25565 1 883 . 1 1 82 82 ALA HB2 H 1 0.863 . . . . . . . A 85 ALA HB2 . 25565 1 884 . 1 1 82 82 ALA HB3 H 1 0.863 . . . . . . . A 85 ALA HB3 . 25565 1 885 . 1 1 82 82 ALA C C 13 176.738 . . . . . . . A 85 ALA C . 25565 1 886 . 1 1 82 82 ALA CA C 13 52.758 . . . . . . . A 85 ALA CA . 25565 1 887 . 1 1 82 82 ALA CB C 13 18.778 . . . . . . . A 85 ALA CB . 25565 1 888 . 1 1 82 82 ALA N N 15 119.231 . . . . . . . A 85 ALA N . 25565 1 889 . 1 1 83 83 PHE H H 1 7.780 . . . . . . . A 86 PHE H . 25565 1 890 . 1 1 83 83 PHE HA H 1 4.842 . . . . . . . A 86 PHE HA . 25565 1 891 . 1 1 83 83 PHE HB2 H 1 3.238 . . . . . . . A 86 PHE HB2 . 25565 1 892 . 1 1 83 83 PHE HB3 H 1 3.004 . . . . . . . A 86 PHE HB3 . 25565 1 893 . 1 1 83 83 PHE HD1 H 1 6.851 . . . . . . . A 86 PHE HD1 . 25565 1 894 . 1 1 83 83 PHE HD2 H 1 6.851 . . . . . . . A 86 PHE HD2 . 25565 1 895 . 1 1 83 83 PHE HE1 H 1 7.139 . . . . . . . A 86 PHE HE1 . 25565 1 896 . 1 1 83 83 PHE HE2 H 1 7.139 . . . . . . . A 86 PHE HE2 . 25565 1 897 . 1 1 83 83 PHE C C 13 173.692 . . . . . . . A 86 PHE C . 25565 1 898 . 1 1 83 83 PHE CA C 13 56.948 . . . . . . . A 86 PHE CA . 25565 1 899 . 1 1 83 83 PHE CB C 13 41.968 . . . . . . . A 86 PHE CB . 25565 1 900 . 1 1 83 83 PHE N N 15 117.171 . . . . . . . A 86 PHE N . 25565 1 901 . 1 1 84 84 ASN H H 1 9.367 . . . . . . . A 87 ASN HN . 25565 1 902 . 1 1 84 84 ASN HA H 1 5.067 . . . . . . . A 87 ASN HA . 25565 1 903 . 1 1 84 84 ASN HB2 H 1 2.801 . . . . . . . A 87 ASN HB2 . 25565 1 904 . 1 1 84 84 ASN HB3 H 1 2.735 . . . . . . . A 87 ASN HB3 . 25565 1 905 . 1 1 84 84 ASN C C 13 174.604 . . . . . . . A 87 ASN C . 25565 1 906 . 1 1 84 84 ASN CA C 13 49.202 . . . . . . . A 87 ASN CA . 25565 1 907 . 1 1 84 84 ASN CB C 13 40.638 . . . . . . . A 87 ASN CB . 25565 1 908 . 1 1 84 84 ASN N N 15 120.894 . . . . . . . A 87 ASN N . 25565 1 909 . 1 1 85 85 PRO HA H 1 3.719 . . . . . . . A 88 PRO HA . 25565 1 910 . 1 1 85 85 PRO HB2 H 1 1.619 . . . . . . . A 88 PRO HB2 . 25565 1 911 . 1 1 85 85 PRO HB3 H 1 1.191 . . . . . . . A 88 PRO HB3 . 25565 1 912 . 1 1 85 85 PRO HG2 H 1 1.302 . . . . . . . A 88 PRO HG2 . 25565 1 913 . 1 1 85 85 PRO HG3 H 1 1.302 . . . . . . . A 88 PRO HG3 . 25565 1 914 . 1 1 85 85 PRO HD2 H 1 3.177 . . . . . . . A 88 PRO HD2 . 25565 1 915 . 1 1 85 85 PRO HD3 H 1 3.177 . . . . . . . A 88 PRO HD3 . 25565 1 916 . 1 1 85 85 PRO C C 13 176.994 . . . . . . . A 88 PRO C . 25565 1 917 . 1 1 85 85 PRO CA C 13 63.960 . . . . . . . A 88 PRO CA . 25565 1 918 . 1 1 85 85 PRO CB C 13 31.967 . . . . . . . A 88 PRO CB . 25565 1 919 . 1 1 85 85 PRO CG C 13 26.315 . . . . . . . A 88 PRO CG . 25565 1 920 . 1 1 85 85 PRO CD C 13 50.949 . . . . . . . A 88 PRO CD . 25565 1 921 . 1 1 86 86 GLU H H 1 7.762 . . . . . . . A 89 GLU H . 25565 1 922 . 1 1 86 86 GLU HA H 1 4.342 . . . . . . . A 89 GLU HA . 25565 1 923 . 1 1 86 86 GLU HB2 H 1 1.691 . . . . . . . A 89 GLU HB2 . 25565 1 924 . 1 1 86 86 GLU HB3 H 1 2.178 . . . . . . . A 89 GLU HB3 . 25565 1 925 . 1 1 86 86 GLU HG2 H 1 2.043 . . . . . . . A 89 GLU HG2 . 25565 1 926 . 1 1 86 86 GLU HG3 H 1 2.130 . . . . . . . A 89 GLU HG3 . 25565 1 927 . 1 1 86 86 GLU C C 13 176.499 . . . . . . . A 89 GLU C . 25565 1 928 . 1 1 86 86 GLU CA C 13 55.099 . . . . . . . A 89 GLU CA . 25565 1 929 . 1 1 86 86 GLU CB C 13 30.002 . . . . . . . A 89 GLU CB . 25565 1 930 . 1 1 86 86 GLU CG C 13 36.665 . . . . . . . A 89 GLU CG . 25565 1 931 . 1 1 86 86 GLU N N 15 114.931 . . . . . . . A 89 GLU N . 25565 1 932 . 1 1 87 87 SER H H 1 7.155 . . . . . . . A 90 SER H . 25565 1 933 . 1 1 87 87 SER HA H 1 4.280 . . . . . . . A 90 SER HA . 25565 1 934 . 1 1 87 87 SER CA C 13 57.683 . . . . . . . A 90 SER CA . 25565 1 935 . 1 1 87 87 SER CB C 13 64.176 . . . . . . . A 90 SER CB . 25565 1 936 . 1 1 87 87 SER N N 15 114.308 . . . . . . . A 90 SER N . 25565 1 937 . 1 1 88 88 LYS HA H 1 4.495 . . . . . . . A 91 LYS HA . 25565 1 938 . 1 1 88 88 LYS HB2 H 1 2.070 . . . . . . . A 91 LYS HB2 . 25565 1 939 . 1 1 88 88 LYS HB3 H 1 1.664 . . . . . . . A 91 LYS HB3 . 25565 1 940 . 1 1 88 88 LYS HG2 H 1 1.403 . . . . . . . A 91 LYS HG2 . 25565 1 941 . 1 1 88 88 LYS HG3 H 1 1.465 . . . . . . . A 91 LYS HG3 . 25565 1 942 . 1 1 88 88 LYS HD2 H 1 1.723 . . . . . . . A 91 LYS HD2 . 25565 1 943 . 1 1 88 88 LYS HD3 H 1 1.723 . . . . . . . A 91 LYS HD3 . 25565 1 944 . 1 1 88 88 LYS HE2 H 1 2.914 . . . . . . . A 91 LYS HE2 . 25565 1 945 . 1 1 88 88 LYS HE3 H 1 2.914 . . . . . . . A 91 LYS HE3 . 25565 1 946 . 1 1 88 88 LYS C C 13 176.657 . . . . . . . A 91 LYS C . 25565 1 947 . 1 1 88 88 LYS CA C 13 55.344 . . . . . . . A 91 LYS CA . 25565 1 948 . 1 1 88 88 LYS CB C 13 32.145 . . . . . . . A 91 LYS CB . 25565 1 949 . 1 1 88 88 LYS CG C 13 25.134 . . . . . . . A 91 LYS CG . 25565 1 950 . 1 1 88 88 LYS CD C 13 29.039 . . . . . . . A 91 LYS CD . 25565 1 951 . 1 1 88 88 LYS CE C 13 42.539 . . . . . . . A 91 LYS CE . 25565 1 952 . 1 1 89 89 GLU H H 1 8.380 . . . . . . . A 92 GLU H . 25565 1 953 . 1 1 89 89 GLU HA H 1 4.170 . . . . . . . A 92 GLU HA . 25565 1 954 . 1 1 89 89 GLU HB2 H 1 2.133 . . . . . . . A 92 GLU HB2 . 25565 1 955 . 1 1 89 89 GLU HB3 H 1 1.832 . . . . . . . A 92 GLU HB3 . 25565 1 956 . 1 1 89 89 GLU C C 13 175.581 . . . . . . . A 92 GLU C . 25565 1 957 . 1 1 89 89 GLU CA C 13 56.260 . . . . . . . A 92 GLU CA . 25565 1 958 . 1 1 89 89 GLU CB C 13 30.513 . . . . . . . A 92 GLU CB . 25565 1 959 . 1 1 89 89 GLU CG C 13 35.257 . . . . . . . A 92 GLU CG . 25565 1 960 . 1 1 89 89 GLU N N 15 120.349 . . . . . . . A 92 GLU N . 25565 1 961 . 1 1 90 90 LEU H H 1 8.588 . . . . . . . A 93 LEU HN . 25565 1 962 . 1 1 90 90 LEU HA H 1 4.587 . . . . . . . A 93 LEU HA . 25565 1 963 . 1 1 90 90 LEU HB2 H 1 1.675 . . . . . . . A 93 LEU HB2 . 25565 1 964 . 1 1 90 90 LEU HB3 H 1 1.076 . . . . . . . A 93 LEU HB3 . 25565 1 965 . 1 1 90 90 LEU HD11 H 1 0.825 . . . . . . . A 93 LEU HD11 . 25565 1 966 . 1 1 90 90 LEU HD12 H 1 0.825 . . . . . . . A 93 LEU HD12 . 25565 1 967 . 1 1 90 90 LEU HD13 H 1 0.825 . . . . . . . A 93 LEU HD13 . 25565 1 968 . 1 1 90 90 LEU HD21 H 1 0.650 . . . . . . . A 93 LEU HD21 . 25565 1 969 . 1 1 90 90 LEU HD22 H 1 0.650 . . . . . . . A 93 LEU HD22 . 25565 1 970 . 1 1 90 90 LEU HD23 H 1 0.650 . . . . . . . A 93 LEU HD23 . 25565 1 971 . 1 1 90 90 LEU C C 13 176.671 . . . . . . . A 93 LEU C . 25565 1 972 . 1 1 90 90 LEU CA C 13 54.448 . . . . . . . A 93 LEU CA . 25565 1 973 . 1 1 90 90 LEU CB C 13 42.944 . . . . . . . A 93 LEU CB . 25565 1 974 . 1 1 90 90 LEU CG C 13 27.033 . . . . . . . A 93 LEU CG . 25565 1 975 . 1 1 90 90 LEU CD1 C 13 25.153 . . . . . . . A 93 LEU CD1 . 25565 1 976 . 1 1 90 90 LEU CD2 C 13 22.282 . . . . . . . A 93 LEU CD2 . 25565 1 977 . 1 1 90 90 LEU N N 15 121.278 . . . . . . . A 93 LEU N . 25565 1 978 . 1 1 91 91 LEU H H 1 9.144 . . . . . . . A 94 LEU HN . 25565 1 979 . 1 1 91 91 LEU HA H 1 4.505 . . . . . . . A 94 LEU HA . 25565 1 980 . 1 1 91 91 LEU HB2 H 1 1.271 . . . . . . . A 94 LEU HB2 . 25565 1 981 . 1 1 91 91 LEU HB3 H 1 0.957 . . . . . . . A 94 LEU HB3 . 25565 1 982 . 1 1 91 91 LEU HG H 1 1.200 . . . . . . . A 94 LEU HG . 25565 1 983 . 1 1 91 91 LEU HD11 H 1 0.063 . . . . . . . A 94 LEU HD11 . 25565 1 984 . 1 1 91 91 LEU HD12 H 1 0.063 . . . . . . . A 94 LEU HD12 . 25565 1 985 . 1 1 91 91 LEU HD13 H 1 0.063 . . . . . . . A 94 LEU HD13 . 25565 1 986 . 1 1 91 91 LEU HD21 H 1 0.511 . . . . . . . A 94 LEU HD21 . 25565 1 987 . 1 1 91 91 LEU HD22 H 1 0.511 . . . . . . . A 94 LEU HD22 . 25565 1 988 . 1 1 91 91 LEU HD23 H 1 0.511 . . . . . . . A 94 LEU HD23 . 25565 1 989 . 1 1 91 91 LEU C C 13 175.005 . . . . . . . A 94 LEU C . 25565 1 990 . 1 1 91 91 LEU CA C 13 53.437 . . . . . . . A 94 LEU CA . 25565 1 991 . 1 1 91 91 LEU CB C 13 44.348 . . . . . . . A 94 LEU CB . 25565 1 992 . 1 1 91 91 LEU CG C 13 26.298 . . . . . . . A 94 LEU CG . 25565 1 993 . 1 1 91 91 LEU CD1 C 13 25.882 . . . . . . . A 94 LEU CD1 . 25565 1 994 . 1 1 91 91 LEU CD2 C 13 23.231 . . . . . . . A 94 LEU CD2 . 25565 1 995 . 1 1 91 91 LEU N N 15 122.675 . . . . . . . A 94 LEU N . 25565 1 996 . 1 1 92 92 ASP H H 1 7.404 . . . . . . . A 95 ASP H . 25565 1 997 . 1 1 92 92 ASP HA H 1 5.171 . . . . . . . A 95 ASP HA . 25565 1 998 . 1 1 92 92 ASP HB2 H 1 2.444 . . . . . . . A 95 ASP HB2 . 25565 1 999 . 1 1 92 92 ASP HB3 H 1 2.176 . . . . . . . A 95 ASP HB3 . 25565 1 1000 . 1 1 92 92 ASP C C 13 175.607 . . . . . . . A 95 ASP C . 25565 1 1001 . 1 1 92 92 ASP CA C 13 53.605 . . . . . . . A 95 ASP CA . 25565 1 1002 . 1 1 92 92 ASP CB C 13 43.454 . . . . . . . A 95 ASP CB . 25565 1 1003 . 1 1 92 92 ASP N N 15 119.165 . . . . . . . A 95 ASP N . 25565 1 1004 . 1 1 93 93 LEU H H 1 9.633 . . . . . . . A 96 LEU HN . 25565 1 1005 . 1 1 93 93 LEU HA H 1 5.304 . . . . . . . A 96 LEU HA . 25565 1 1006 . 1 1 93 93 LEU HB2 H 1 1.485 . . . . . . . A 96 LEU HB2 . 25565 1 1007 . 1 1 93 93 LEU HB3 H 1 1.340 . . . . . . . A 96 LEU HB3 . 25565 1 1008 . 1 1 93 93 LEU HG H 1 1.240 . . . . . . . A 96 LEU HG . 25565 1 1009 . 1 1 93 93 LEU HD11 H 1 -0.092 . . . . . . . A 96 LEU HD11 . 25565 1 1010 . 1 1 93 93 LEU HD12 H 1 -0.092 . . . . . . . A 96 LEU HD12 . 25565 1 1011 . 1 1 93 93 LEU HD13 H 1 -0.092 . . . . . . . A 96 LEU HD13 . 25565 1 1012 . 1 1 93 93 LEU HD21 H 1 0.443 . . . . . . . A 96 LEU HD21 . 25565 1 1013 . 1 1 93 93 LEU HD22 H 1 0.443 . . . . . . . A 96 LEU HD22 . 25565 1 1014 . 1 1 93 93 LEU HD23 H 1 0.443 . . . . . . . A 96 LEU HD23 . 25565 1 1015 . 1 1 93 93 LEU C C 13 175.634 . . . . . . . A 96 LEU C . 25565 1 1016 . 1 1 93 93 LEU CA C 13 53.658 . . . . . . . A 96 LEU CA . 25565 1 1017 . 1 1 93 93 LEU CB C 13 46.173 . . . . . . . A 96 LEU CB . 25565 1 1018 . 1 1 93 93 LEU CG C 13 26.730 . . . . . . . A 96 LEU CG . 25565 1 1019 . 1 1 93 93 LEU CD1 C 13 25.157 . . . . . . . A 96 LEU CD1 . 25565 1 1020 . 1 1 93 93 LEU CD2 C 13 23.467 . . . . . . . A 96 LEU CD2 . 25565 1 1021 . 1 1 93 93 LEU N N 15 125.802 . . . . . . . A 96 LEU N . 25565 1 1022 . 1 1 94 94 VAL H H 1 9.154 . . . . . . . A 97 VAL HN . 25565 1 1023 . 1 1 94 94 VAL HA H 1 5.099 . . . . . . . A 97 VAL HA . 25565 1 1024 . 1 1 94 94 VAL HB H 1 1.982 . . . . . . . A 97 VAL HB . 25565 1 1025 . 1 1 94 94 VAL HG11 H 1 0.928 . . . . . . . A 97 VAL HG11 . 25565 1 1026 . 1 1 94 94 VAL HG12 H 1 0.928 . . . . . . . A 97 VAL HG12 . 25565 1 1027 . 1 1 94 94 VAL HG13 H 1 0.928 . . . . . . . A 97 VAL HG13 . 25565 1 1028 . 1 1 94 94 VAL HG21 H 1 0.861 . . . . . . . A 97 VAL HG21 . 25565 1 1029 . 1 1 94 94 VAL HG22 H 1 0.861 . . . . . . . A 97 VAL HG22 . 25565 1 1030 . 1 1 94 94 VAL HG23 H 1 0.861 . . . . . . . A 97 VAL HG23 . 25565 1 1031 . 1 1 94 94 VAL C C 13 174.521 . . . . . . . A 97 VAL C . 25565 1 1032 . 1 1 94 94 VAL CA C 13 59.628 . . . . . . . A 97 VAL CA . 25565 1 1033 . 1 1 94 94 VAL CB C 13 35.693 . . . . . . . A 97 VAL CB . 25565 1 1034 . 1 1 94 94 VAL CG1 C 13 23.031 . . . . . . . A 97 VAL CG1 . 25565 1 1035 . 1 1 94 94 VAL CG2 C 13 21.249 . . . . . . . A 97 VAL CG2 . 25565 1 1036 . 1 1 94 94 VAL N N 15 114.628 . . . . . . . A 97 VAL N . 25565 1 1037 . 1 1 95 95 GLU H H 1 9.551 . . . . . . . A 98 GLU H . 25565 1 1038 . 1 1 95 95 GLU HA H 1 3.689 . . . . . . . A 98 GLU HA . 25565 1 1039 . 1 1 95 95 GLU HB2 H 1 1.684 . . . . . . . A 98 GLU HB2 . 25565 1 1040 . 1 1 95 95 GLU HB3 H 1 1.560 . . . . . . . A 98 GLU HB3 . 25565 1 1041 . 1 1 95 95 GLU C C 13 176.170 . . . . . . . A 98 GLU C . 25565 1 1042 . 1 1 95 95 GLU CA C 13 57.673 . . . . . . . A 98 GLU CA . 25565 1 1043 . 1 1 95 95 GLU CB C 13 29.043 . . . . . . . A 98 GLU CB . 25565 1 1044 . 1 1 95 95 GLU CG C 13 36.194 . . . . . . . A 98 GLU CG . 25565 1 1045 . 1 1 95 95 GLU N N 15 129.978 . . . . . . . A 98 GLU N . 25565 1 1046 . 1 1 96 96 PHE H H 1 8.767 . . . . . . . A 99 PHE H . 25565 1 1047 . 1 1 96 96 PHE HA H 1 4.668 . . . . . . . A 99 PHE HA . 25565 1 1048 . 1 1 96 96 PHE HB2 H 1 3.101 . . . . . . . A 99 PHE HB2 . 25565 1 1049 . 1 1 96 96 PHE HB3 H 1 2.456 . . . . . . . A 99 PHE HB3 . 25565 1 1050 . 1 1 96 96 PHE HD1 H 1 6.959 . . . . . . . A 99 PHE HD1 . 25565 1 1051 . 1 1 96 96 PHE HD2 H 1 6.959 . . . . . . . A 99 PHE HD2 . 25565 1 1052 . 1 1 96 96 PHE C C 13 174.610 . . . . . . . A 99 PHE C . 25565 1 1053 . 1 1 96 96 PHE CA C 13 55.146 . . . . . . . A 99 PHE CA . 25565 1 1054 . 1 1 96 96 PHE CB C 13 37.036 . . . . . . . A 99 PHE CB . 25565 1 1055 . 1 1 96 96 PHE N N 15 126.690 . . . . . . . A 99 PHE N . 25565 1 1056 . 1 1 97 97 THR H H 1 7.503 . . . . . . . A 100 THR HN . 25565 1 1057 . 1 1 97 97 THR HA H 1 4.401 . . . . . . . A 100 THR HA . 25565 1 1058 . 1 1 97 97 THR HB H 1 4.598 . . . . . . . A 100 THR HB . 25565 1 1059 . 1 1 97 97 THR HG21 H 1 1.070 . . . . . . . A 100 THR HG21 . 25565 1 1060 . 1 1 97 97 THR HG22 H 1 1.070 . . . . . . . A 100 THR HG22 . 25565 1 1061 . 1 1 97 97 THR HG23 H 1 1.070 . . . . . . . A 100 THR HG23 . 25565 1 1062 . 1 1 97 97 THR CA C 13 59.731 . . . . . . . A 100 THR CA . 25565 1 1063 . 1 1 97 97 THR CB C 13 72.111 . . . . . . . A 100 THR CB . 25565 1 1064 . 1 1 97 97 THR CG2 C 13 21.389 . . . . . . . A 100 THR CG2 . 25565 1 1065 . 1 1 97 97 THR N N 15 116.518 . . . . . . . A 100 THR N . 25565 1 1066 . 1 1 99 99 GLU HA H 1 3.965 . . . . . . . A 102 GLU HA . 25565 1 1067 . 1 1 99 99 GLU HB2 H 1 1.985 . . . . . . . A 102 GLU HB2 . 25565 1 1068 . 1 1 99 99 GLU HB3 H 1 1.855 . . . . . . . A 102 GLU HB3 . 25565 1 1069 . 1 1 99 99 GLU HG2 H 1 2.188 . . . . . . . A 102 GLU HG2 . 25565 1 1070 . 1 1 99 99 GLU HG3 H 1 2.188 . . . . . . . A 102 GLU HG3 . 25565 1 1071 . 1 1 99 99 GLU C C 13 178.876 . . . . . . . A 102 GLU C . 25565 1 1072 . 1 1 99 99 GLU CA C 13 60.295 . . . . . . . A 102 GLU CA . 25565 1 1073 . 1 1 99 99 GLU CB C 13 29.338 . . . . . . . A 102 GLU CB . 25565 1 1074 . 1 1 99 99 GLU CG C 13 36.710 . . . . . . . A 102 GLU CG . 25565 1 1075 . 1 1 100 100 ILE H H 1 7.375 . . . . . . . A 103 ILE HN . 25565 1 1076 . 1 1 100 100 ILE HA H 1 3.848 . . . . . . . A 103 ILE HA . 25565 1 1077 . 1 1 100 100 ILE HB H 1 2.214 . . . . . . . A 103 ILE HB . 25565 1 1078 . 1 1 100 100 ILE HG12 H 1 1.714 . . . . . . . A 103 ILE HG12 . 25565 1 1079 . 1 1 100 100 ILE HG13 H 1 1.578 . . . . . . . A 103 ILE HG13 . 25565 1 1080 . 1 1 100 100 ILE HG21 H 1 0.945 . . . . . . . A 103 ILE HG21 . 25565 1 1081 . 1 1 100 100 ILE HG22 H 1 0.945 . . . . . . . A 103 ILE HG22 . 25565 1 1082 . 1 1 100 100 ILE HG23 H 1 0.945 . . . . . . . A 103 ILE HG23 . 25565 1 1083 . 1 1 100 100 ILE HD11 H 1 0.706 . . . . . . . A 103 ILE HD11 . 25565 1 1084 . 1 1 100 100 ILE HD12 H 1 0.706 . . . . . . . A 103 ILE HD12 . 25565 1 1085 . 1 1 100 100 ILE HD13 H 1 0.706 . . . . . . . A 103 ILE HD13 . 25565 1 1086 . 1 1 100 100 ILE C C 13 177.336 . . . . . . . A 103 ILE C . 25565 1 1087 . 1 1 100 100 ILE CA C 13 61.863 . . . . . . . A 103 ILE CA . 25565 1 1088 . 1 1 100 100 ILE CB C 13 36.045 . . . . . . . A 103 ILE CB . 25565 1 1089 . 1 1 100 100 ILE CG1 C 13 28.172 . . . . . . . A 103 ILE CG1 . 25565 1 1090 . 1 1 100 100 ILE CG2 C 13 18.266 . . . . . . . A 103 ILE CG2 . 25565 1 1091 . 1 1 100 100 ILE CD1 C 13 9.700 . . . . . . . A 103 ILE CD1 . 25565 1 1092 . 1 1 100 100 ILE N N 15 120.433 . . . . . . . A 103 ILE N . 25565 1 1093 . 1 1 101 101 GLN H H 1 8.144 . . . . . . . A 104 GLN HN . 25565 1 1094 . 1 1 101 101 GLN HA H 1 3.872 . . . . . . . A 104 GLN HA . 25565 1 1095 . 1 1 101 101 GLN HB2 H 1 1.842 . . . . . . . A 104 GLN HB2 . 25565 1 1096 . 1 1 101 101 GLN HB3 H 1 2.010 . . . . . . . A 104 GLN HB3 . 25565 1 1097 . 1 1 101 101 GLN C C 13 178.954 . . . . . . . A 104 GLN C . 25565 1 1098 . 1 1 101 101 GLN CA C 13 60.012 . . . . . . . A 104 GLN CA . 25565 1 1099 . 1 1 101 101 GLN CB C 13 28.186 . . . . . . . A 104 GLN CB . 25565 1 1100 . 1 1 101 101 GLN CG C 13 34.085 . . . . . . . A 104 GLN CG . 25565 1 1101 . 1 1 101 101 GLN N N 15 120.913 . . . . . . . A 104 GLN N . 25565 1 1102 . 1 1 102 102 THR H H 1 8.148 . . . . . . . A 105 THR HN . 25565 1 1103 . 1 1 102 102 THR HA H 1 3.872 . . . . . . . A 105 THR HA . 25565 1 1104 . 1 1 102 102 THR HB H 1 4.156 . . . . . . . A 105 THR HB . 25565 1 1105 . 1 1 102 102 THR HG21 H 1 1.180 . . . . . . . A 105 THR HG21 . 25565 1 1106 . 1 1 102 102 THR HG22 H 1 1.180 . . . . . . . A 105 THR HG22 . 25565 1 1107 . 1 1 102 102 THR HG23 H 1 1.180 . . . . . . . A 105 THR HG23 . 25565 1 1108 . 1 1 102 102 THR C C 13 176.655 . . . . . . . A 105 THR C . 25565 1 1109 . 1 1 102 102 THR CA C 13 66.380 . . . . . . . A 105 THR CA . 25565 1 1110 . 1 1 102 102 THR CB C 13 68.878 . . . . . . . A 105 THR CB . 25565 1 1111 . 1 1 102 102 THR CG2 C 13 21.890 . . . . . . . A 105 THR CG2 . 25565 1 1112 . 1 1 102 102 THR N N 15 115.490 . . . . . . . A 105 THR N . 25565 1 1113 . 1 1 103 103 LEU H H 1 7.638 . . . . . . . A 106 LEU HN . 25565 1 1114 . 1 1 103 103 LEU HA H 1 4.070 . . . . . . . A 106 LEU HA . 25565 1 1115 . 1 1 103 103 LEU HB2 H 1 1.666 . . . . . . . A 106 LEU HB2 . 25565 1 1116 . 1 1 103 103 LEU HB3 H 1 1.666 . . . . . . . A 106 LEU HB3 . 25565 1 1117 . 1 1 103 103 LEU HG H 1 1.552 . . . . . . . A 106 LEU HG . 25565 1 1118 . 1 1 103 103 LEU HD11 H 1 0.480 . . . . . . . A 106 LEU HD11 . 25565 1 1119 . 1 1 103 103 LEU HD12 H 1 0.480 . . . . . . . A 106 LEU HD12 . 25565 1 1120 . 1 1 103 103 LEU HD13 H 1 0.480 . . . . . . . A 106 LEU HD13 . 25565 1 1121 . 1 1 103 103 LEU HD21 H 1 0.533 . . . . . . . A 106 LEU HD21 . 25565 1 1122 . 1 1 103 103 LEU HD22 H 1 0.533 . . . . . . . A 106 LEU HD22 . 25565 1 1123 . 1 1 103 103 LEU HD23 H 1 0.533 . . . . . . . A 106 LEU HD23 . 25565 1 1124 . 1 1 103 103 LEU C C 13 178.871 . . . . . . . A 106 LEU C . 25565 1 1125 . 1 1 103 103 LEU CA C 13 58.194 . . . . . . . A 106 LEU CA . 25565 1 1126 . 1 1 103 103 LEU CB C 13 42.384 . . . . . . . A 106 LEU CB . 25565 1 1127 . 1 1 103 103 LEU CG C 13 26.925 . . . . . . . A 106 LEU CG . 25565 1 1128 . 1 1 103 103 LEU CD1 C 13 24.376 . . . . . . . A 106 LEU CD1 . 25565 1 1129 . 1 1 103 103 LEU CD2 C 13 24.168 . . . . . . . A 106 LEU CD2 . 25565 1 1130 . 1 1 103 103 LEU N N 15 123.260 . . . . . . . A 106 LEU N . 25565 1 1131 . 1 1 104 104 LEU H H 1 8.111 . . . . . . . A 107 LEU HN . 25565 1 1132 . 1 1 104 104 LEU HA H 1 4.068 . . . . . . . A 107 LEU HA . 25565 1 1133 . 1 1 104 104 LEU HB2 H 1 1.423 . . . . . . . A 107 LEU HB2 . 25565 1 1134 . 1 1 104 104 LEU HB3 H 1 1.889 . . . . . . . A 107 LEU HB3 . 25565 1 1135 . 1 1 104 104 LEU HD11 H 1 0.774 . . . . . . . A 107 LEU HD11 . 25565 1 1136 . 1 1 104 104 LEU HD12 H 1 0.774 . . . . . . . A 107 LEU HD12 . 25565 1 1137 . 1 1 104 104 LEU HD13 H 1 0.774 . . . . . . . A 107 LEU HD13 . 25565 1 1138 . 1 1 104 104 LEU HD21 H 1 0.842 . . . . . . . A 107 LEU HD21 . 25565 1 1139 . 1 1 104 104 LEU HD22 H 1 0.842 . . . . . . . A 107 LEU HD22 . 25565 1 1140 . 1 1 104 104 LEU HD23 H 1 0.842 . . . . . . . A 107 LEU HD23 . 25565 1 1141 . 1 1 104 104 LEU C C 13 178.388 . . . . . . . A 107 LEU C . 25565 1 1142 . 1 1 104 104 LEU CA C 13 56.841 . . . . . . . A 107 LEU CA . 25565 1 1143 . 1 1 104 104 LEU CB C 13 42.135 . . . . . . . A 107 LEU CB . 25565 1 1144 . 1 1 104 104 LEU CD1 C 13 26.763 . . . . . . . A 107 LEU CD1 . 25565 1 1145 . 1 1 104 104 LEU CD2 C 13 23.168 . . . . . . . A 107 LEU CD2 . 25565 1 1146 . 1 1 104 104 LEU N N 15 116.553 . . . . . . . A 107 LEU N . 25565 1 1147 . 1 1 105 105 GLY H H 1 7.884 . . . . . . . A 108 GLY H . 25565 1 1148 . 1 1 105 105 GLY HA2 H 1 4.019 . . . . . . . A 108 GLY HA2 . 25565 1 1149 . 1 1 105 105 GLY HA3 H 1 4.019 . . . . . . . A 108 GLY HA3 . 25565 1 1150 . 1 1 105 105 GLY C C 13 174.659 . . . . . . . A 108 GLY C . 25565 1 1151 . 1 1 105 105 GLY CA C 13 46.227 . . . . . . . A 108 GLY CA . 25565 1 1152 . 1 1 105 105 GLY N N 15 106.349 . . . . . . . A 108 GLY N . 25565 1 1153 . 1 1 106 106 SER H H 1 7.880 . . . . . . . A 109 SER H . 25565 1 1154 . 1 1 106 106 SER HA H 1 4.511 . . . . . . . A 109 SER HA . 25565 1 1155 . 1 1 106 106 SER HB2 H 1 3.939 . . . . . . . A 109 SER HB2 . 25565 1 1156 . 1 1 106 106 SER HB3 H 1 3.975 . . . . . . . A 109 SER HB3 . 25565 1 1157 . 1 1 106 106 SER C C 13 172.817 . . . . . . . A 109 SER C . 25565 1 1158 . 1 1 106 106 SER CA C 13 59.069 . . . . . . . A 109 SER CA . 25565 1 1159 . 1 1 106 106 SER CB C 13 64.231 . . . . . . . A 109 SER CB . 25565 1 1160 . 1 1 106 106 SER N N 15 115.250 . . . . . . . A 109 SER N . 25565 1 1161 . 1 1 108 108 VAL HA H 1 4.057 . . . . . . . A 111 VAL HA . 25565 1 1162 . 1 1 108 108 VAL HB H 1 1.910 . . . . . . . A 111 VAL HB . 25565 1 1163 . 1 1 108 108 VAL HG11 H 1 0.677 . . . . . . . A 111 VAL HG11 . 25565 1 1164 . 1 1 108 108 VAL HG12 H 1 0.677 . . . . . . . A 111 VAL HG12 . 25565 1 1165 . 1 1 108 108 VAL HG13 H 1 0.677 . . . . . . . A 111 VAL HG13 . 25565 1 1166 . 1 1 108 108 VAL HG21 H 1 0.775 . . . . . . . A 111 VAL HG21 . 25565 1 1167 . 1 1 108 108 VAL HG22 H 1 0.775 . . . . . . . A 111 VAL HG22 . 25565 1 1168 . 1 1 108 108 VAL HG23 H 1 0.775 . . . . . . . A 111 VAL HG23 . 25565 1 1169 . 1 1 108 108 VAL C C 13 175.763 . . . . . . . A 111 VAL C . 25565 1 1170 . 1 1 108 108 VAL CA C 13 62.195 . . . . . . . A 111 VAL CA . 25565 1 1171 . 1 1 108 108 VAL CB C 13 32.862 . . . . . . . A 111 VAL CB . 25565 1 1172 . 1 1 108 108 VAL CG1 C 13 21.195 . . . . . . . A 111 VAL CG1 . 25565 1 1173 . 1 1 108 108 VAL CG2 C 13 20.669 . . . . . . . A 111 VAL CG2 . 25565 1 1174 . 1 1 109 109 GLU H H 1 8.263 . . . . . . . A 112 GLU H . 25565 1 1175 . 1 1 109 109 GLU HA H 1 4.173 . . . . . . . A 112 GLU HA . 25565 1 1176 . 1 1 109 109 GLU HB2 H 1 1.815 . . . . . . . A 112 GLU HB2 . 25565 1 1177 . 1 1 109 109 GLU HB3 H 1 1.945 . . . . . . . A 112 GLU HB3 . 25565 1 1178 . 1 1 109 109 GLU HG2 H 1 2.175 . . . . . . . A 112 GLU HG2 . 25565 1 1179 . 1 1 109 109 GLU HG3 H 1 2.215 . . . . . . . A 112 GLU HG3 . 25565 1 1180 . 1 1 109 109 GLU C C 13 175.945 . . . . . . . A 112 GLU C . 25565 1 1181 . 1 1 109 109 GLU CA C 13 56.801 . . . . . . . A 112 GLU CA . 25565 1 1182 . 1 1 109 109 GLU CB C 13 30.201 . . . . . . . A 112 GLU CB . 25565 1 1183 . 1 1 109 109 GLU CG C 13 36.560 . . . . . . . A 112 GLU CG . 25565 1 1184 . 1 1 109 109 GLU N N 15 123.245 . . . . . . . A 112 GLU N . 25565 1 1185 . 1 1 110 110 TRP H H 1 7.920 . . . . . . . A 113 TRP H . 25565 1 1186 . 1 1 110 110 TRP HA H 1 4.579 . . . . . . . A 113 TRP HA . 25565 1 1187 . 1 1 110 110 TRP HB2 H 1 3.164 . . . . . . . A 113 TRP HB2 . 25565 1 1188 . 1 1 110 110 TRP HB3 H 1 3.164 . . . . . . . A 113 TRP HB3 . 25565 1 1189 . 1 1 110 110 TRP C C 13 175.693 . . . . . . . A 113 TRP C . 25565 1 1190 . 1 1 110 110 TRP CA C 13 56.939 . . . . . . . A 113 TRP CA . 25565 1 1191 . 1 1 110 110 TRP CB C 13 29.639 . . . . . . . A 113 TRP CB . 25565 1 1192 . 1 1 110 110 TRP N N 15 121.639 . . . . . . . A 113 TRP N . 25565 1 1193 . 1 1 111 111 LEU H H 1 7.795 . . . . . . . A 114 LEU HN . 25565 1 1194 . 1 1 111 111 LEU HA H 1 4.500 . . . . . . . A 114 LEU HA . 25565 1 1195 . 1 1 111 111 LEU HB2 H 1 2.634 . . . . . . . A 114 LEU HB2 . 25565 1 1196 . 1 1 111 111 LEU HB3 H 1 2.597 . . . . . . . A 114 LEU HB3 . 25565 1 1197 . 1 1 111 111 LEU HD11 H 1 0.892 . . . . . . . A 114 LEU HD11 . 25565 1 1198 . 1 1 111 111 LEU HD12 H 1 0.892 . . . . . . . A 114 LEU HD12 . 25565 1 1199 . 1 1 111 111 LEU HD13 H 1 0.892 . . . . . . . A 114 LEU HD13 . 25565 1 1200 . 1 1 111 111 LEU HD21 H 1 0.483 . . . . . . . A 114 LEU HD21 . 25565 1 1201 . 1 1 111 111 LEU HD22 H 1 0.483 . . . . . . . A 114 LEU HD22 . 25565 1 1202 . 1 1 111 111 LEU HD23 H 1 0.483 . . . . . . . A 114 LEU HD23 . 25565 1 1203 . 1 1 111 111 LEU C C 13 176.191 . . . . . . . A 114 LEU C . 25565 1 1204 . 1 1 111 111 LEU CA C 13 54.917 . . . . . . . A 114 LEU CA . 25565 1 1205 . 1 1 111 111 LEU CB C 13 42.733 . . . . . . . A 114 LEU CB . 25565 1 1206 . 1 1 111 111 LEU CG C 13 27.024 . . . . . . . A 114 LEU CG . 25565 1 1207 . 1 1 111 111 LEU CD1 C 13 25.007 . . . . . . . A 114 LEU CD1 . 25565 1 1208 . 1 1 111 111 LEU CD2 C 13 23.827 . . . . . . . A 114 LEU CD2 . 25565 1 1209 . 1 1 111 111 LEU N N 15 123.185 . . . . . . . A 114 LEU N . 25565 1 1210 . 1 1 112 112 HIS H H 1 8.093 . . . . . . . A 115 HIS H . 25565 1 1211 . 1 1 112 112 HIS CA C 13 54.305 . . . . . . . A 115 HIS CA . 25565 1 1212 . 1 1 112 112 HIS CB C 13 30.485 . . . . . . . A 115 HIS CB . 25565 1 1213 . 1 1 112 112 HIS N N 15 121.621 . . . . . . . A 115 HIS N . 25565 1 1214 . 1 1 113 113 PRO HA H 1 4.416 . . . . . . . A 116 PRO HA . 25565 1 1215 . 1 1 113 113 PRO HB2 H 1 2.243 . . . . . . . A 116 PRO HB2 . 25565 1 1216 . 1 1 113 113 PRO HB3 H 1 1.948 . . . . . . . A 116 PRO HB3 . 25565 1 1217 . 1 1 113 113 PRO HD2 H 1 3.679 . . . . . . . A 116 PRO HD2 . 25565 1 1218 . 1 1 113 113 PRO HD3 H 1 3.458 . . . . . . . A 116 PRO HD3 . 25565 1 1219 . 1 1 113 113 PRO C C 13 176.852 . . . . . . . A 116 PRO C . 25565 1 1220 . 1 1 113 113 PRO CA C 13 63.467 . . . . . . . A 116 PRO CA . 25565 1 1221 . 1 1 113 113 PRO CB C 13 32.220 . . . . . . . A 116 PRO CB . 25565 1 1222 . 1 1 113 113 PRO CG C 13 27.626 . . . . . . . A 116 PRO CG . 25565 1 1223 . 1 1 113 113 PRO CD C 13 50.901 . . . . . . . A 116 PRO CD . 25565 1 1224 . 1 1 114 114 SER H H 1 8.453 . . . . . . . A 117 SER H . 25565 1 1225 . 1 1 114 114 SER HA H 1 4.450 . . . . . . . A 117 SER HA . 25565 1 1226 . 1 1 114 114 SER HB2 H 1 3.835 . . . . . . . A 117 SER HB2 . 25565 1 1227 . 1 1 114 114 SER HB3 H 1 3.835 . . . . . . . A 117 SER HB3 . 25565 1 1228 . 1 1 114 114 SER C C 13 173.471 . . . . . . . A 117 SER C . 25565 1 1229 . 1 1 114 114 SER CA C 13 58.427 . . . . . . . A 117 SER CA . 25565 1 1230 . 1 1 114 114 SER CB C 13 64.408 . . . . . . . A 117 SER CB . 25565 1 1231 . 1 1 114 114 SER N N 15 116.658 . . . . . . . A 117 SER N . 25565 1 1232 . 1 1 115 115 ASP H H 1 7.977 . . . . . . . A 118 ASP H . 25565 1 1233 . 1 1 115 115 ASP HA H 1 4.350 . . . . . . . A 118 ASP HA . 25565 1 1234 . 1 1 115 115 ASP HB2 H 1 2.526 . . . . . . . A 118 ASP HB2 . 25565 1 1235 . 1 1 115 115 ASP HB3 H 1 2.632 . . . . . . . A 118 ASP HB3 . 25565 1 1236 . 1 1 115 115 ASP CA C 13 56.159 . . . . . . . A 118 ASP CA . 25565 1 1237 . 1 1 115 115 ASP CB C 13 42.445 . . . . . . . A 118 ASP CB . 25565 1 1238 . 1 1 115 115 ASP N N 15 127.751 . . . . . . . A 118 ASP N . 25565 1 stop_ save_