data_25919 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25919 _Entry.Title ; LC3 FUNDC1 complex structure ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-12-14 _Entry.Accession_date 2015-12-14 _Entry.Last_release_date 2015-12-17 _Entry.Original_release_date 2015-12-17 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Bin Xia . . . . 25919 2 Yao Kuang . . . . 25919 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' . 25919 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'LC3 interacting region (LIR)' . 25919 protein/peptide . 25919 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25919 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 533 25919 '15N chemical shifts' 132 25919 '1H chemical shifts' 955 25919 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 2 . . 2017-02-21 2015-12-14 update BMRB 'update entry citation' 25919 1 . . 2016-12-08 2015-12-14 original author 'original release' 25919 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N9X 'BMRB Entry Tracking System' 25919 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25919 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27653272 _Citation.Full_citation . _Citation.Title ; Structural basis for the phosphorylation of FUNDC1 LIR as a molecular switch of mitophagy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Autophagy _Citation.Journal_name_full Autophagy _Citation.Journal_volume 12 _Citation.Journal_issue 12 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1554-8635 _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 2363 _Citation.Page_last 2373 _Citation.Year 2016 _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 Yao Kuang Y. . . . 25919 1 2 Kaili Ma K. . . . 25919 1 3 Changqian Zhou C. . . . 25919 1 4 Pengfei Ding P. . . . 25919 1 5 Yushan Zhu Y. . . . 25919 1 6 Quan Chen Q. . . . 25919 1 7 Bin Xia B. . . . 25919 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25919 _Assembly.ID 1 _Assembly.Name 'LC3 FUNDC1 complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A . yes native no no . . . 25919 1 2 entity_2 2 $entity_2 B . yes native no no . . . 25919 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 25919 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MPSEKTFKQRRTFEQRVEDV RLIREQHPTKIPVIIERYKG EKQLPVLDKTKFLVPDHVNM SELIKIIRRRLQLNANQAFF LLVNGHSMVSVSTPISEVYE SEKDEDGFLYMVYASQETFG ; _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 120 _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 14150.413 _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 . MET . 25919 1 2 . PRO . 25919 1 3 . SER . 25919 1 4 . GLU . 25919 1 5 . LYS . 25919 1 6 . THR . 25919 1 7 . PHE . 25919 1 8 . LYS . 25919 1 9 . GLN . 25919 1 10 . ARG . 25919 1 11 . ARG . 25919 1 12 . THR . 25919 1 13 . PHE . 25919 1 14 . GLU . 25919 1 15 . GLN . 25919 1 16 . ARG . 25919 1 17 . VAL . 25919 1 18 . GLU . 25919 1 19 . ASP . 25919 1 20 . VAL . 25919 1 21 . ARG . 25919 1 22 . LEU . 25919 1 23 . ILE . 25919 1 24 . ARG . 25919 1 25 . GLU . 25919 1 26 . GLN . 25919 1 27 . HIS . 25919 1 28 . PRO . 25919 1 29 . THR . 25919 1 30 . LYS . 25919 1 31 . ILE . 25919 1 32 . PRO . 25919 1 33 . VAL . 25919 1 34 . ILE . 25919 1 35 . ILE . 25919 1 36 . GLU . 25919 1 37 . ARG . 25919 1 38 . TYR . 25919 1 39 . LYS . 25919 1 40 . GLY . 25919 1 41 . GLU . 25919 1 42 . LYS . 25919 1 43 . GLN . 25919 1 44 . LEU . 25919 1 45 . PRO . 25919 1 46 . VAL . 25919 1 47 . LEU . 25919 1 48 . ASP . 25919 1 49 . LYS . 25919 1 50 . THR . 25919 1 51 . LYS . 25919 1 52 . PHE . 25919 1 53 . LEU . 25919 1 54 . VAL . 25919 1 55 . PRO . 25919 1 56 . ASP . 25919 1 57 . HIS . 25919 1 58 . VAL . 25919 1 59 . ASN . 25919 1 60 . MET . 25919 1 61 . SER . 25919 1 62 . GLU . 25919 1 63 . LEU . 25919 1 64 . ILE . 25919 1 65 . LYS . 25919 1 66 . ILE . 25919 1 67 . ILE . 25919 1 68 . ARG . 25919 1 69 . ARG . 25919 1 70 . ARG . 25919 1 71 . LEU . 25919 1 72 . GLN . 25919 1 73 . LEU . 25919 1 74 . ASN . 25919 1 75 . ALA . 25919 1 76 . ASN . 25919 1 77 . GLN . 25919 1 78 . ALA . 25919 1 79 . PHE . 25919 1 80 . PHE . 25919 1 81 . LEU . 25919 1 82 . LEU . 25919 1 83 . VAL . 25919 1 84 . ASN . 25919 1 85 . GLY . 25919 1 86 . HIS . 25919 1 87 . SER . 25919 1 88 . MET . 25919 1 89 . VAL . 25919 1 90 . SER . 25919 1 91 . VAL . 25919 1 92 . SER . 25919 1 93 . THR . 25919 1 94 . PRO . 25919 1 95 . ILE . 25919 1 96 . SER . 25919 1 97 . GLU . 25919 1 98 . VAL . 25919 1 99 . TYR . 25919 1 100 . GLU . 25919 1 101 . SER . 25919 1 102 . GLU . 25919 1 103 . LYS . 25919 1 104 . ASP . 25919 1 105 . GLU . 25919 1 106 . ASP . 25919 1 107 . GLY . 25919 1 108 . PHE . 25919 1 109 . LEU . 25919 1 110 . TYR . 25919 1 111 . MET . 25919 1 112 . VAL . 25919 1 113 . TYR . 25919 1 114 . ALA . 25919 1 115 . SER . 25919 1 116 . GLN . 25919 1 117 . GLU . 25919 1 118 . THR . 25919 1 119 . PHE . 25919 1 120 . GLY . 25919 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 . MET 1 1 25919 1 . PRO 2 2 25919 1 . SER 3 3 25919 1 . GLU 4 4 25919 1 . LYS 5 5 25919 1 . THR 6 6 25919 1 . PHE 7 7 25919 1 . LYS 8 8 25919 1 . GLN 9 9 25919 1 . ARG 10 10 25919 1 . ARG 11 11 25919 1 . THR 12 12 25919 1 . PHE 13 13 25919 1 . GLU 14 14 25919 1 . GLN 15 15 25919 1 . ARG 16 16 25919 1 . VAL 17 17 25919 1 . GLU 18 18 25919 1 . ASP 19 19 25919 1 . VAL 20 20 25919 1 . ARG 21 21 25919 1 . LEU 22 22 25919 1 . ILE 23 23 25919 1 . ARG 24 24 25919 1 . GLU 25 25 25919 1 . GLN 26 26 25919 1 . HIS 27 27 25919 1 . PRO 28 28 25919 1 . THR 29 29 25919 1 . LYS 30 30 25919 1 . ILE 31 31 25919 1 . PRO 32 32 25919 1 . VAL 33 33 25919 1 . ILE 34 34 25919 1 . ILE 35 35 25919 1 . GLU 36 36 25919 1 . ARG 37 37 25919 1 . TYR 38 38 25919 1 . LYS 39 39 25919 1 . GLY 40 40 25919 1 . GLU 41 41 25919 1 . LYS 42 42 25919 1 . GLN 43 43 25919 1 . LEU 44 44 25919 1 . PRO 45 45 25919 1 . VAL 46 46 25919 1 . LEU 47 47 25919 1 . ASP 48 48 25919 1 . LYS 49 49 25919 1 . THR 50 50 25919 1 . LYS 51 51 25919 1 . PHE 52 52 25919 1 . LEU 53 53 25919 1 . VAL 54 54 25919 1 . PRO 55 55 25919 1 . ASP 56 56 25919 1 . HIS 57 57 25919 1 . VAL 58 58 25919 1 . ASN 59 59 25919 1 . MET 60 60 25919 1 . SER 61 61 25919 1 . GLU 62 62 25919 1 . LEU 63 63 25919 1 . ILE 64 64 25919 1 . LYS 65 65 25919 1 . ILE 66 66 25919 1 . ILE 67 67 25919 1 . ARG 68 68 25919 1 . ARG 69 69 25919 1 . ARG 70 70 25919 1 . LEU 71 71 25919 1 . GLN 72 72 25919 1 . LEU 73 73 25919 1 . ASN 74 74 25919 1 . ALA 75 75 25919 1 . ASN 76 76 25919 1 . GLN 77 77 25919 1 . ALA 78 78 25919 1 . PHE 79 79 25919 1 . PHE 80 80 25919 1 . LEU 81 81 25919 1 . LEU 82 82 25919 1 . VAL 83 83 25919 1 . ASN 84 84 25919 1 . GLY 85 85 25919 1 . HIS 86 86 25919 1 . SER 87 87 25919 1 . MET 88 88 25919 1 . VAL 89 89 25919 1 . SER 90 90 25919 1 . VAL 91 91 25919 1 . SER 92 92 25919 1 . THR 93 93 25919 1 . PRO 94 94 25919 1 . ILE 95 95 25919 1 . SER 96 96 25919 1 . GLU 97 97 25919 1 . VAL 98 98 25919 1 . TYR 99 99 25919 1 . GLU 100 100 25919 1 . SER 101 101 25919 1 . GLU 102 102 25919 1 . LYS 103 103 25919 1 . ASP 104 104 25919 1 . GLU 105 105 25919 1 . ASP 106 106 25919 1 . GLY 107 107 25919 1 . PHE 108 108 25919 1 . LEU 109 109 25919 1 . TYR 110 110 25919 1 . MET 111 111 25919 1 . VAL 112 112 25919 1 . TYR 113 113 25919 1 . ALA 114 114 25919 1 . SER 115 115 25919 1 . GLN 116 116 25919 1 . GLU 117 117 25919 1 . THR 118 118 25919 1 . PHE 119 119 25919 1 . GLY 120 120 25919 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 25919 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DYESDDDSYEVLDLTEY ; _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 17 _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 2071.041 _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 10 ASP . 25919 2 2 11 TYR . 25919 2 3 12 GLU . 25919 2 4 13 SER . 25919 2 5 14 ASP . 25919 2 6 15 ASP . 25919 2 7 16 ASP . 25919 2 8 17 SER . 25919 2 9 18 TYR . 25919 2 10 19 GLU . 25919 2 11 20 VAL . 25919 2 12 21 LEU . 25919 2 13 22 ASP . 25919 2 14 23 LEU . 25919 2 15 24 THR . 25919 2 16 25 GLU . 25919 2 17 26 TYR . 25919 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ASP 1 1 25919 2 . TYR 2 2 25919 2 . GLU 3 3 25919 2 . SER 4 4 25919 2 . ASP 5 5 25919 2 . ASP 6 6 25919 2 . ASP 7 7 25919 2 . SER 8 8 25919 2 . TYR 9 9 25919 2 . GLU 10 10 25919 2 . VAL 11 11 25919 2 . LEU 12 12 25919 2 . ASP 13 13 25919 2 . LEU 14 14 25919 2 . THR 15 15 25919 2 . GLU 16 16 25919 2 . TYR 17 17 25919 2 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 25919 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25919 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25919 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 25919 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . PET30a . . . 25919 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . 25919 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25919 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.9 . . mM . . . . 25919 1 2 entity_2 'natural abundance' . . 2 $entity_2 . . 1.8 . . mM . . . . 25919 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25919 1 4 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 25919 1 5 D2O [U-2H] . . . . . . 10 . . % . . . . 25919 1 6 DSS 'natural abundance' . . . . . . 1 . . % . . . . 25919 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 25919 _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' 0.15 . M 25919 1 pH 7 . pH 25919 1 pressure 1 . atm 25919 1 temperature 298 . K 25919 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25919 _Software.ID 1 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 25919 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25919 1 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 25919 _Software.ID 2 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 25919 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25919 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Bruker_Avance_700_MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance_700_MHz _NMR_spectrometer.Entry_ID 25919 _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_Bruker_Avance_800_MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance_800_MHz _NMR_spectrometer.Entry_ID 25919 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25919 _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 Bruker_Avance_700_MHz Bruker Avance . 700 . . . 25919 1 2 Bruker_Avance_800_MHz Bruker Avance . 800 . . . 25919 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 25919 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 7 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 9 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance_800_MHz . . . . . . . . . . . . . . . . 25919 1 12 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance_800_MHz . . . . . . . . . . . . . . . . 25919 1 13 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance_800_MHz . . . . . . . . . . . . . . . . 25919 1 14 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance_700_MHz . . . . . . . . . . . . . . . . 25919 1 15 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance_800_MHz . . . . . . . . . . . . . . . . 25919 1 16 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance_800_MHz . . . . . . . . . . . . . . . . 25919 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 25919 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.25145 . . . . . 25919 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 25919 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.10133 . . . . . 25919 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 25919 _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 1 '2D 1H-15N HSQC' . . . 25919 1 2 '2D 1H-13C HSQC' . . . 25919 1 3 '3D CBCA(CO)NH' . . . 25919 1 4 '3D HNCACB' . . . 25919 1 5 '3D HN(CO)CA' . . . 25919 1 6 '3D HNCA' . . . 25919 1 7 '3D HNCO' . . . 25919 1 8 '3D HBHA(CO)NH' . . . 25919 1 9 '3D HCCH-COSY' . . . 25919 1 10 '3D HCCH-TOCSY' . . . 25919 1 12 '3D 1H-13C NOESY' . . . 25919 1 13 '3D 1H-13C NOESY aromatic' . . . 25919 1 14 '2D 1H-1H TOCSY' . . . 25919 1 15 '2D 1H-1H NOESY' . . . 25919 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.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 MET H H 1 8.337 . . 1 . . . . 1 MET H . 25919 1 2 . 1 1 1 1 MET HA H 1 4.783 . . 1 . . . . 1 MET HA . 25919 1 3 . 1 1 1 1 MET HB2 H 1 1.940 . . 2 . . . . 1 MET HB2 . 25919 1 4 . 1 1 1 1 MET HB3 H 1 2.048 . . 2 . . . . 1 MET HB3 . 25919 1 5 . 1 1 1 1 MET HG2 H 1 2.555 . . 2 . . . . 1 MET HG2 . 25919 1 6 . 1 1 1 1 MET HG3 H 1 2.636 . . 2 . . . . 1 MET HG3 . 25919 1 7 . 1 1 1 1 MET CA C 13 53.141 . . 1 . . . . 1 MET CA . 25919 1 8 . 1 1 1 1 MET CB C 13 32.499 . . 1 . . . . 1 MET CB . 25919 1 9 . 1 1 1 1 MET CG C 13 32.169 . . 1 . . . . 1 MET CG . 25919 1 10 . 1 1 1 1 MET CE C 13 17.188 . . 1 . . . . 1 MET CE . 25919 1 11 . 1 1 1 1 MET N N 15 121.523 . . 1 . . . . 1 MET N . 25919 1 12 . 1 1 2 2 PRO HA H 1 4.424 . . 1 . . . . 2 PRO HA . 25919 1 13 . 1 1 2 2 PRO HB2 H 1 1.919 . . 2 . . . . 2 PRO HB2 . 25919 1 14 . 1 1 2 2 PRO HB3 H 1 2.299 . . 2 . . . . 2 PRO HB3 . 25919 1 15 . 1 1 2 2 PRO HG2 H 1 2.000 . . 2 . . . . 2 PRO HG2 . 25919 1 16 . 1 1 2 2 PRO HG3 H 1 2.041 . . 2 . . . . 2 PRO HG3 . 25919 1 17 . 1 1 2 2 PRO HD2 H 1 3.689 . . 2 . . . . 2 PRO HD2 . 25919 1 18 . 1 1 2 2 PRO HD3 H 1 3.811 . . 2 . . . . 2 PRO HD3 . 25919 1 19 . 1 1 2 2 PRO C C 13 176.917 . . 1 . . . . 2 PRO C . 25919 1 20 . 1 1 2 2 PRO CA C 13 63.418 . . 1 . . . . 2 PRO CA . 25919 1 21 . 1 1 2 2 PRO CB C 13 32.160 . . 1 . . . . 2 PRO CB . 25919 1 22 . 1 1 2 2 PRO CG C 13 27.458 . . 1 . . . . 2 PRO CG . 25919 1 23 . 1 1 2 2 PRO CD C 13 50.650 . . 1 . . . . 2 PRO CD . 25919 1 24 . 1 1 3 3 SER H H 1 8.366 . . 1 . . . . 3 SER H . 25919 1 25 . 1 1 3 3 SER HA H 1 4.389 . . 1 . . . . 3 SER HA . 25919 1 26 . 1 1 3 3 SER HB2 H 1 3.828 . . 2 . . . . 3 SER HB2 . 25919 1 27 . 1 1 3 3 SER HB3 H 1 3.888 . . 2 . . . . 3 SER HB3 . 25919 1 28 . 1 1 3 3 SER C C 13 174.762 . . 1 . . . . 3 SER C . 25919 1 29 . 1 1 3 3 SER CA C 13 58.472 . . 1 . . . . 3 SER CA . 25919 1 30 . 1 1 3 3 SER CB C 13 63.913 . . 1 . . . . 3 SER CB . 25919 1 31 . 1 1 3 3 SER N N 15 116.273 . . 1 . . . . 3 SER N . 25919 1 32 . 1 1 4 4 GLU H H 1 8.513 . . 1 . . . . 4 GLU H . 25919 1 33 . 1 1 4 4 GLU HA H 1 4.289 . . 1 . . . . 4 GLU HA . 25919 1 34 . 1 1 4 4 GLU HB2 H 1 1.936 . . 2 . . . . 4 GLU HB2 . 25919 1 35 . 1 1 4 4 GLU HB3 H 1 2.066 . . 2 . . . . 4 GLU HB3 . 25919 1 36 . 1 1 4 4 GLU HG2 H 1 2.226 . . 2 . . . . 4 GLU HG2 . 25919 1 37 . 1 1 4 4 GLU HG3 H 1 2.272 . . 2 . . . . 4 GLU HG3 . 25919 1 38 . 1 1 4 4 GLU C C 13 176.545 . . 1 . . . . 4 GLU C . 25919 1 39 . 1 1 4 4 GLU CA C 13 56.785 . . 1 . . . . 4 GLU CA . 25919 1 40 . 1 1 4 4 GLU CB C 13 30.200 . . 1 . . . . 4 GLU CB . 25919 1 41 . 1 1 4 4 GLU CG C 13 36.361 . . 1 . . . . 4 GLU CG . 25919 1 42 . 1 1 4 4 GLU N N 15 123.959 . . 1 . . . . 4 GLU N . 25919 1 43 . 1 1 5 5 LYS H H 1 8.198 . . 1 . . . . 5 LYS H . 25919 1 44 . 1 1 5 5 LYS HA H 1 4.508 . . 1 . . . . 5 LYS HA . 25919 1 45 . 1 1 5 5 LYS HB2 H 1 1.704 . . 2 . . . . 5 LYS HB2 . 25919 1 46 . 1 1 5 5 LYS HB3 H 1 1.704 . . 2 . . . . 5 LYS HB3 . 25919 1 47 . 1 1 5 5 LYS HG2 H 1 1.317 . . 2 . . . . 5 LYS HG2 . 25919 1 48 . 1 1 5 5 LYS HG3 H 1 1.497 . . 2 . . . . 5 LYS HG3 . 25919 1 49 . 1 1 5 5 LYS HD2 H 1 1.522 . . 2 . . . . 5 LYS HD2 . 25919 1 50 . 1 1 5 5 LYS HD3 H 1 1.555 . . 2 . . . . 5 LYS HD3 . 25919 1 51 . 1 1 5 5 LYS HE2 H 1 2.899 . . 2 . . . . 5 LYS HE2 . 25919 1 52 . 1 1 5 5 LYS HE3 H 1 2.899 . . 2 . . . . 5 LYS HE3 . 25919 1 53 . 1 1 5 5 LYS C C 13 177.178 . . 1 . . . . 5 LYS C . 25919 1 54 . 1 1 5 5 LYS CA C 13 56.000 . . 1 . . . . 5 LYS CA . 25919 1 55 . 1 1 5 5 LYS CB C 13 34.758 . . 1 . . . . 5 LYS CB . 25919 1 56 . 1 1 5 5 LYS CG C 13 25.642 . . 1 . . . . 5 LYS CG . 25919 1 57 . 1 1 5 5 LYS CD C 13 29.460 . . 1 . . . . 5 LYS CD . 25919 1 58 . 1 1 5 5 LYS CE C 13 42.195 . . 1 . . . . 5 LYS CE . 25919 1 59 . 1 1 5 5 LYS N N 15 122.165 . . 1 . . . . 5 LYS N . 25919 1 60 . 1 1 6 6 THR H H 1 8.423 . . 1 . . . . 6 THR H . 25919 1 61 . 1 1 6 6 THR HA H 1 4.426 . . 1 . . . . 6 THR HA . 25919 1 62 . 1 1 6 6 THR HB H 1 5.051 . . 1 . . . . 6 THR HB . 25919 1 63 . 1 1 6 6 THR HG21 H 1 1.238 . . 1 . . . . 6 THR MG . 25919 1 64 . 1 1 6 6 THR HG22 H 1 1.238 . . 1 . . . . 6 THR MG . 25919 1 65 . 1 1 6 6 THR HG23 H 1 1.238 . . 1 . . . . 6 THR MG . 25919 1 66 . 1 1 6 6 THR C C 13 175.570 . . 1 . . . . 6 THR C . 25919 1 67 . 1 1 6 6 THR CA C 13 61.120 . . 1 . . . . 6 THR CA . 25919 1 68 . 1 1 6 6 THR CB C 13 69.871 . . 1 . . . . 6 THR CB . 25919 1 69 . 1 1 6 6 THR CG2 C 13 21.863 . . 1 . . . . 6 THR CG2 . 25919 1 70 . 1 1 6 6 THR N N 15 115.586 . . 1 . . . . 6 THR N . 25919 1 71 . 1 1 7 7 PHE H H 1 10.276 . . 1 . . . . 7 PHE H . 25919 1 72 . 1 1 7 7 PHE HA H 1 3.935 . . 1 . . . . 7 PHE HA . 25919 1 73 . 1 1 7 7 PHE HB2 H 1 2.989 . . 2 . . . . 7 PHE HB2 . 25919 1 74 . 1 1 7 7 PHE HB3 H 1 3.073 . . 2 . . . . 7 PHE HB3 . 25919 1 75 . 1 1 7 7 PHE HD1 H 1 7.206 . . 3 . . . . 7 PHE HD1 . 25919 1 76 . 1 1 7 7 PHE HD2 H 1 7.206 . . 3 . . . . 7 PHE HD2 . 25919 1 77 . 1 1 7 7 PHE HE1 H 1 6.863 . . 3 . . . . 7 PHE HE1 . 25919 1 78 . 1 1 7 7 PHE HE2 H 1 6.863 . . 3 . . . . 7 PHE HE2 . 25919 1 79 . 1 1 7 7 PHE CA C 13 63.687 . . 1 . . . . 7 PHE CA . 25919 1 80 . 1 1 7 7 PHE CB C 13 39.656 . . 1 . . . . 7 PHE CB . 25919 1 81 . 1 1 7 7 PHE CD1 C 13 131.908 . . 3 . . . . 7 PHE CD1 . 25919 1 82 . 1 1 7 7 PHE CD2 C 13 131.908 . . 3 . . . . 7 PHE CD2 . 25919 1 83 . 1 1 7 7 PHE CE1 C 13 131.720 . . 3 . . . . 7 PHE CE1 . 25919 1 84 . 1 1 7 7 PHE CE2 C 13 131.720 . . 3 . . . . 7 PHE CE2 . 25919 1 85 . 1 1 7 7 PHE N N 15 126.100 . . 1 . . . . 7 PHE N . 25919 1 86 . 1 1 8 8 LYS H H 1 8.707 . . 1 . . . . 8 LYS H . 25919 1 87 . 1 1 8 8 LYS HA H 1 3.800 . . 1 . . . . 8 LYS HA . 25919 1 88 . 1 1 8 8 LYS HB2 H 1 1.669 . . 2 . . . . 8 LYS HB2 . 25919 1 89 . 1 1 8 8 LYS HB3 H 1 1.693 . . 2 . . . . 8 LYS HB3 . 25919 1 90 . 1 1 8 8 LYS HG2 H 1 1.304 . . 2 . . . . 8 LYS HG2 . 25919 1 91 . 1 1 8 8 LYS HG3 H 1 1.700 . . 2 . . . . 8 LYS HG3 . 25919 1 92 . 1 1 8 8 LYS HD2 H 1 1.370 . . 2 . . . . 8 LYS HD2 . 25919 1 93 . 1 1 8 8 LYS HD3 H 1 1.470 . . 2 . . . . 8 LYS HD3 . 25919 1 94 . 1 1 8 8 LYS HE2 H 1 2.176 . . 2 . . . . 8 LYS HE2 . 25919 1 95 . 1 1 8 8 LYS HE3 H 1 2.696 . . 2 . . . . 8 LYS HE3 . 25919 1 96 . 1 1 8 8 LYS CA C 13 59.944 . . 1 . . . . 8 LYS CA . 25919 1 97 . 1 1 8 8 LYS CB C 13 33.852 . . 1 . . . . 8 LYS CB . 25919 1 98 . 1 1 8 8 LYS CG C 13 26.785 . . 1 . . . . 8 LYS CG . 25919 1 99 . 1 1 8 8 LYS CD C 13 30.830 . . 1 . . . . 8 LYS CD . 25919 1 100 . 1 1 8 8 LYS CE C 13 41.740 . . 1 . . . . 8 LYS CE . 25919 1 101 . 1 1 8 8 LYS N N 15 115.026 . . 1 . . . . 8 LYS N . 25919 1 102 . 1 1 9 9 GLN H H 1 7.343 . . 1 . . . . 9 GLN H . 25919 1 103 . 1 1 9 9 GLN HA H 1 4.178 . . 1 . . . . 9 GLN HA . 25919 1 104 . 1 1 9 9 GLN HB2 H 1 1.988 . . 2 . . . . 9 GLN HB2 . 25919 1 105 . 1 1 9 9 GLN HB3 H 1 2.257 . . 2 . . . . 9 GLN HB3 . 25919 1 106 . 1 1 9 9 GLN HG2 H 1 2.331 . . 2 . . . . 9 GLN HG2 . 25919 1 107 . 1 1 9 9 GLN HG3 H 1 2.331 . . 2 . . . . 9 GLN HG3 . 25919 1 108 . 1 1 9 9 GLN HE21 H 1 7.535 . . 2 . . . . 9 GLN HE21 . 25919 1 109 . 1 1 9 9 GLN HE22 H 1 6.907 . . 2 . . . . 9 GLN HE22 . 25919 1 110 . 1 1 9 9 GLN C C 13 173.193 . . 1 . . . . 9 GLN C . 25919 1 111 . 1 1 9 9 GLN CA C 13 56.741 . . 1 . . . . 9 GLN CA . 25919 1 112 . 1 1 9 9 GLN CB C 13 30.065 . . 1 . . . . 9 GLN CB . 25919 1 113 . 1 1 9 9 GLN CG C 13 34.593 . . 1 . . . . 9 GLN CG . 25919 1 114 . 1 1 9 9 GLN CD C 13 180.206 . . 1 . . . . 9 GLN CD . 25919 1 115 . 1 1 9 9 GLN N N 15 113.774 . . 1 . . . . 9 GLN N . 25919 1 116 . 1 1 9 9 GLN NE2 N 15 112.123 . . 1 . . . . 9 GLN NE2 . 25919 1 117 . 1 1 10 10 ARG H H 1 7.912 . . 1 . . . . 10 ARG H . 25919 1 118 . 1 1 10 10 ARG HA H 1 4.248 . . 1 . . . . 10 ARG HA . 25919 1 119 . 1 1 10 10 ARG HB2 H 1 1.606 . . 2 . . . . 10 ARG HB2 . 25919 1 120 . 1 1 10 10 ARG HB3 H 1 1.844 . . 2 . . . . 10 ARG HB3 . 25919 1 121 . 1 1 10 10 ARG HG2 H 1 1.413 . . 2 . . . . 10 ARG HG2 . 25919 1 122 . 1 1 10 10 ARG HG3 H 1 1.708 . . 2 . . . . 10 ARG HG3 . 25919 1 123 . 1 1 10 10 ARG HD2 H 1 3.139 . . 2 . . . . 10 ARG HD2 . 25919 1 124 . 1 1 10 10 ARG HD3 H 1 3.139 . . 2 . . . . 10 ARG HD3 . 25919 1 125 . 1 1 10 10 ARG CA C 13 57.555 . . 1 . . . . 10 ARG CA . 25919 1 126 . 1 1 10 10 ARG CB C 13 31.771 . . 1 . . . . 10 ARG CB . 25919 1 127 . 1 1 10 10 ARG CG C 13 27.985 . . 1 . . . . 10 ARG CG . 25919 1 128 . 1 1 10 10 ARG CD C 13 43.386 . . 1 . . . . 10 ARG CD . 25919 1 129 . 1 1 10 10 ARG N N 15 119.156 . . 1 . . . . 10 ARG N . 25919 1 130 . 1 1 11 11 ARG H H 1 7.341 . . 1 . . . . 11 ARG H . 25919 1 131 . 1 1 11 11 ARG HA H 1 4.685 . . 1 . . . . 11 ARG HA . 25919 1 132 . 1 1 11 11 ARG HB2 H 1 0.910 . . 2 . . . . 11 ARG HB2 . 25919 1 133 . 1 1 11 11 ARG HB3 H 1 1.360 . . 2 . . . . 11 ARG HB3 . 25919 1 134 . 1 1 11 11 ARG HG2 H 1 1.156 . . 2 . . . . 11 ARG HG2 . 25919 1 135 . 1 1 11 11 ARG HG3 H 1 1.264 . . 2 . . . . 11 ARG HG3 . 25919 1 136 . 1 1 11 11 ARG HD2 H 1 2.921 . . 2 . . . . 11 ARG HD2 . 25919 1 137 . 1 1 11 11 ARG HD3 H 1 2.921 . . 2 . . . . 11 ARG HD3 . 25919 1 138 . 1 1 11 11 ARG HE H 1 7.758 . . 1 . . . . 11 ARG HE . 25919 1 139 . 1 1 11 11 ARG CA C 13 53.161 . . 1 . . . . 11 ARG CA . 25919 1 140 . 1 1 11 11 ARG CB C 13 32.773 . . 1 . . . . 11 ARG CB . 25919 1 141 . 1 1 11 11 ARG CG C 13 26.292 . . 1 . . . . 11 ARG CG . 25919 1 142 . 1 1 11 11 ARG CD C 13 43.032 . . 1 . . . . 11 ARG CD . 25919 1 143 . 1 1 11 11 ARG N N 15 120.777 . . 1 . . . . 11 ARG N . 25919 1 144 . 1 1 11 11 ARG NE N 15 85.37 . . 1 . . . . 11 ARG NE . 25919 1 145 . 1 1 12 12 THR H H 1 8.855 . . 1 . . . . 12 THR H . 25919 1 146 . 1 1 12 12 THR HA H 1 4.358 . . 1 . . . . 12 THR HA . 25919 1 147 . 1 1 12 12 THR HB H 1 4.776 . . 1 . . . . 12 THR HB . 25919 1 148 . 1 1 12 12 THR HG21 H 1 1.345 . . 1 . . . . 12 THR MG . 25919 1 149 . 1 1 12 12 THR HG22 H 1 1.345 . . 1 . . . . 12 THR MG . 25919 1 150 . 1 1 12 12 THR HG23 H 1 1.345 . . 1 . . . . 12 THR MG . 25919 1 151 . 1 1 12 12 THR C C 13 175.056 . . 1 . . . . 12 THR C . 25919 1 152 . 1 1 12 12 THR CA C 13 61.795 . . 1 . . . . 12 THR CA . 25919 1 153 . 1 1 12 12 THR CB C 13 71.050 . . 1 . . . . 12 THR CB . 25919 1 154 . 1 1 12 12 THR CG2 C 13 22.095 . . 1 . . . . 12 THR CG2 . 25919 1 155 . 1 1 12 12 THR N N 15 116.696 . . 1 . . . . 12 THR N . 25919 1 156 . 1 1 13 13 PHE H H 1 9.221 . . 1 . . . . 13 PHE H . 25919 1 157 . 1 1 13 13 PHE HA H 1 4.043 . . 1 . . . . 13 PHE HA . 25919 1 158 . 1 1 13 13 PHE HB2 H 1 2.998 . . 2 . . . . 13 PHE HB2 . 25919 1 159 . 1 1 13 13 PHE HB3 H 1 3.356 . . 2 . . . . 13 PHE HB3 . 25919 1 160 . 1 1 13 13 PHE HD1 H 1 7.313 . . 3 . . . . 13 PHE HD1 . 25919 1 161 . 1 1 13 13 PHE HD2 H 1 7.313 . . 3 . . . . 13 PHE HD2 . 25919 1 162 . 1 1 13 13 PHE HE1 H 1 7.185 . . 3 . . . . 13 PHE HE1 . 25919 1 163 . 1 1 13 13 PHE HE2 H 1 7.185 . . 3 . . . . 13 PHE HE2 . 25919 1 164 . 1 1 13 13 PHE C C 13 176.234 . . 1 . . . . 13 PHE C . 25919 1 165 . 1 1 13 13 PHE CA C 13 62.947 . . 1 . . . . 13 PHE CA . 25919 1 166 . 1 1 13 13 PHE CB C 13 39.571 . . 1 . . . . 13 PHE CB . 25919 1 167 . 1 1 13 13 PHE CD1 C 13 132.080 . . 3 . . . . 13 PHE CD1 . 25919 1 168 . 1 1 13 13 PHE CD2 C 13 132.080 . . 3 . . . . 13 PHE CD2 . 25919 1 169 . 1 1 13 13 PHE CE1 C 13 130.033 . . 3 . . . . 13 PHE CE1 . 25919 1 170 . 1 1 13 13 PHE CE2 C 13 130.033 . . 3 . . . . 13 PHE CE2 . 25919 1 171 . 1 1 13 13 PHE N N 15 123.894 . . 1 . . . . 13 PHE N . 25919 1 172 . 1 1 14 14 GLU H H 1 9.002 . . 1 . . . . 14 GLU H . 25919 1 173 . 1 1 14 14 GLU HA H 1 3.812 . . 1 . . . . 14 GLU HA . 25919 1 174 . 1 1 14 14 GLU HB2 H 1 1.975 . . 2 . . . . 14 GLU HB2 . 25919 1 175 . 1 1 14 14 GLU HB3 H 1 2.084 . . 2 . . . . 14 GLU HB3 . 25919 1 176 . 1 1 14 14 GLU HG2 H 1 2.406 . . 2 . . . . 14 GLU HG2 . 25919 1 177 . 1 1 14 14 GLU HG3 H 1 2.546 . . 2 . . . . 14 GLU HG3 . 25919 1 178 . 1 1 14 14 GLU CA C 13 60.699 . . 1 . . . . 14 GLU CA . 25919 1 179 . 1 1 14 14 GLU CB C 13 28.943 . . 1 . . . . 14 GLU CB . 25919 1 180 . 1 1 14 14 GLU CG C 13 37.516 . . 1 . . . . 14 GLU CG . 25919 1 181 . 1 1 14 14 GLU N N 15 116.516 . . 1 . . . . 14 GLU N . 25919 1 182 . 1 1 15 15 GLN H H 1 7.706 . . 1 . . . . 15 GLN H . 25919 1 183 . 1 1 15 15 GLN HA H 1 4.024 . . 1 . . . . 15 GLN HA . 25919 1 184 . 1 1 15 15 GLN HB2 H 1 1.861 . . 2 . . . . 15 GLN HB2 . 25919 1 185 . 1 1 15 15 GLN HB3 H 1 2.405 . . 2 . . . . 15 GLN HB3 . 25919 1 186 . 1 1 15 15 GLN HG2 H 1 2.352 . . 2 . . . . 15 GLN HG2 . 25919 1 187 . 1 1 15 15 GLN HG3 H 1 2.501 . . 2 . . . . 15 GLN HG3 . 25919 1 188 . 1 1 15 15 GLN HE21 H 1 7.535 . . 2 . . . . 15 GLN HE21 . 25919 1 189 . 1 1 15 15 GLN HE22 H 1 6.824 . . 2 . . . . 15 GLN HE22 . 25919 1 190 . 1 1 15 15 GLN C C 13 175.263 . . 1 . . . . 15 GLN C . 25919 1 191 . 1 1 15 15 GLN CA C 13 58.800 . . 1 . . . . 15 GLN CA . 25919 1 192 . 1 1 15 15 GLN CB C 13 29.300 . . 1 . . . . 15 GLN CB . 25919 1 193 . 1 1 15 15 GLN CG C 13 34.900 . . 1 . . . . 15 GLN CG . 25919 1 194 . 1 1 15 15 GLN N N 15 119.291 . . 1 . . . . 15 GLN N . 25919 1 195 . 1 1 15 15 GLN NE2 N 15 112.277 . . 1 . . . . 15 GLN NE2 . 25919 1 196 . 1 1 16 16 ARG H H 1 8.567 . . 1 . . . . 16 ARG H . 25919 1 197 . 1 1 16 16 ARG HA H 1 4.235 . . 1 . . . . 16 ARG HA . 25919 1 198 . 1 1 16 16 ARG HB2 H 1 1.756 . . 2 . . . . 16 ARG HB2 . 25919 1 199 . 1 1 16 16 ARG HB3 H 1 2.308 . . 2 . . . . 16 ARG HB3 . 25919 1 200 . 1 1 16 16 ARG HG2 H 1 1.644 . . 2 . . . . 16 ARG HG2 . 25919 1 201 . 1 1 16 16 ARG HG3 H 1 1.644 . . 2 . . . . 16 ARG HG3 . 25919 1 202 . 1 1 16 16 ARG HD2 H 1 3.061 . . 2 . . . . 16 ARG HD2 . 25919 1 203 . 1 1 16 16 ARG HD3 H 1 3.295 . . 2 . . . . 16 ARG HD3 . 25919 1 204 . 1 1 16 16 ARG HE H 1 7.285 . . 1 . . . . 16 ARG HE . 25919 1 205 . 1 1 16 16 ARG CA C 13 61.660 . . 1 . . . . 16 ARG CA . 25919 1 206 . 1 1 16 16 ARG CB C 13 30.877 . . 1 . . . . 16 ARG CB . 25919 1 207 . 1 1 16 16 ARG CG C 13 27.271 . . 1 . . . . 16 ARG CG . 25919 1 208 . 1 1 16 16 ARG CD C 13 42.454 . . 1 . . . . 16 ARG CD . 25919 1 209 . 1 1 16 16 ARG N N 15 122.883 . . 1 . . . . 16 ARG N . 25919 1 210 . 1 1 16 16 ARG NE N 15 84.15 . . 1 . . . . 16 ARG NE . 25919 1 211 . 1 1 17 17 VAL H H 1 8.430 . . 1 . . . . 17 VAL H . 25919 1 212 . 1 1 17 17 VAL HA H 1 3.865 . . 1 . . . . 17 VAL HA . 25919 1 213 . 1 1 17 17 VAL HB H 1 1.715 . . 1 . . . . 17 VAL HB . 25919 1 214 . 1 1 17 17 VAL HG21 H 1 0.500 . . 2 . . . . 17 VAL MG2 . 25919 1 215 . 1 1 17 17 VAL HG22 H 1 0.500 . . 2 . . . . 17 VAL MG2 . 25919 1 216 . 1 1 17 17 VAL HG23 H 1 0.500 . . 2 . . . . 17 VAL MG2 . 25919 1 217 . 1 1 17 17 VAL C C 13 174.213 . . 1 . . . . 17 VAL C . 25919 1 218 . 1 1 17 17 VAL CA C 13 65.550 . . 1 . . . . 17 VAL CA . 25919 1 219 . 1 1 17 17 VAL CB C 13 32.171 . . 1 . . . . 17 VAL CB . 25919 1 220 . 1 1 17 17 VAL CG1 C 13 21.028 . . 2 . . . . 17 VAL CG1 . 25919 1 221 . 1 1 17 17 VAL CG2 C 13 23.026 . . 2 . . . . 17 VAL CG2 . 25919 1 222 . 1 1 17 17 VAL N N 15 118.523 . . 1 . . . . 17 VAL N . 25919 1 223 . 1 1 18 18 GLU H H 1 7.423 . . 1 . . . . 18 GLU H . 25919 1 224 . 1 1 18 18 GLU HA H 1 4.212 . . 1 . . . . 18 GLU HA . 25919 1 225 . 1 1 18 18 GLU HB2 H 1 2.029 . . 2 . . . . 18 GLU HB2 . 25919 1 226 . 1 1 18 18 GLU HB3 H 1 2.029 . . 2 . . . . 18 GLU HB3 . 25919 1 227 . 1 1 18 18 GLU HG2 H 1 2.342 . . 2 . . . . 18 GLU HG2 . 25919 1 228 . 1 1 18 18 GLU HG3 H 1 2.342 . . 2 . . . . 18 GLU HG3 . 25919 1 229 . 1 1 18 18 GLU C C 13 175.758 . . 1 . . . . 18 GLU C . 25919 1 230 . 1 1 18 18 GLU CA C 13 58.488 . . 1 . . . . 18 GLU CA . 25919 1 231 . 1 1 18 18 GLU CB C 13 29.360 . . 1 . . . . 18 GLU CB . 25919 1 232 . 1 1 18 18 GLU CG C 13 35.316 . . 1 . . . . 18 GLU CG . 25919 1 233 . 1 1 18 18 GLU N N 15 120.170 . . 1 . . . . 18 GLU N . 25919 1 234 . 1 1 19 19 ASP H H 1 7.955 . . 1 . . . . 19 ASP H . 25919 1 235 . 1 1 19 19 ASP HA H 1 4.384 . . 1 . . . . 19 ASP HA . 25919 1 236 . 1 1 19 19 ASP HB2 H 1 3.253 . . 2 . . . . 19 ASP HB2 . 25919 1 237 . 1 1 19 19 ASP HB3 H 1 3.253 . . 2 . . . . 19 ASP HB3 . 25919 1 238 . 1 1 19 19 ASP C C 13 177.016 . . 1 . . . . 19 ASP C . 25919 1 239 . 1 1 19 19 ASP CA C 13 56.900 . . 1 . . . . 19 ASP CA . 25919 1 240 . 1 1 19 19 ASP CB C 13 41.884 . . 1 . . . . 19 ASP CB . 25919 1 241 . 1 1 19 19 ASP N N 15 121.273 . . 1 . . . . 19 ASP N . 25919 1 242 . 1 1 20 20 VAL H H 1 7.818 . . 1 . . . . 20 VAL H . 25919 1 243 . 1 1 20 20 VAL HA H 1 3.232 . . 1 . . . . 20 VAL HA . 25919 1 244 . 1 1 20 20 VAL HB H 1 1.781 . . 1 . . . . 20 VAL HB . 25919 1 245 . 1 1 20 20 VAL HG21 H 1 0.684 . . 2 . . . . 20 VAL MG2 . 25919 1 246 . 1 1 20 20 VAL HG22 H 1 0.684 . . 2 . . . . 20 VAL MG2 . 25919 1 247 . 1 1 20 20 VAL HG23 H 1 0.684 . . 2 . . . . 20 VAL MG2 . 25919 1 248 . 1 1 20 20 VAL C C 13 173.876 . . 1 . . . . 20 VAL C . 25919 1 249 . 1 1 20 20 VAL CA C 13 66.128 . . 1 . . . . 20 VAL CA . 25919 1 250 . 1 1 20 20 VAL CB C 13 31.099 . . 1 . . . . 20 VAL CB . 25919 1 251 . 1 1 20 20 VAL CG1 C 13 21.705 . . 2 . . . . 20 VAL CG1 . 25919 1 252 . 1 1 20 20 VAL CG2 C 13 21.705 . . 2 . . . . 20 VAL CG2 . 25919 1 253 . 1 1 20 20 VAL N N 15 119.523 . . 1 . . . . 20 VAL N . 25919 1 254 . 1 1 21 21 ARG H H 1 8.037 . . 1 . . . . 21 ARG H . 25919 1 255 . 1 1 21 21 ARG HA H 1 3.803 . . 1 . . . . 21 ARG HA . 25919 1 256 . 1 1 21 21 ARG HB2 H 1 1.862 . . 2 . . . . 21 ARG HB2 . 25919 1 257 . 1 1 21 21 ARG HB3 H 1 1.958 . . 2 . . . . 21 ARG HB3 . 25919 1 258 . 1 1 21 21 ARG HG2 H 1 1.496 . . 2 . . . . 21 ARG HG2 . 25919 1 259 . 1 1 21 21 ARG HG3 H 1 1.689 . . 2 . . . . 21 ARG HG3 . 25919 1 260 . 1 1 21 21 ARG HD2 H 1 3.063 . . 2 . . . . 21 ARG HD2 . 25919 1 261 . 1 1 21 21 ARG HD3 H 1 3.257 . . 2 . . . . 21 ARG HD3 . 25919 1 262 . 1 1 21 21 ARG HE H 1 7.837 . . 1 . . . . 21 ARG HE . 25919 1 263 . 1 1 21 21 ARG CA C 13 59.934 . . 1 . . . . 21 ARG CA . 25919 1 264 . 1 1 21 21 ARG CB C 13 30.076 . . 1 . . . . 21 ARG CB . 25919 1 265 . 1 1 21 21 ARG CG C 13 27.235 . . 1 . . . . 21 ARG CG . 25919 1 266 . 1 1 21 21 ARG CD C 13 43.202 . . 1 . . . . 21 ARG CD . 25919 1 267 . 1 1 21 21 ARG N N 15 120.310 . . 1 . . . . 21 ARG N . 25919 1 268 . 1 1 21 21 ARG NE N 15 84.15 . . 1 . . . . 21 ARG NE . 25919 1 269 . 1 1 22 22 LEU H H 1 8.050 . . 1 . . . . 22 LEU H . 25919 1 270 . 1 1 22 22 LEU HA H 1 4.094 . . 1 . . . . 22 LEU HA . 25919 1 271 . 1 1 22 22 LEU HB2 H 1 1.610 . . 2 . . . . 22 LEU HB2 . 25919 1 272 . 1 1 22 22 LEU HB3 H 1 1.901 . . 2 . . . . 22 LEU HB3 . 25919 1 273 . 1 1 22 22 LEU HG H 1 1.725 . . 1 . . . . 22 LEU HG . 25919 1 274 . 1 1 22 22 LEU HD11 H 1 0.953 . . 2 . . . . 22 LEU MD1 . 25919 1 275 . 1 1 22 22 LEU HD12 H 1 0.953 . . 2 . . . . 22 LEU MD1 . 25919 1 276 . 1 1 22 22 LEU HD13 H 1 0.953 . . 2 . . . . 22 LEU MD1 . 25919 1 277 . 1 1 22 22 LEU HD21 H 1 0.890 . . 2 . . . . 22 LEU MD2 . 25919 1 278 . 1 1 22 22 LEU HD22 H 1 0.890 . . 2 . . . . 22 LEU MD2 . 25919 1 279 . 1 1 22 22 LEU HD23 H 1 0.890 . . 2 . . . . 22 LEU MD2 . 25919 1 280 . 1 1 22 22 LEU C C 13 177.626 . . 1 . . . . 22 LEU C . 25919 1 281 . 1 1 22 22 LEU CA C 13 57.738 . . 1 . . . . 22 LEU CA . 25919 1 282 . 1 1 22 22 LEU CB C 13 42.222 . . 1 . . . . 22 LEU CB . 25919 1 283 . 1 1 22 22 LEU CG C 13 27.038 . . 1 . . . . 22 LEU CG . 25919 1 284 . 1 1 22 22 LEU CD1 C 13 25.068 . . 2 . . . . 22 LEU CD1 . 25919 1 285 . 1 1 22 22 LEU CD2 C 13 23.729 . . 2 . . . . 22 LEU CD2 . 25919 1 286 . 1 1 22 22 LEU N N 15 118.660 . . 1 . . . . 22 LEU N . 25919 1 287 . 1 1 23 23 ILE H H 1 8.390 . . 1 . . . . 23 ILE H . 25919 1 288 . 1 1 23 23 ILE HA H 1 4.122 . . 1 . . . . 23 ILE HA . 25919 1 289 . 1 1 23 23 ILE HB H 1 1.727 . . 1 . . . . 23 ILE HB . 25919 1 290 . 1 1 23 23 ILE HG12 H 1 0.216 . . 2 . . . . 23 ILE HG12 . 25919 1 291 . 1 1 23 23 ILE HG13 H 1 1.094 . . 2 . . . . 23 ILE HG13 . 25919 1 292 . 1 1 23 23 ILE HG21 H 1 0.897 . . 1 . . . . 23 ILE MG . 25919 1 293 . 1 1 23 23 ILE HG22 H 1 0.897 . . 1 . . . . 23 ILE MG . 25919 1 294 . 1 1 23 23 ILE HG23 H 1 0.897 . . 1 . . . . 23 ILE MG . 25919 1 295 . 1 1 23 23 ILE HD11 H 1 0.734 . . 1 . . . . 23 ILE MD . 25919 1 296 . 1 1 23 23 ILE HD12 H 1 0.734 . . 1 . . . . 23 ILE MD . 25919 1 297 . 1 1 23 23 ILE HD13 H 1 0.734 . . 1 . . . . 23 ILE MD . 25919 1 298 . 1 1 23 23 ILE C C 13 176.226 . . 1 . . . . 23 ILE C . 25919 1 299 . 1 1 23 23 ILE CA C 13 61.243 . . 1 . . . . 23 ILE CA . 25919 1 300 . 1 1 23 23 ILE CB C 13 38.268 . . 1 . . . . 23 ILE CB . 25919 1 301 . 1 1 23 23 ILE CG1 C 13 30.232 . . 1 . . . . 23 ILE CG1 . 25919 1 302 . 1 1 23 23 ILE CG2 C 13 19.253 . . 1 . . . . 23 ILE CG2 . 25919 1 303 . 1 1 23 23 ILE CD1 C 13 14.290 . . 1 . . . . 23 ILE CD1 . 25919 1 304 . 1 1 23 23 ILE N N 15 122.825 . . 1 . . . . 23 ILE N . 25919 1 305 . 1 1 24 24 ARG H H 1 8.540 . . 1 . . . . 24 ARG H . 25919 1 306 . 1 1 24 24 ARG HA H 1 4.017 . . 1 . . . . 24 ARG HA . 25919 1 307 . 1 1 24 24 ARG HB2 H 1 1.795 . . 2 . . . . 24 ARG HB2 . 25919 1 308 . 1 1 24 24 ARG HB3 H 1 1.959 . . 2 . . . . 24 ARG HB3 . 25919 1 309 . 1 1 24 24 ARG HG2 H 1 1.647 . . 2 . . . . 24 ARG HG2 . 25919 1 310 . 1 1 24 24 ARG HG3 H 1 1.822 . . 2 . . . . 24 ARG HG3 . 25919 1 311 . 1 1 24 24 ARG HD2 H 1 3.062 . . 2 . . . . 24 ARG HD2 . 25919 1 312 . 1 1 24 24 ARG HD3 H 1 3.293 . . 2 . . . . 24 ARG HD3 . 25919 1 313 . 1 1 24 24 ARG CA C 13 57.684 . . 1 . . . . 24 ARG CA . 25919 1 314 . 1 1 24 24 ARG CB C 13 28.817 . . 1 . . . . 24 ARG CB . 25919 1 315 . 1 1 24 24 ARG CG C 13 27.228 . . 1 . . . . 24 ARG CG . 25919 1 316 . 1 1 24 24 ARG CD C 13 42.556 . . 1 . . . . 24 ARG CD . 25919 1 317 . 1 1 24 24 ARG N N 15 122.365 . . 1 . . . . 24 ARG N . 25919 1 318 . 1 1 25 25 GLU H H 1 7.287 . . 1 . . . . 25 GLU H . 25919 1 319 . 1 1 25 25 GLU HA H 1 4.044 . . 1 . . . . 25 GLU HA . 25919 1 320 . 1 1 25 25 GLU HB2 H 1 2.140 . . 2 . . . . 25 GLU HB2 . 25919 1 321 . 1 1 25 25 GLU HB3 H 1 2.140 . . 2 . . . . 25 GLU HB3 . 25919 1 322 . 1 1 25 25 GLU HG2 H 1 2.204 . . 2 . . . . 25 GLU HG2 . 25919 1 323 . 1 1 25 25 GLU HG3 H 1 2.423 . . 2 . . . . 25 GLU HG3 . 25919 1 324 . 1 1 25 25 GLU CA C 13 58.680 . . 1 . . . . 25 GLU CA . 25919 1 325 . 1 1 25 25 GLU CB C 13 29.850 . . 1 . . . . 25 GLU CB . 25919 1 326 . 1 1 25 25 GLU CG C 13 36.360 . . 1 . . . . 25 GLU CG . 25919 1 327 . 1 1 25 25 GLU N N 15 118.383 . . 1 . . . . 25 GLU N . 25919 1 328 . 1 1 26 26 GLN H H 1 7.423 . . 1 . . . . 26 GLN H . 25919 1 329 . 1 1 26 26 GLN HA H 1 3.948 . . 1 . . . . 26 GLN HA . 25919 1 330 . 1 1 26 26 GLN HB2 H 1 1.740 . . 2 . . . . 26 GLN HB2 . 25919 1 331 . 1 1 26 26 GLN HB3 H 1 1.964 . . 2 . . . . 26 GLN HB3 . 25919 1 332 . 1 1 26 26 GLN HG2 H 1 2.134 . . 2 . . . . 26 GLN HG2 . 25919 1 333 . 1 1 26 26 GLN HG3 H 1 2.426 . . 2 . . . . 26 GLN HG3 . 25919 1 334 . 1 1 26 26 GLN HE21 H 1 7.395 . . 2 . . . . 26 GLN HE21 . 25919 1 335 . 1 1 26 26 GLN HE22 H 1 6.785 . . 2 . . . . 26 GLN HE22 . 25919 1 336 . 1 1 26 26 GLN C C 13 176.221 . . 1 . . . . 26 GLN C . 25919 1 337 . 1 1 26 26 GLN CA C 13 57.638 . . 1 . . . . 26 GLN CA . 25919 1 338 . 1 1 26 26 GLN CB C 13 30.320 . . 1 . . . . 26 GLN CB . 25919 1 339 . 1 1 26 26 GLN CG C 13 33.994 . . 1 . . . . 26 GLN CG . 25919 1 340 . 1 1 26 26 GLN N N 15 117.165 . . 1 . . . . 26 GLN N . 25919 1 341 . 1 1 26 26 GLN NE2 N 15 111.731 . . 1 . . . . 26 GLN NE2 . 25919 1 342 . 1 1 27 27 HIS H H 1 8.254 . . 1 . . . . 27 HIS H . 25919 1 343 . 1 1 27 27 HIS HA H 1 4.866 . . 1 . . . . 27 HIS HA . 25919 1 344 . 1 1 27 27 HIS HB2 H 1 2.533 . . 2 . . . . 27 HIS HB2 . 25919 1 345 . 1 1 27 27 HIS HB3 H 1 2.910 . . 2 . . . . 27 HIS HB3 . 25919 1 346 . 1 1 27 27 HIS HD2 H 1 6.617 . . 1 . . . . 27 HIS HD2 . 25919 1 347 . 1 1 27 27 HIS CA C 13 53.305 . . 1 . . . . 27 HIS CA . 25919 1 348 . 1 1 27 27 HIS CB C 13 30.917 . . 1 . . . . 27 HIS CB . 25919 1 349 . 1 1 27 27 HIS CD2 C 13 119.533 . . 1 . . . . 27 HIS CD2 . 25919 1 350 . 1 1 27 27 HIS N N 15 117.140 . . 1 . . . . 27 HIS N . 25919 1 351 . 1 1 28 28 PRO HA H 1 4.609 . . 1 . . . . 28 PRO HA . 25919 1 352 . 1 1 28 28 PRO HB2 H 1 2.018 . . 2 . . . . 28 PRO HB2 . 25919 1 353 . 1 1 28 28 PRO HB3 H 1 2.447 . . 2 . . . . 28 PRO HB3 . 25919 1 354 . 1 1 28 28 PRO HG2 H 1 1.918 . . 2 . . . . 28 PRO HG2 . 25919 1 355 . 1 1 28 28 PRO HG3 H 1 1.918 . . 2 . . . . 28 PRO HG3 . 25919 1 356 . 1 1 28 28 PRO HD2 H 1 3.252 . . 2 . . . . 28 PRO HD2 . 25919 1 357 . 1 1 28 28 PRO HD3 H 1 3.590 . . 2 . . . . 28 PRO HD3 . 25919 1 358 . 1 1 28 28 PRO CA C 13 64.881 . . 1 . . . . 28 PRO CA . 25919 1 359 . 1 1 28 28 PRO CB C 13 32.554 . . 1 . . . . 28 PRO CB . 25919 1 360 . 1 1 28 28 PRO CG C 13 27.270 . . 1 . . . . 28 PRO CG . 25919 1 361 . 1 1 28 28 PRO CD C 13 50.249 . . 1 . . . . 28 PRO CD . 25919 1 362 . 1 1 29 29 THR H H 1 7.764 . . 1 . . . . 29 THR H . 25919 1 363 . 1 1 29 29 THR HA H 1 4.644 . . 1 . . . . 29 THR HA . 25919 1 364 . 1 1 29 29 THR HB H 1 4.726 . . 1 . . . . 29 THR HB . 25919 1 365 . 1 1 29 29 THR HG21 H 1 1.168 . . 1 . . . . 29 THR MG . 25919 1 366 . 1 1 29 29 THR HG22 H 1 1.168 . . 1 . . . . 29 THR MG . 25919 1 367 . 1 1 29 29 THR HG23 H 1 1.168 . . 1 . . . . 29 THR MG . 25919 1 368 . 1 1 29 29 THR C C 13 172.933 . . 1 . . . . 29 THR C . 25919 1 369 . 1 1 29 29 THR CA C 13 60.600 . . 1 . . . . 29 THR CA . 25919 1 370 . 1 1 29 29 THR CB C 13 68.520 . . 1 . . . . 29 THR CB . 25919 1 371 . 1 1 29 29 THR CG2 C 13 21.450 . . 1 . . . . 29 THR CG2 . 25919 1 372 . 1 1 29 29 THR N N 15 107.339 . . 1 . . . . 29 THR N . 25919 1 373 . 1 1 30 30 LYS H H 1 7.478 . . 1 . . . . 30 LYS H . 25919 1 374 . 1 1 30 30 LYS HA H 1 4.926 . . 1 . . . . 30 LYS HA . 25919 1 375 . 1 1 30 30 LYS HB2 H 1 1.210 . . 2 . . . . 30 LYS HB2 . 25919 1 376 . 1 1 30 30 LYS HB3 H 1 1.539 . . 2 . . . . 30 LYS HB3 . 25919 1 377 . 1 1 30 30 LYS HG2 H 1 1.122 . . 2 . . . . 30 LYS HG2 . 25919 1 378 . 1 1 30 30 LYS HG3 H 1 1.462 . . 2 . . . . 30 LYS HG3 . 25919 1 379 . 1 1 30 30 LYS HD2 H 1 1.660 . . 2 . . . . 30 LYS HD2 . 25919 1 380 . 1 1 30 30 LYS HD3 H 1 1.660 . . 2 . . . . 30 LYS HD3 . 25919 1 381 . 1 1 30 30 LYS HE2 H 1 2.901 . . 2 . . . . 30 LYS HE2 . 25919 1 382 . 1 1 30 30 LYS HE3 H 1 2.901 . . 2 . . . . 30 LYS HE3 . 25919 1 383 . 1 1 30 30 LYS C C 13 175.010 . . 1 . . . . 30 LYS C . 25919 1 384 . 1 1 30 30 LYS CA C 13 53.740 . . 1 . . . . 30 LYS CA . 25919 1 385 . 1 1 30 30 LYS CB C 13 36.445 . . 1 . . . . 30 LYS CB . 25919 1 386 . 1 1 30 30 LYS CG C 13 25.560 . . 1 . . . . 30 LYS CG . 25919 1 387 . 1 1 30 30 LYS CD C 13 29.536 . . 1 . . . . 30 LYS CD . 25919 1 388 . 1 1 30 30 LYS CE C 13 42.021 . . 1 . . . . 30 LYS CE . 25919 1 389 . 1 1 30 30 LYS N N 15 118.273 . . 1 . . . . 30 LYS N . 25919 1 390 . 1 1 31 31 ILE H H 1 9.235 . . 1 . . . . 31 ILE H . 25919 1 391 . 1 1 31 31 ILE HA H 1 4.139 . . 1 . . . . 31 ILE HA . 25919 1 392 . 1 1 31 31 ILE HB H 1 1.767 . . 1 . . . . 31 ILE HB . 25919 1 393 . 1 1 31 31 ILE HG12 H 1 0.953 . . 2 . . . . 31 ILE HG12 . 25919 1 394 . 1 1 31 31 ILE HG13 H 1 1.318 . . 2 . . . . 31 ILE HG13 . 25919 1 395 . 1 1 31 31 ILE HG21 H 1 0.404 . . 1 . . . . 31 ILE MG . 25919 1 396 . 1 1 31 31 ILE HG22 H 1 0.404 . . 1 . . . . 31 ILE MG . 25919 1 397 . 1 1 31 31 ILE HG23 H 1 0.404 . . 1 . . . . 31 ILE MG . 25919 1 398 . 1 1 31 31 ILE HD11 H 1 0.326 . . 1 . . . . 31 ILE MD . 25919 1 399 . 1 1 31 31 ILE HD12 H 1 0.326 . . 1 . . . . 31 ILE MD . 25919 1 400 . 1 1 31 31 ILE HD13 H 1 0.326 . . 1 . . . . 31 ILE MD . 25919 1 401 . 1 1 31 31 ILE CA C 13 54.669 . . 1 . . . . 31 ILE CA . 25919 1 402 . 1 1 31 31 ILE CB C 13 38.427 . . 1 . . . . 31 ILE CB . 25919 1 403 . 1 1 31 31 ILE CG1 C 13 27.860 . . 1 . . . . 31 ILE CG1 . 25919 1 404 . 1 1 31 31 ILE CG2 C 13 16.998 . . 1 . . . . 31 ILE CG2 . 25919 1 405 . 1 1 31 31 ILE CD1 C 13 10.032 . . 1 . . . . 31 ILE CD1 . 25919 1 406 . 1 1 31 31 ILE N N 15 123.498 . . 1 . . . . 31 ILE N . 25919 1 407 . 1 1 32 32 PRO HA H 1 5.212 . . 1 . . . . 32 PRO HA . 25919 1 408 . 1 1 32 32 PRO HB2 H 1 1.761 . . 2 . . . . 32 PRO HB2 . 25919 1 409 . 1 1 32 32 PRO HB3 H 1 2.308 . . 2 . . . . 32 PRO HB3 . 25919 1 410 . 1 1 32 32 PRO HG2 H 1 1.656 . . 2 . . . . 32 PRO HG2 . 25919 1 411 . 1 1 32 32 PRO HG3 H 1 2.600 . . 2 . . . . 32 PRO HG3 . 25919 1 412 . 1 1 32 32 PRO HD2 H 1 3.304 . . 2 . . . . 32 PRO HD2 . 25919 1 413 . 1 1 32 32 PRO HD3 H 1 3.518 . . 2 . . . . 32 PRO HD3 . 25919 1 414 . 1 1 32 32 PRO C C 13 174.832 . . 1 . . . . 32 PRO C . 25919 1 415 . 1 1 32 32 PRO CA C 13 61.678 . . 1 . . . . 32 PRO CA . 25919 1 416 . 1 1 32 32 PRO CB C 13 30.993 . . 1 . . . . 32 PRO CB . 25919 1 417 . 1 1 32 32 PRO CG C 13 27.170 . . 1 . . . . 32 PRO CG . 25919 1 418 . 1 1 32 32 PRO CD C 13 50.220 . . 1 . . . . 32 PRO CD . 25919 1 419 . 1 1 33 33 VAL H H 1 9.289 . . 1 . . . . 33 VAL H . 25919 1 420 . 1 1 33 33 VAL HA H 1 5.234 . . 1 . . . . 33 VAL HA . 25919 1 421 . 1 1 33 33 VAL HB H 1 1.886 . . 1 . . . . 33 VAL HB . 25919 1 422 . 1 1 33 33 VAL HG21 H 1 0.884 . . 2 . . . . 33 VAL MG2 . 25919 1 423 . 1 1 33 33 VAL HG22 H 1 0.884 . . 2 . . . . 33 VAL MG2 . 25919 1 424 . 1 1 33 33 VAL HG23 H 1 0.884 . . 2 . . . . 33 VAL MG2 . 25919 1 425 . 1 1 33 33 VAL CA C 13 59.611 . . 1 . . . . 33 VAL CA . 25919 1 426 . 1 1 33 33 VAL CB C 13 35.711 . . 1 . . . . 33 VAL CB . 25919 1 427 . 1 1 33 33 VAL CG1 C 13 22.503 . . 2 . . . . 33 VAL CG1 . 25919 1 428 . 1 1 33 33 VAL CG2 C 13 22.740 . . 2 . . . . 33 VAL CG2 . 25919 1 429 . 1 1 33 33 VAL N N 15 124.964 . . 1 . . . . 33 VAL N . 25919 1 430 . 1 1 34 34 ILE H H 1 8.594 . . 1 . . . . 34 ILE H . 25919 1 431 . 1 1 34 34 ILE HA H 1 4.742 . . 1 . . . . 34 ILE HA . 25919 1 432 . 1 1 34 34 ILE HB H 1 1.407 . . 1 . . . . 34 ILE HB . 25919 1 433 . 1 1 34 34 ILE HG12 H 1 -0.197 . . 2 . . . . 34 ILE HG12 . 25919 1 434 . 1 1 34 34 ILE HG13 H 1 0.311 . . 2 . . . . 34 ILE HG13 . 25919 1 435 . 1 1 34 34 ILE HG21 H 1 0.503 . . 1 . . . . 34 ILE MG . 25919 1 436 . 1 1 34 34 ILE HG22 H 1 0.503 . . 1 . . . . 34 ILE MG . 25919 1 437 . 1 1 34 34 ILE HG23 H 1 0.503 . . 1 . . . . 34 ILE MG . 25919 1 438 . 1 1 34 34 ILE HD11 H 1 -1.118 . . 1 . . . . 34 ILE MD . 25919 1 439 . 1 1 34 34 ILE HD12 H 1 -1.118 . . 1 . . . . 34 ILE MD . 25919 1 440 . 1 1 34 34 ILE HD13 H 1 -1.118 . . 1 . . . . 34 ILE MD . 25919 1 441 . 1 1 34 34 ILE CA C 13 56.330 . . 1 . . . . 34 ILE CA . 25919 1 442 . 1 1 34 34 ILE CB C 13 36.629 . . 1 . . . . 34 ILE CB . 25919 1 443 . 1 1 34 34 ILE CG1 C 13 24.974 . . 1 . . . . 34 ILE CG1 . 25919 1 444 . 1 1 34 34 ILE CG2 C 13 16.717 . . 1 . . . . 34 ILE CG2 . 25919 1 445 . 1 1 34 34 ILE CD1 C 13 9.011 . . 1 . . . . 34 ILE CD1 . 25919 1 446 . 1 1 34 34 ILE N N 15 127.908 . . 1 . . . . 34 ILE N . 25919 1 447 . 1 1 35 35 ILE H H 1 8.545 . . 1 . . . . 35 ILE H . 25919 1 448 . 1 1 35 35 ILE HA H 1 4.879 . . 1 . . . . 35 ILE HA . 25919 1 449 . 1 1 35 35 ILE HB H 1 1.742 . . 1 . . . . 35 ILE HB . 25919 1 450 . 1 1 35 35 ILE HG12 H 1 0.749 . . 2 . . . . 35 ILE HG12 . 25919 1 451 . 1 1 35 35 ILE HG13 H 1 1.588 . . 2 . . . . 35 ILE HG13 . 25919 1 452 . 1 1 35 35 ILE HG21 H 1 0.774 . . 1 . . . . 35 ILE MG . 25919 1 453 . 1 1 35 35 ILE HG22 H 1 0.774 . . 1 . . . . 35 ILE MG . 25919 1 454 . 1 1 35 35 ILE HG23 H 1 0.774 . . 1 . . . . 35 ILE MG . 25919 1 455 . 1 1 35 35 ILE HD11 H 1 0.133 . . 1 . . . . 35 ILE MD . 25919 1 456 . 1 1 35 35 ILE HD12 H 1 0.133 . . 1 . . . . 35 ILE MD . 25919 1 457 . 1 1 35 35 ILE HD13 H 1 0.133 . . 1 . . . . 35 ILE MD . 25919 1 458 . 1 1 35 35 ILE C C 13 176.126 . . 1 . . . . 35 ILE C . 25919 1 459 . 1 1 35 35 ILE CA C 13 60.923 . . 1 . . . . 35 ILE CA . 25919 1 460 . 1 1 35 35 ILE CB C 13 38.968 . . 1 . . . . 35 ILE CB . 25919 1 461 . 1 1 35 35 ILE CG1 C 13 27.809 . . 1 . . . . 35 ILE CG1 . 25919 1 462 . 1 1 35 35 ILE CG2 C 13 18.006 . . 1 . . . . 35 ILE CG2 . 25919 1 463 . 1 1 35 35 ILE CD1 C 13 12.193 . . 1 . . . . 35 ILE CD1 . 25919 1 464 . 1 1 35 35 ILE N N 15 125.405 . . 1 . . . . 35 ILE N . 25919 1 465 . 1 1 36 36 GLU H H 1 8.363 . . 1 . . . . 36 GLU H . 25919 1 466 . 1 1 36 36 GLU HA H 1 4.789 . . 1 . . . . 36 GLU HA . 25919 1 467 . 1 1 36 36 GLU HB2 H 1 1.935 . . 2 . . . . 36 GLU HB2 . 25919 1 468 . 1 1 36 36 GLU HB3 H 1 2.215 . . 2 . . . . 36 GLU HB3 . 25919 1 469 . 1 1 36 36 GLU HG2 H 1 2.302 . . 2 . . . . 36 GLU HG2 . 25919 1 470 . 1 1 36 36 GLU HG3 H 1 2.302 . . 2 . . . . 36 GLU HG3 . 25919 1 471 . 1 1 36 36 GLU C C 13 173.645 . . 1 . . . . 36 GLU C . 25919 1 472 . 1 1 36 36 GLU CA C 13 54.282 . . 1 . . . . 36 GLU CA . 25919 1 473 . 1 1 36 36 GLU CB C 13 35.401 . . 1 . . . . 36 GLU CB . 25919 1 474 . 1 1 36 36 GLU CG C 13 39.320 . . 1 . . . . 36 GLU CG . 25919 1 475 . 1 1 36 36 GLU N N 15 124.153 . . 1 . . . . 36 GLU N . 25919 1 476 . 1 1 37 37 ARG H H 1 8.853 . . 1 . . . . 37 ARG H . 25919 1 477 . 1 1 37 37 ARG HA H 1 2.804 . . 1 . . . . 37 ARG HA . 25919 1 478 . 1 1 37 37 ARG HB2 H 1 1.521 . . 2 . . . . 37 ARG HB2 . 25919 1 479 . 1 1 37 37 ARG HB3 H 1 1.816 . . 2 . . . . 37 ARG HB3 . 25919 1 480 . 1 1 37 37 ARG HG2 H 1 1.133 . . 2 . . . . 37 ARG HG2 . 25919 1 481 . 1 1 37 37 ARG HG3 H 1 1.877 . . 2 . . . . 37 ARG HG3 . 25919 1 482 . 1 1 37 37 ARG HD2 H 1 2.840 . . 2 . . . . 37 ARG HD2 . 25919 1 483 . 1 1 37 37 ARG HD3 H 1 3.091 . . 2 . . . . 37 ARG HD3 . 25919 1 484 . 1 1 37 37 ARG HE H 1 7.061 . . 1 . . . . 37 ARG HE . 25919 1 485 . 1 1 37 37 ARG C C 13 176.456 . . 1 . . . . 37 ARG C . 25919 1 486 . 1 1 37 37 ARG CA C 13 56.120 . . 1 . . . . 37 ARG CA . 25919 1 487 . 1 1 37 37 ARG CB C 13 31.500 . . 1 . . . . 37 ARG CB . 25919 1 488 . 1 1 37 37 ARG CG C 13 26.483 . . 1 . . . . 37 ARG CG . 25919 1 489 . 1 1 37 37 ARG CD C 13 44.211 . . 1 . . . . 37 ARG CD . 25919 1 490 . 1 1 37 37 ARG N N 15 123.957 . . 1 . . . . 37 ARG N . 25919 1 491 . 1 1 37 37 ARG NE N 15 84.15 . . 1 . . . . 37 ARG NE . 25919 1 492 . 1 1 38 38 TYR H H 1 8.663 . . 1 . . . . 38 TYR H . 25919 1 493 . 1 1 38 38 TYR HA H 1 4.311 . . 1 . . . . 38 TYR HA . 25919 1 494 . 1 1 38 38 TYR HB2 H 1 2.762 . . 2 . . . . 38 TYR HB2 . 25919 1 495 . 1 1 38 38 TYR HB3 H 1 2.980 . . 2 . . . . 38 TYR HB3 . 25919 1 496 . 1 1 38 38 TYR HD1 H 1 6.999 . . 3 . . . . 38 TYR HD1 . 25919 1 497 . 1 1 38 38 TYR HD2 H 1 6.999 . . 3 . . . . 38 TYR HD2 . 25919 1 498 . 1 1 38 38 TYR HE1 H 1 6.628 . . 3 . . . . 38 TYR HE1 . 25919 1 499 . 1 1 38 38 TYR HE2 H 1 6.628 . . 3 . . . . 38 TYR HE2 . 25919 1 500 . 1 1 38 38 TYR CA C 13 57.907 . . 1 . . . . 38 TYR CA . 25919 1 501 . 1 1 38 38 TYR CB C 13 39.567 . . 1 . . . . 38 TYR CB . 25919 1 502 . 1 1 38 38 TYR CD1 C 13 133.220 . . 3 . . . . 38 TYR CD1 . 25919 1 503 . 1 1 38 38 TYR CD2 C 13 133.220 . . 3 . . . . 38 TYR CD2 . 25919 1 504 . 1 1 38 38 TYR CE1 C 13 118.220 . . 3 . . . . 38 TYR CE1 . 25919 1 505 . 1 1 38 38 TYR CE2 C 13 118.220 . . 3 . . . . 38 TYR CE2 . 25919 1 506 . 1 1 38 38 TYR N N 15 129.636 . . 1 . . . . 38 TYR N . 25919 1 507 . 1 1 39 39 LYS H H 1 8.389 . . 1 . . . . 39 LYS H . 25919 1 508 . 1 1 39 39 LYS HA H 1 3.848 . . 1 . . . . 39 LYS HA . 25919 1 509 . 1 1 39 39 LYS HB2 H 1 1.524 . . 2 . . . . 39 LYS HB2 . 25919 1 510 . 1 1 39 39 LYS HB3 H 1 1.640 . . 2 . . . . 39 LYS HB3 . 25919 1 511 . 1 1 39 39 LYS HG2 H 1 1.115 . . 2 . . . . 39 LYS HG2 . 25919 1 512 . 1 1 39 39 LYS HG3 H 1 1.170 . . 2 . . . . 39 LYS HG3 . 25919 1 513 . 1 1 39 39 LYS HD2 H 1 1.564 . . 2 . . . . 39 LYS HD2 . 25919 1 514 . 1 1 39 39 LYS HD3 H 1 1.564 . . 2 . . . . 39 LYS HD3 . 25919 1 515 . 1 1 39 39 LYS HE2 H 1 2.900 . . 2 . . . . 39 LYS HE2 . 25919 1 516 . 1 1 39 39 LYS HE3 H 1 2.900 . . 2 . . . . 39 LYS HE3 . 25919 1 517 . 1 1 39 39 LYS CA C 13 58.986 . . 1 . . . . 39 LYS CA . 25919 1 518 . 1 1 39 39 LYS CB C 13 31.777 . . 1 . . . . 39 LYS CB . 25919 1 519 . 1 1 39 39 LYS CG C 13 23.959 . . 1 . . . . 39 LYS CG . 25919 1 520 . 1 1 39 39 LYS CD C 13 29.180 . . 1 . . . . 39 LYS CD . 25919 1 521 . 1 1 39 39 LYS CE C 13 42.020 . . 1 . . . . 39 LYS CE . 25919 1 522 . 1 1 39 39 LYS N N 15 130.772 . . 1 . . . . 39 LYS N . 25919 1 523 . 1 1 40 40 GLY H H 1 5.643 . . 1 . . . . 40 GLY H . 25919 1 524 . 1 1 40 40 GLY HA2 H 1 3.350 . . 2 . . . . 40 GLY HA2 . 25919 1 525 . 1 1 40 40 GLY HA3 H 1 3.963 . . 2 . . . . 40 GLY HA3 . 25919 1 526 . 1 1 40 40 GLY C C 13 173.407 . . 1 . . . . 40 GLY C . 25919 1 527 . 1 1 40 40 GLY CA C 13 44.796 . . 1 . . . . 40 GLY CA . 25919 1 528 . 1 1 40 40 GLY N N 15 106.013 . . 1 . . . . 40 GLY N . 25919 1 529 . 1 1 41 41 GLU H H 1 7.464 . . 1 . . . . 41 GLU H . 25919 1 530 . 1 1 41 41 GLU HA H 1 4.265 . . 1 . . . . 41 GLU HA . 25919 1 531 . 1 1 41 41 GLU HB2 H 1 2.097 . . 2 . . . . 41 GLU HB2 . 25919 1 532 . 1 1 41 41 GLU HB3 H 1 2.471 . . 2 . . . . 41 GLU HB3 . 25919 1 533 . 1 1 41 41 GLU HG2 H 1 2.273 . . 2 . . . . 41 GLU HG2 . 25919 1 534 . 1 1 41 41 GLU HG3 H 1 2.470 . . 2 . . . . 41 GLU HG3 . 25919 1 535 . 1 1 41 41 GLU C C 13 176.231 . . 1 . . . . 41 GLU C . 25919 1 536 . 1 1 41 41 GLU CA C 13 56.365 . . 1 . . . . 41 GLU CA . 25919 1 537 . 1 1 41 41 GLU CB C 13 31.077 . . 1 . . . . 41 GLU CB . 25919 1 538 . 1 1 41 41 GLU CG C 13 37.422 . . 1 . . . . 41 GLU CG . 25919 1 539 . 1 1 41 41 GLU N N 15 123.519 . . 1 . . . . 41 GLU N . 25919 1 540 . 1 1 42 42 LYS H H 1 8.895 . . 1 . . . . 42 LYS H . 25919 1 541 . 1 1 42 42 LYS HA H 1 4.669 . . 1 . . . . 42 LYS HA . 25919 1 542 . 1 1 42 42 LYS HB2 H 1 1.712 . . 2 . . . . 42 LYS HB2 . 25919 1 543 . 1 1 42 42 LYS HB3 H 1 1.981 . . 2 . . . . 42 LYS HB3 . 25919 1 544 . 1 1 42 42 LYS HG2 H 1 1.403 . . 2 . . . . 42 LYS HG2 . 25919 1 545 . 1 1 42 42 LYS HG3 H 1 1.510 . . 2 . . . . 42 LYS HG3 . 25919 1 546 . 1 1 42 42 LYS HD2 H 1 1.634 . . 2 . . . . 42 LYS HD2 . 25919 1 547 . 1 1 42 42 LYS HD3 H 1 1.675 . . 2 . . . . 42 LYS HD3 . 25919 1 548 . 1 1 42 42 LYS HE2 H 1 2.974 . . 2 . . . . 42 LYS HE2 . 25919 1 549 . 1 1 42 42 LYS HE3 H 1 2.974 . . 2 . . . . 42 LYS HE3 . 25919 1 550 . 1 1 42 42 LYS C C 13 177.170 . . 1 . . . . 42 LYS C . 25919 1 551 . 1 1 42 42 LYS CA C 13 55.750 . . 1 . . . . 42 LYS CA . 25919 1 552 . 1 1 42 42 LYS CB C 13 34.929 . . 1 . . . . 42 LYS CB . 25919 1 553 . 1 1 42 42 LYS CG C 13 24.462 . . 1 . . . . 42 LYS CG . 25919 1 554 . 1 1 42 42 LYS CD C 13 28.642 . . 1 . . . . 42 LYS CD . 25919 1 555 . 1 1 42 42 LYS CE C 13 42.296 . . 1 . . . . 42 LYS CE . 25919 1 556 . 1 1 42 42 LYS N N 15 124.405 . . 1 . . . . 42 LYS N . 25919 1 557 . 1 1 43 43 GLN H H 1 8.459 . . 1 . . . . 43 GLN H . 25919 1 558 . 1 1 43 43 GLN HA H 1 4.541 . . 1 . . . . 43 GLN HA . 25919 1 559 . 1 1 43 43 GLN HB2 H 1 2.192 . . 2 . . . . 43 GLN HB2 . 25919 1 560 . 1 1 43 43 GLN HB3 H 1 2.291 . . 2 . . . . 43 GLN HB3 . 25919 1 561 . 1 1 43 43 GLN HG2 H 1 2.393 . . 2 . . . . 43 GLN HG2 . 25919 1 562 . 1 1 43 43 GLN HG3 H 1 2.475 . . 2 . . . . 43 GLN HG3 . 25919 1 563 . 1 1 43 43 GLN HE21 H 1 7.644 . . 2 . . . . 43 GLN HE21 . 25919 1 564 . 1 1 43 43 GLN HE22 H 1 6.855 . . 2 . . . . 43 GLN HE22 . 25919 1 565 . 1 1 43 43 GLN C C 13 177.260 . . 1 . . . . 43 GLN C . 25919 1 566 . 1 1 43 43 GLN CA C 13 57.566 . . 1 . . . . 43 GLN CA . 25919 1 567 . 1 1 43 43 GLN CB C 13 30.620 . . 1 . . . . 43 GLN CB . 25919 1 568 . 1 1 43 43 GLN CG C 13 34.210 . . 1 . . . . 43 GLN CG . 25919 1 569 . 1 1 43 43 GLN CD C 13 180.237 . . 1 . . . . 43 GLN CD . 25919 1 570 . 1 1 43 43 GLN N N 15 119.903 . . 1 . . . . 43 GLN N . 25919 1 571 . 1 1 43 43 GLN NE2 N 15 112.541 . . 1 . . . . 43 GLN NE2 . 25919 1 572 . 1 1 44 44 LEU H H 1 9.002 . . 1 . . . . 44 LEU H . 25919 1 573 . 1 1 44 44 LEU HA H 1 4.726 . . 1 . . . . 44 LEU HA . 25919 1 574 . 1 1 44 44 LEU HB2 H 1 1.688 . . 2 . . . . 44 LEU HB2 . 25919 1 575 . 1 1 44 44 LEU HB3 H 1 1.796 . . 2 . . . . 44 LEU HB3 . 25919 1 576 . 1 1 44 44 LEU HG H 1 2.038 . . 1 . . . . 44 LEU HG . 25919 1 577 . 1 1 44 44 LEU HD11 H 1 1.156 . . 2 . . . . 44 LEU MD1 . 25919 1 578 . 1 1 44 44 LEU HD12 H 1 1.156 . . 2 . . . . 44 LEU MD1 . 25919 1 579 . 1 1 44 44 LEU HD13 H 1 1.156 . . 2 . . . . 44 LEU MD1 . 25919 1 580 . 1 1 44 44 LEU HD21 H 1 1.225 . . 2 . . . . 44 LEU MD2 . 25919 1 581 . 1 1 44 44 LEU HD22 H 1 1.225 . . 2 . . . . 44 LEU MD2 . 25919 1 582 . 1 1 44 44 LEU HD23 H 1 1.225 . . 2 . . . . 44 LEU MD2 . 25919 1 583 . 1 1 44 44 LEU CA C 13 53.165 . . 1 . . . . 44 LEU CA . 25919 1 584 . 1 1 44 44 LEU CB C 13 43.444 . . 1 . . . . 44 LEU CB . 25919 1 585 . 1 1 44 44 LEU CG C 13 27.500 . . 1 . . . . 44 LEU CG . 25919 1 586 . 1 1 44 44 LEU CD1 C 13 28.382 . . 2 . . . . 44 LEU CD1 . 25919 1 587 . 1 1 44 44 LEU CD2 C 13 24.527 . . 2 . . . . 44 LEU CD2 . 25919 1 588 . 1 1 44 44 LEU N N 15 121.272 . . 1 . . . . 44 LEU N . 25919 1 589 . 1 1 45 45 PRO HA H 1 4.722 . . 1 . . . . 45 PRO HA . 25919 1 590 . 1 1 45 45 PRO HB2 H 1 2.028 . . 2 . . . . 45 PRO HB2 . 25919 1 591 . 1 1 45 45 PRO HB3 H 1 2.435 . . 2 . . . . 45 PRO HB3 . 25919 1 592 . 1 1 45 45 PRO HG2 H 1 2.066 . . 2 . . . . 45 PRO HG2 . 25919 1 593 . 1 1 45 45 PRO HG3 H 1 2.191 . . 2 . . . . 45 PRO HG3 . 25919 1 594 . 1 1 45 45 PRO HD2 H 1 3.434 . . 2 . . . . 45 PRO HD2 . 25919 1 595 . 1 1 45 45 PRO HD3 H 1 4.016 . . 2 . . . . 45 PRO HD3 . 25919 1 596 . 1 1 45 45 PRO CA C 13 62.169 . . 1 . . . . 45 PRO CA . 25919 1 597 . 1 1 45 45 PRO CB C 13 32.722 . . 1 . . . . 45 PRO CB . 25919 1 598 . 1 1 45 45 PRO CG C 13 27.197 . . 1 . . . . 45 PRO CG . 25919 1 599 . 1 1 45 45 PRO CD C 13 50.436 . . 1 . . . . 45 PRO CD . 25919 1 600 . 1 1 46 46 VAL H H 1 8.349 . . 1 . . . . 46 VAL H . 25919 1 601 . 1 1 46 46 VAL HA H 1 4.009 . . 1 . . . . 46 VAL HA . 25919 1 602 . 1 1 46 46 VAL HB H 1 2.095 . . 1 . . . . 46 VAL HB . 25919 1 603 . 1 1 46 46 VAL HG21 H 1 0.977 . . 2 . . . . 46 VAL MG2 . 25919 1 604 . 1 1 46 46 VAL HG22 H 1 0.977 . . 2 . . . . 46 VAL MG2 . 25919 1 605 . 1 1 46 46 VAL HG23 H 1 0.977 . . 2 . . . . 46 VAL MG2 . 25919 1 606 . 1 1 46 46 VAL C C 13 173.416 . . 1 . . . . 46 VAL C . 25919 1 607 . 1 1 46 46 VAL CA C 13 62.413 . . 1 . . . . 46 VAL CA . 25919 1 608 . 1 1 46 46 VAL CB C 13 33.087 . . 1 . . . . 46 VAL CB . 25919 1 609 . 1 1 46 46 VAL CG1 C 13 20.480 . . 2 . . . . 46 VAL CG1 . 25919 1 610 . 1 1 46 46 VAL CG2 C 13 21.274 . . 2 . . . . 46 VAL CG2 . 25919 1 611 . 1 1 46 46 VAL N N 15 118.403 . . 1 . . . . 46 VAL N . 25919 1 612 . 1 1 47 47 LEU H H 1 8.064 . . 1 . . . . 47 LEU H . 25919 1 613 . 1 1 47 47 LEU HA H 1 4.452 . . 1 . . . . 47 LEU HA . 25919 1 614 . 1 1 47 47 LEU HB2 H 1 1.984 . . 2 . . . . 47 LEU HB2 . 25919 1 615 . 1 1 47 47 LEU HB3 H 1 2.057 . . 2 . . . . 47 LEU HB3 . 25919 1 616 . 1 1 47 47 LEU HG H 1 2.043 . . 1 . . . . 47 LEU HG . 25919 1 617 . 1 1 47 47 LEU HD11 H 1 0.892 . . 2 . . . . 47 LEU MD1 . 25919 1 618 . 1 1 47 47 LEU HD12 H 1 0.892 . . 2 . . . . 47 LEU MD1 . 25919 1 619 . 1 1 47 47 LEU HD13 H 1 0.892 . . 2 . . . . 47 LEU MD1 . 25919 1 620 . 1 1 47 47 LEU HD21 H 1 0.892 . . 2 . . . . 47 LEU MD2 . 25919 1 621 . 1 1 47 47 LEU HD22 H 1 0.892 . . 2 . . . . 47 LEU MD2 . 25919 1 622 . 1 1 47 47 LEU HD23 H 1 0.892 . . 2 . . . . 47 LEU MD2 . 25919 1 623 . 1 1 47 47 LEU CA C 13 54.758 . . 1 . . . . 47 LEU CA . 25919 1 624 . 1 1 47 47 LEU CB C 13 44.076 . . 1 . . . . 47 LEU CB . 25919 1 625 . 1 1 47 47 LEU CG C 13 27.063 . . 1 . . . . 47 LEU CG . 25919 1 626 . 1 1 47 47 LEU CD1 C 13 25.167 . . 2 . . . . 47 LEU CD1 . 25919 1 627 . 1 1 47 47 LEU CD2 C 13 25.167 . . 2 . . . . 47 LEU CD2 . 25919 1 628 . 1 1 47 47 LEU N N 15 128.653 . . 1 . . . . 47 LEU N . 25919 1 629 . 1 1 48 48 ASP H H 1 8.649 . . 1 . . . . 48 ASP H . 25919 1 630 . 1 1 48 48 ASP HA H 1 4.347 . . 1 . . . . 48 ASP HA . 25919 1 631 . 1 1 48 48 ASP HB2 H 1 2.737 . . 2 . . . . 48 ASP HB2 . 25919 1 632 . 1 1 48 48 ASP HB3 H 1 2.802 . . 2 . . . . 48 ASP HB3 . 25919 1 633 . 1 1 48 48 ASP CA C 13 55.600 . . 1 . . . . 48 ASP CA . 25919 1 634 . 1 1 48 48 ASP CB C 13 40.407 . . 1 . . . . 48 ASP CB . 25919 1 635 . 1 1 48 48 ASP N N 15 121.042 . . 1 . . . . 48 ASP N . 25919 1 636 . 1 1 49 49 LYS H H 1 7.287 . . 1 . . . . 49 LYS H . 25919 1 637 . 1 1 49 49 LYS HA H 1 4.541 . . 1 . . . . 49 LYS HA . 25919 1 638 . 1 1 49 49 LYS HB2 H 1 1.349 . . 2 . . . . 49 LYS HB2 . 25919 1 639 . 1 1 49 49 LYS HB3 H 1 1.442 . . 2 . . . . 49 LYS HB3 . 25919 1 640 . 1 1 49 49 LYS HG2 H 1 1.224 . . 2 . . . . 49 LYS HG2 . 25919 1 641 . 1 1 49 49 LYS HG3 H 1 1.224 . . 2 . . . . 49 LYS HG3 . 25919 1 642 . 1 1 49 49 LYS HD2 H 1 1.478 . . 2 . . . . 49 LYS HD2 . 25919 1 643 . 1 1 49 49 LYS HD3 H 1 1.645 . . 2 . . . . 49 LYS HD3 . 25919 1 644 . 1 1 49 49 LYS HE2 H 1 2.831 . . 2 . . . . 49 LYS HE2 . 25919 1 645 . 1 1 49 49 LYS HE3 H 1 2.853 . . 2 . . . . 49 LYS HE3 . 25919 1 646 . 1 1 49 49 LYS C C 13 179.744 . . 1 . . . . 49 LYS C . 25919 1 647 . 1 1 49 49 LYS CA C 13 54.099 . . 1 . . . . 49 LYS CA . 25919 1 648 . 1 1 49 49 LYS CB C 13 35.378 . . 1 . . . . 49 LYS CB . 25919 1 649 . 1 1 49 49 LYS CG C 13 24.456 . . 1 . . . . 49 LYS CG . 25919 1 650 . 1 1 49 49 LYS CD C 13 28.177 . . 1 . . . . 49 LYS CD . 25919 1 651 . 1 1 49 49 LYS CE C 13 42.277 . . 1 . . . . 49 LYS CE . 25919 1 652 . 1 1 49 49 LYS N N 15 118.877 . . 1 . . . . 49 LYS N . 25919 1 653 . 1 1 50 50 THR H H 1 8.064 . . 1 . . . . 50 THR H . 25919 1 654 . 1 1 50 50 THR HA H 1 4.628 . . 1 . . . . 50 THR HA . 25919 1 655 . 1 1 50 50 THR HB H 1 3.772 . . 1 . . . . 50 THR HB . 25919 1 656 . 1 1 50 50 THR HG21 H 1 1.140 . . 1 . . . . 50 THR MG . 25919 1 657 . 1 1 50 50 THR HG22 H 1 1.140 . . 1 . . . . 50 THR MG . 25919 1 658 . 1 1 50 50 THR HG23 H 1 1.140 . . 1 . . . . 50 THR MG . 25919 1 659 . 1 1 50 50 THR CA C 13 63.920 . . 1 . . . . 50 THR CA . 25919 1 660 . 1 1 50 50 THR CB C 13 71.365 . . 1 . . . . 50 THR CB . 25919 1 661 . 1 1 50 50 THR CG2 C 13 22.902 . . 1 . . . . 50 THR CG2 . 25919 1 662 . 1 1 50 50 THR N N 15 114.691 . . 1 . . . . 50 THR N . 25919 1 663 . 1 1 51 51 LYS H H 1 7.192 . . 1 . . . . 51 LYS H . 25919 1 664 . 1 1 51 51 LYS HA H 1 4.570 . . 1 . . . . 51 LYS HA . 25919 1 665 . 1 1 51 51 LYS HB2 H 1 1.029 . . 2 . . . . 51 LYS HB2 . 25919 1 666 . 1 1 51 51 LYS HB3 H 1 1.143 . . 2 . . . . 51 LYS HB3 . 25919 1 667 . 1 1 51 51 LYS HG2 H 1 0.448 . . 2 . . . . 51 LYS HG2 . 25919 1 668 . 1 1 51 51 LYS HG3 H 1 0.927 . . 2 . . . . 51 LYS HG3 . 25919 1 669 . 1 1 51 51 LYS HD2 H 1 1.182 . . 2 . . . . 51 LYS HD2 . 25919 1 670 . 1 1 51 51 LYS HD3 H 1 1.361 . . 2 . . . . 51 LYS HD3 . 25919 1 671 . 1 1 51 51 LYS HE2 H 1 1.886 . . 2 . . . . 51 LYS HE2 . 25919 1 672 . 1 1 51 51 LYS HE3 H 1 1.970 . . 2 . . . . 51 LYS HE3 . 25919 1 673 . 1 1 51 51 LYS CA C 13 54.997 . . 1 . . . . 51 LYS CA . 25919 1 674 . 1 1 51 51 LYS CB C 13 32.700 . . 1 . . . . 51 LYS CB . 25919 1 675 . 1 1 51 51 LYS CG C 13 23.780 . . 1 . . . . 51 LYS CG . 25919 1 676 . 1 1 51 51 LYS CD C 13 29.601 . . 1 . . . . 51 LYS CD . 25919 1 677 . 1 1 51 51 LYS CE C 13 40.951 . . 1 . . . . 51 LYS CE . 25919 1 678 . 1 1 51 51 LYS N N 15 120.273 . . 1 . . . . 51 LYS N . 25919 1 679 . 1 1 52 52 PHE H H 1 9.466 . . 1 . . . . 52 PHE H . 25919 1 680 . 1 1 52 52 PHE HA H 1 5.503 . . 1 . . . . 52 PHE HA . 25919 1 681 . 1 1 52 52 PHE HB2 H 1 2.656 . . 2 . . . . 52 PHE HB2 . 25919 1 682 . 1 1 52 52 PHE HB3 H 1 2.749 . . 2 . . . . 52 PHE HB3 . 25919 1 683 . 1 1 52 52 PHE HD1 H 1 7.024 . . 3 . . . . 52 PHE HD1 . 25919 1 684 . 1 1 52 52 PHE HD2 H 1 7.024 . . 3 . . . . 52 PHE HD2 . 25919 1 685 . 1 1 52 52 PHE HE1 H 1 6.918 . . 3 . . . . 52 PHE HE1 . 25919 1 686 . 1 1 52 52 PHE HE2 H 1 6.918 . . 3 . . . . 52 PHE HE2 . 25919 1 687 . 1 1 52 52 PHE HZ H 1 7.203 . . 1 . . . . 52 PHE HZ . 25919 1 688 . 1 1 52 52 PHE CA C 13 56.104 . . 1 . . . . 52 PHE CA . 25919 1 689 . 1 1 52 52 PHE CB C 13 43.188 . . 1 . . . . 52 PHE CB . 25919 1 690 . 1 1 52 52 PHE CD1 C 13 132.470 . . 3 . . . . 52 PHE CD1 . 25919 1 691 . 1 1 52 52 PHE CD2 C 13 132.470 . . 3 . . . . 52 PHE CD2 . 25919 1 692 . 1 1 52 52 PHE CE1 C 13 132.095 . . 3 . . . . 52 PHE CE1 . 25919 1 693 . 1 1 52 52 PHE CE2 C 13 132.095 . . 3 . . . . 52 PHE CE2 . 25919 1 694 . 1 1 52 52 PHE CZ C 13 131.345 . . 1 . . . . 52 PHE CZ . 25919 1 695 . 1 1 52 52 PHE N N 15 121.816 . . 1 . . . . 52 PHE N . 25919 1 696 . 1 1 53 53 LEU H H 1 8.608 . . 1 . . . . 53 LEU H . 25919 1 697 . 1 1 53 53 LEU HA H 1 5.135 . . 1 . . . . 53 LEU HA . 25919 1 698 . 1 1 53 53 LEU HB2 H 1 0.868 . . 2 . . . . 53 LEU HB2 . 25919 1 699 . 1 1 53 53 LEU HB3 H 1 1.345 . . 2 . . . . 53 LEU HB3 . 25919 1 700 . 1 1 53 53 LEU HG H 1 1.154 . . 1 . . . . 53 LEU HG . 25919 1 701 . 1 1 53 53 LEU HD11 H 1 -0.123 . . 2 . . . . 53 LEU MD1 . 25919 1 702 . 1 1 53 53 LEU HD12 H 1 -0.123 . . 2 . . . . 53 LEU MD1 . 25919 1 703 . 1 1 53 53 LEU HD13 H 1 -0.123 . . 2 . . . . 53 LEU MD1 . 25919 1 704 . 1 1 53 53 LEU HD21 H 1 0.283 . . 2 . . . . 53 LEU MD2 . 25919 1 705 . 1 1 53 53 LEU HD22 H 1 0.283 . . 2 . . . . 53 LEU MD2 . 25919 1 706 . 1 1 53 53 LEU HD23 H 1 0.283 . . 2 . . . . 53 LEU MD2 . 25919 1 707 . 1 1 53 53 LEU C C 13 175.042 . . 1 . . . . 53 LEU C . 25919 1 708 . 1 1 53 53 LEU CA C 13 52.916 . . 1 . . . . 53 LEU CA . 25919 1 709 . 1 1 53 53 LEU CB C 13 45.242 . . 1 . . . . 53 LEU CB . 25919 1 710 . 1 1 53 53 LEU CG C 13 26.278 . . 1 . . . . 53 LEU CG . 25919 1 711 . 1 1 53 53 LEU CD1 C 13 24.542 . . 2 . . . . 53 LEU CD1 . 25919 1 712 . 1 1 53 53 LEU CD2 C 13 22.865 . . 2 . . . . 53 LEU CD2 . 25919 1 713 . 1 1 53 53 LEU N N 15 120.846 . . 1 . . . . 53 LEU N . 25919 1 714 . 1 1 54 54 VAL H H 1 8.801 . . 1 . . . . 54 VAL H . 25919 1 715 . 1 1 54 54 VAL HA H 1 4.755 . . 1 . . . . 54 VAL HA . 25919 1 716 . 1 1 54 54 VAL HB H 1 1.918 . . 1 . . . . 54 VAL HB . 25919 1 717 . 1 1 54 54 VAL HG21 H 1 0.845 . . 2 . . . . 54 VAL MG2 . 25919 1 718 . 1 1 54 54 VAL HG22 H 1 0.845 . . 2 . . . . 54 VAL MG2 . 25919 1 719 . 1 1 54 54 VAL HG23 H 1 0.845 . . 2 . . . . 54 VAL MG2 . 25919 1 720 . 1 1 54 54 VAL CA C 13 58.622 . . 1 . . . . 54 VAL CA . 25919 1 721 . 1 1 54 54 VAL CB C 13 35.150 . . 1 . . . . 54 VAL CB . 25919 1 722 . 1 1 54 54 VAL CG1 C 13 21.430 . . 2 . . . . 54 VAL CG1 . 25919 1 723 . 1 1 54 54 VAL CG2 C 13 21.845 . . 2 . . . . 54 VAL CG2 . 25919 1 724 . 1 1 54 54 VAL N N 15 123.773 . . 1 . . . . 54 VAL N . 25919 1 725 . 1 1 55 55 PRO HA H 1 4.435 . . 1 . . . . 55 PRO HA . 25919 1 726 . 1 1 55 55 PRO HB2 H 1 1.649 . . 2 . . . . 55 PRO HB2 . 25919 1 727 . 1 1 55 55 PRO HB3 H 1 2.592 . . 2 . . . . 55 PRO HB3 . 25919 1 728 . 1 1 55 55 PRO HG2 H 1 2.125 . . 2 . . . . 55 PRO HG2 . 25919 1 729 . 1 1 55 55 PRO HG3 H 1 2.164 . . 2 . . . . 55 PRO HG3 . 25919 1 730 . 1 1 55 55 PRO HD2 H 1 3.497 . . 2 . . . . 55 PRO HD2 . 25919 1 731 . 1 1 55 55 PRO HD3 H 1 4.070 . . 2 . . . . 55 PRO HD3 . 25919 1 732 . 1 1 55 55 PRO C C 13 176.427 . . 1 . . . . 55 PRO C . 25919 1 733 . 1 1 55 55 PRO CA C 13 64.298 . . 1 . . . . 55 PRO CA . 25919 1 734 . 1 1 55 55 PRO CB C 13 32.822 . . 1 . . . . 55 PRO CB . 25919 1 735 . 1 1 55 55 PRO CG C 13 28.218 . . 1 . . . . 55 PRO CG . 25919 1 736 . 1 1 55 55 PRO CD C 13 51.693 . . 1 . . . . 55 PRO CD . 25919 1 737 . 1 1 56 56 ASP H H 1 8.336 . . 1 . . . . 56 ASP H . 25919 1 738 . 1 1 56 56 ASP HA H 1 3.880 . . 1 . . . . 56 ASP HA . 25919 1 739 . 1 1 56 56 ASP HB2 H 1 2.406 . . 2 . . . . 56 ASP HB2 . 25919 1 740 . 1 1 56 56 ASP HB3 H 1 2.747 . . 2 . . . . 56 ASP HB3 . 25919 1 741 . 1 1 56 56 ASP CA C 13 56.742 . . 1 . . . . 56 ASP CA . 25919 1 742 . 1 1 56 56 ASP CB C 13 40.481 . . 1 . . . . 56 ASP CB . 25919 1 743 . 1 1 56 56 ASP N N 15 121.214 . . 1 . . . . 56 ASP N . 25919 1 744 . 1 1 57 57 HIS H H 1 7.464 . . 1 . . . . 57 HIS H . 25919 1 745 . 1 1 57 57 HIS HA H 1 4.772 . . 1 . . . . 57 HIS HA . 25919 1 746 . 1 1 57 57 HIS HB2 H 1 3.063 . . 2 . . . . 57 HIS HB2 . 25919 1 747 . 1 1 57 57 HIS HB3 H 1 3.390 . . 2 . . . . 57 HIS HB3 . 25919 1 748 . 1 1 57 57 HIS HD2 H 1 7.094 . . 1 . . . . 57 HIS HD2 . 25919 1 749 . 1 1 57 57 HIS C C 13 174.806 . . 1 . . . . 57 HIS C . 25919 1 750 . 1 1 57 57 HIS CA C 13 55.688 . . 1 . . . . 57 HIS CA . 25919 1 751 . 1 1 57 57 HIS CB C 13 30.450 . . 1 . . . . 57 HIS CB . 25919 1 752 . 1 1 57 57 HIS CD2 C 13 119.720 . . 1 . . . . 57 HIS CD2 . 25919 1 753 . 1 1 57 57 HIS N N 15 114.277 . . 1 . . . . 57 HIS N . 25919 1 754 . 1 1 58 58 VAL H H 1 7.261 . . 1 . . . . 58 VAL H . 25919 1 755 . 1 1 58 58 VAL HA H 1 3.909 . . 1 . . . . 58 VAL HA . 25919 1 756 . 1 1 58 58 VAL HB H 1 2.014 . . 1 . . . . 58 VAL HB . 25919 1 757 . 1 1 58 58 VAL HG21 H 1 0.789 . . 2 . . . . 58 VAL MG2 . 25919 1 758 . 1 1 58 58 VAL HG22 H 1 0.789 . . 2 . . . . 58 VAL MG2 . 25919 1 759 . 1 1 58 58 VAL HG23 H 1 0.789 . . 2 . . . . 58 VAL MG2 . 25919 1 760 . 1 1 58 58 VAL C C 13 177.148 . . 1 . . . . 58 VAL C . 25919 1 761 . 1 1 58 58 VAL CA C 13 62.900 . . 1 . . . . 58 VAL CA . 25919 1 762 . 1 1 58 58 VAL CB C 13 32.320 . . 1 . . . . 58 VAL CB . 25919 1 763 . 1 1 58 58 VAL CG1 C 13 22.474 . . 2 . . . . 58 VAL CG1 . 25919 1 764 . 1 1 58 58 VAL CG2 C 13 21.570 . . 2 . . . . 58 VAL CG2 . 25919 1 765 . 1 1 58 58 VAL N N 15 123.531 . . 1 . . . . 58 VAL N . 25919 1 766 . 1 1 59 59 ASN H H 1 8.819 . . 1 . . . . 59 ASN H . 25919 1 767 . 1 1 59 59 ASN HA H 1 5.174 . . 1 . . . . 59 ASN HA . 25919 1 768 . 1 1 59 59 ASN HB2 H 1 2.630 . . 2 . . . . 59 ASN HB2 . 25919 1 769 . 1 1 59 59 ASN HB3 H 1 2.856 . . 2 . . . . 59 ASN HB3 . 25919 1 770 . 1 1 59 59 ASN HD21 H 1 7.470 . . 2 . . . . 59 ASN HD21 . 25919 1 771 . 1 1 59 59 ASN HD22 H 1 6.933 . . 2 . . . . 59 ASN HD22 . 25919 1 772 . 1 1 59 59 ASN C C 13 175.176 . . 1 . . . . 59 ASN C . 25919 1 773 . 1 1 59 59 ASN CA C 13 51.374 . . 1 . . . . 59 ASN CA . 25919 1 774 . 1 1 59 59 ASN CB C 13 40.038 . . 1 . . . . 59 ASN CB . 25919 1 775 . 1 1 59 59 ASN N N 15 124.147 . . 1 . . . . 59 ASN N . 25919 1 776 . 1 1 59 59 ASN ND2 N 15 112.449 . . 1 . . . . 59 ASN ND2 . 25919 1 777 . 1 1 60 60 MET H H 1 8.023 . . 1 . . . . 60 MET H . 25919 1 778 . 1 1 60 60 MET HA H 1 4.425 . . 1 . . . . 60 MET HA . 25919 1 779 . 1 1 60 60 MET HB2 H 1 2.054 . . 2 . . . . 60 MET HB2 . 25919 1 780 . 1 1 60 60 MET HB3 H 1 2.273 . . 2 . . . . 60 MET HB3 . 25919 1 781 . 1 1 60 60 MET HG2 H 1 2.775 . . 2 . . . . 60 MET HG2 . 25919 1 782 . 1 1 60 60 MET HG3 H 1 2.797 . . 2 . . . . 60 MET HG3 . 25919 1 783 . 1 1 60 60 MET CA C 13 57.271 . . 1 . . . . 60 MET CA . 25919 1 784 . 1 1 60 60 MET CB C 13 30.063 . . 1 . . . . 60 MET CB . 25919 1 785 . 1 1 60 60 MET CG C 13 32.309 . . 1 . . . . 60 MET CG . 25919 1 786 . 1 1 60 60 MET CE C 13 16.336 . . 1 . . . . 60 MET CE . 25919 1 787 . 1 1 60 60 MET N N 15 117.583 . . 1 . . . . 60 MET N . 25919 1 788 . 1 1 61 61 SER H H 1 8.350 . . 1 . . . . 61 SER H . 25919 1 789 . 1 1 61 61 SER HA H 1 4.138 . . 1 . . . . 61 SER HA . 25919 1 790 . 1 1 61 61 SER HB2 H 1 3.894 . . 2 . . . . 61 SER HB2 . 25919 1 791 . 1 1 61 61 SER HB3 H 1 3.894 . . 2 . . . . 61 SER HB3 . 25919 1 792 . 1 1 61 61 SER C C 13 178.809 . . 1 . . . . 61 SER C . 25919 1 793 . 1 1 61 61 SER CA C 13 61.553 . . 1 . . . . 61 SER CA . 25919 1 794 . 1 1 61 61 SER CB C 13 62.581 . . 1 . . . . 61 SER CB . 25919 1 795 . 1 1 61 61 SER N N 15 115.027 . . 1 . . . . 61 SER N . 25919 1 796 . 1 1 62 62 GLU H H 1 7.994 . . 1 . . . . 62 GLU H . 25919 1 797 . 1 1 62 62 GLU HA H 1 3.979 . . 1 . . . . 62 GLU HA . 25919 1 798 . 1 1 62 62 GLU HB2 H 1 1.899 . . 2 . . . . 62 GLU HB2 . 25919 1 799 . 1 1 62 62 GLU HB3 H 1 2.350 . . 2 . . . . 62 GLU HB3 . 25919 1 800 . 1 1 62 62 GLU HG2 H 1 2.269 . . 2 . . . . 62 GLU HG2 . 25919 1 801 . 1 1 62 62 GLU HG3 H 1 2.435 . . 2 . . . . 62 GLU HG3 . 25919 1 802 . 1 1 62 62 GLU C C 13 176.456 . . 1 . . . . 62 GLU C . 25919 1 803 . 1 1 62 62 GLU CA C 13 58.726 . . 1 . . . . 62 GLU CA . 25919 1 804 . 1 1 62 62 GLU CB C 13 29.700 . . 1 . . . . 62 GLU CB . 25919 1 805 . 1 1 62 62 GLU CG C 13 36.491 . . 1 . . . . 62 GLU CG . 25919 1 806 . 1 1 62 62 GLU N N 15 123.657 . . 1 . . . . 62 GLU N . 25919 1 807 . 1 1 63 63 LEU H H 1 8.223 . . 1 . . . . 63 LEU H . 25919 1 808 . 1 1 63 63 LEU HA H 1 3.949 . . 1 . . . . 63 LEU HA . 25919 1 809 . 1 1 63 63 LEU HB2 H 1 1.242 . . 2 . . . . 63 LEU HB2 . 25919 1 810 . 1 1 63 63 LEU HB3 H 1 2.096 . . 2 . . . . 63 LEU HB3 . 25919 1 811 . 1 1 63 63 LEU HG H 1 1.415 . . 1 . . . . 63 LEU HG . 25919 1 812 . 1 1 63 63 LEU HD11 H 1 0.776 . . 2 . . . . 63 LEU MD1 . 25919 1 813 . 1 1 63 63 LEU HD12 H 1 0.776 . . 2 . . . . 63 LEU MD1 . 25919 1 814 . 1 1 63 63 LEU HD13 H 1 0.776 . . 2 . . . . 63 LEU MD1 . 25919 1 815 . 1 1 63 63 LEU HD21 H 1 0.700 . . 2 . . . . 63 LEU MD2 . 25919 1 816 . 1 1 63 63 LEU HD22 H 1 0.700 . . 2 . . . . 63 LEU MD2 . 25919 1 817 . 1 1 63 63 LEU HD23 H 1 0.700 . . 2 . . . . 63 LEU MD2 . 25919 1 818 . 1 1 63 63 LEU C C 13 178.113 . . 1 . . . . 63 LEU C . 25919 1 819 . 1 1 63 63 LEU CA C 13 57.860 . . 1 . . . . 63 LEU CA . 25919 1 820 . 1 1 63 63 LEU CB C 13 41.526 . . 1 . . . . 63 LEU CB . 25919 1 821 . 1 1 63 63 LEU CG C 13 27.066 . . 1 . . . . 63 LEU CG . 25919 1 822 . 1 1 63 63 LEU CD1 C 13 26.674 . . 2 . . . . 63 LEU CD1 . 25919 1 823 . 1 1 63 63 LEU CD2 C 13 23.801 . . 2 . . . . 63 LEU CD2 . 25919 1 824 . 1 1 63 63 LEU N N 15 121.225 . . 1 . . . . 63 LEU N . 25919 1 825 . 1 1 64 64 ILE H H 1 8.301 . . 1 . . . . 64 ILE H . 25919 1 826 . 1 1 64 64 ILE HA H 1 3.375 . . 1 . . . . 64 ILE HA . 25919 1 827 . 1 1 64 64 ILE HB H 1 1.956 . . 1 . . . . 64 ILE HB . 25919 1 828 . 1 1 64 64 ILE HG12 H 1 1.031 . . 2 . . . . 64 ILE HG12 . 25919 1 829 . 1 1 64 64 ILE HG13 H 1 1.912 . . 2 . . . . 64 ILE HG13 . 25919 1 830 . 1 1 64 64 ILE HG21 H 1 0.929 . . 1 . . . . 64 ILE MG . 25919 1 831 . 1 1 64 64 ILE HG22 H 1 0.929 . . 1 . . . . 64 ILE MG . 25919 1 832 . 1 1 64 64 ILE HG23 H 1 0.929 . . 1 . . . . 64 ILE MG . 25919 1 833 . 1 1 64 64 ILE HD11 H 1 0.969 . . 1 . . . . 64 ILE MD . 25919 1 834 . 1 1 64 64 ILE HD12 H 1 0.969 . . 1 . . . . 64 ILE MD . 25919 1 835 . 1 1 64 64 ILE HD13 H 1 0.969 . . 1 . . . . 64 ILE MD . 25919 1 836 . 1 1 64 64 ILE CA C 13 66.723 . . 1 . . . . 64 ILE CA . 25919 1 837 . 1 1 64 64 ILE CB C 13 38.161 . . 1 . . . . 64 ILE CB . 25919 1 838 . 1 1 64 64 ILE CG1 C 13 31.642 . . 1 . . . . 64 ILE CG1 . 25919 1 839 . 1 1 64 64 ILE CG2 C 13 17.340 . . 1 . . . . 64 ILE CG2 . 25919 1 840 . 1 1 64 64 ILE CD1 C 13 13.987 . . 1 . . . . 64 ILE CD1 . 25919 1 841 . 1 1 64 64 ILE N N 15 119.273 . . 1 . . . . 64 ILE N . 25919 1 842 . 1 1 65 65 LYS H H 1 7.300 . . 1 . . . . 65 LYS H . 25919 1 843 . 1 1 65 65 LYS HA H 1 3.703 . . 1 . . . . 65 LYS HA . 25919 1 844 . 1 1 65 65 LYS HB2 H 1 1.894 . . 2 . . . . 65 LYS HB2 . 25919 1 845 . 1 1 65 65 LYS HB3 H 1 1.937 . . 2 . . . . 65 LYS HB3 . 25919 1 846 . 1 1 65 65 LYS HG2 H 1 1.318 . . 2 . . . . 65 LYS HG2 . 25919 1 847 . 1 1 65 65 LYS HG3 H 1 1.608 . . 2 . . . . 65 LYS HG3 . 25919 1 848 . 1 1 65 65 LYS HD2 H 1 1.660 . . 2 . . . . 65 LYS HD2 . 25919 1 849 . 1 1 65 65 LYS HD3 H 1 1.660 . . 2 . . . . 65 LYS HD3 . 25919 1 850 . 1 1 65 65 LYS HE2 H 1 2.898 . . 2 . . . . 65 LYS HE2 . 25919 1 851 . 1 1 65 65 LYS HE3 H 1 2.898 . . 2 . . . . 65 LYS HE3 . 25919 1 852 . 1 1 65 65 LYS C C 13 173.869 . . 1 . . . . 65 LYS C . 25919 1 853 . 1 1 65 65 LYS CA C 13 60.451 . . 1 . . . . 65 LYS CA . 25919 1 854 . 1 1 65 65 LYS CB C 13 32.300 . . 1 . . . . 65 LYS CB . 25919 1 855 . 1 1 65 65 LYS CG C 13 25.511 . . 1 . . . . 65 LYS CG . 25919 1 856 . 1 1 65 65 LYS CD C 13 29.615 . . 1 . . . . 65 LYS CD . 25919 1 857 . 1 1 65 65 LYS CE C 13 42.000 . . 1 . . . . 65 LYS CE . 25919 1 858 . 1 1 65 65 LYS N N 15 119.143 . . 1 . . . . 65 LYS N . 25919 1 859 . 1 1 66 66 ILE H H 1 8.048 . . 1 . . . . 66 ILE H . 25919 1 860 . 1 1 66 66 ILE HA H 1 3.541 . . 1 . . . . 66 ILE HA . 25919 1 861 . 1 1 66 66 ILE HB H 1 1.945 . . 1 . . . . 66 ILE HB . 25919 1 862 . 1 1 66 66 ILE HG12 H 1 0.983 . . 2 . . . . 66 ILE HG12 . 25919 1 863 . 1 1 66 66 ILE HG13 H 1 1.787 . . 2 . . . . 66 ILE HG13 . 25919 1 864 . 1 1 66 66 ILE HG21 H 1 0.805 . . 1 . . . . 66 ILE MG . 25919 1 865 . 1 1 66 66 ILE HG22 H 1 0.805 . . 1 . . . . 66 ILE MG . 25919 1 866 . 1 1 66 66 ILE HG23 H 1 0.805 . . 1 . . . . 66 ILE MG . 25919 1 867 . 1 1 66 66 ILE HD11 H 1 0.681 . . 1 . . . . 66 ILE MD . 25919 1 868 . 1 1 66 66 ILE HD12 H 1 0.681 . . 1 . . . . 66 ILE MD . 25919 1 869 . 1 1 66 66 ILE HD13 H 1 0.681 . . 1 . . . . 66 ILE MD . 25919 1 870 . 1 1 66 66 ILE C C 13 176.459 . . 1 . . . . 66 ILE C . 25919 1 871 . 1 1 66 66 ILE CA C 13 65.290 . . 1 . . . . 66 ILE CA . 25919 1 872 . 1 1 66 66 ILE CB C 13 38.254 . . 1 . . . . 66 ILE CB . 25919 1 873 . 1 1 66 66 ILE CG1 C 13 28.908 . . 1 . . . . 66 ILE CG1 . 25919 1 874 . 1 1 66 66 ILE CG2 C 13 17.914 . . 1 . . . . 66 ILE CG2 . 25919 1 875 . 1 1 66 66 ILE CD1 C 13 13.715 . . 1 . . . . 66 ILE CD1 . 25919 1 876 . 1 1 66 66 ILE N N 15 120.527 . . 1 . . . . 66 ILE N . 25919 1 877 . 1 1 67 67 ILE H H 1 8.308 . . 1 . . . . 67 ILE H . 25919 1 878 . 1 1 67 67 ILE HA H 1 3.336 . . 1 . . . . 67 ILE HA . 25919 1 879 . 1 1 67 67 ILE HB H 1 1.626 . . 1 . . . . 67 ILE HB . 25919 1 880 . 1 1 67 67 ILE HG12 H 1 0.994 . . 2 . . . . 67 ILE HG12 . 25919 1 881 . 1 1 67 67 ILE HG13 H 1 1.276 . . 2 . . . . 67 ILE HG13 . 25919 1 882 . 1 1 67 67 ILE HG21 H 1 0.490 . . 1 . . . . 67 ILE MG . 25919 1 883 . 1 1 67 67 ILE HG22 H 1 0.490 . . 1 . . . . 67 ILE MG . 25919 1 884 . 1 1 67 67 ILE HG23 H 1 0.490 . . 1 . . . . 67 ILE MG . 25919 1 885 . 1 1 67 67 ILE HD11 H 1 0.353 . . 1 . . . . 67 ILE MD . 25919 1 886 . 1 1 67 67 ILE HD12 H 1 0.353 . . 1 . . . . 67 ILE MD . 25919 1 887 . 1 1 67 67 ILE HD13 H 1 0.353 . . 1 . . . . 67 ILE MD . 25919 1 888 . 1 1 67 67 ILE C C 13 178.102 . . 1 . . . . 67 ILE C . 25919 1 889 . 1 1 67 67 ILE CA C 13 63.952 . . 1 . . . . 67 ILE CA . 25919 1 890 . 1 1 67 67 ILE CB C 13 35.891 . . 1 . . . . 67 ILE CB . 25919 1 891 . 1 1 67 67 ILE CG1 C 13 27.822 . . 1 . . . . 67 ILE CG1 . 25919 1 892 . 1 1 67 67 ILE CG2 C 13 18.726 . . 1 . . . . 67 ILE CG2 . 25919 1 893 . 1 1 67 67 ILE CD1 C 13 11.388 . . 1 . . . . 67 ILE CD1 . 25919 1 894 . 1 1 67 67 ILE N N 15 121.527 . . 1 . . . . 67 ILE N . 25919 1 895 . 1 1 68 68 ARG H H 1 8.336 . . 1 . . . . 68 ARG H . 25919 1 896 . 1 1 68 68 ARG HA H 1 2.970 . . 1 . . . . 68 ARG HA . 25919 1 897 . 1 1 68 68 ARG HB2 H 1 1.550 . . 2 . . . . 68 ARG HB2 . 25919 1 898 . 1 1 68 68 ARG HB3 H 1 1.550 . . 2 . . . . 68 ARG HB3 . 25919 1 899 . 1 1 68 68 ARG HG2 H 1 0.542 . . 2 . . . . 68 ARG HG2 . 25919 1 900 . 1 1 68 68 ARG HG3 H 1 1.292 . . 2 . . . . 68 ARG HG3 . 25919 1 901 . 1 1 68 68 ARG HD2 H 1 2.765 . . 2 . . . . 68 ARG HD2 . 25919 1 902 . 1 1 68 68 ARG HD3 H 1 3.200 . . 2 . . . . 68 ARG HD3 . 25919 1 903 . 1 1 68 68 ARG HE H 1 7.094 . . 1 . . . . 68 ARG HE . 25919 1 904 . 1 1 68 68 ARG C C 13 172.723 . . 1 . . . . 68 ARG C . 25919 1 905 . 1 1 68 68 ARG CA C 13 60.704 . . 1 . . . . 68 ARG CA . 25919 1 906 . 1 1 68 68 ARG CB C 13 30.320 . . 1 . . . . 68 ARG CB . 25919 1 907 . 1 1 68 68 ARG CG C 13 28.906 . . 1 . . . . 68 ARG CG . 25919 1 908 . 1 1 68 68 ARG CD C 13 43.382 . . 1 . . . . 68 ARG CD . 25919 1 909 . 1 1 68 68 ARG N N 15 119.384 . . 1 . . . . 68 ARG N . 25919 1 910 . 1 1 68 68 ARG NE N 15 82.40 . . 1 . . . . 68 ARG NE . 25919 1 911 . 1 1 69 69 ARG H H 1 7.432 . . 1 . . . . 69 ARG H . 25919 1 912 . 1 1 69 69 ARG HA H 1 4.138 . . 1 . . . . 69 ARG HA . 25919 1 913 . 1 1 69 69 ARG HB2 H 1 1.853 . . 2 . . . . 69 ARG HB2 . 25919 1 914 . 1 1 69 69 ARG HB3 H 1 1.931 . . 2 . . . . 69 ARG HB3 . 25919 1 915 . 1 1 69 69 ARG HG2 H 1 1.587 . . 2 . . . . 69 ARG HG2 . 25919 1 916 . 1 1 69 69 ARG HG3 H 1 1.675 . . 2 . . . . 69 ARG HG3 . 25919 1 917 . 1 1 69 69 ARG HD2 H 1 3.137 . . 2 . . . . 69 ARG HD2 . 25919 1 918 . 1 1 69 69 ARG HD3 H 1 3.137 . . 2 . . . . 69 ARG HD3 . 25919 1 919 . 1 1 69 69 ARG HE H 1 7.245 . . 1 . . . . 69 ARG HE . 25919 1 920 . 1 1 69 69 ARG C C 13 172.480 . . 1 . . . . 69 ARG C . 25919 1 921 . 1 1 69 69 ARG CA C 13 58.645 . . 1 . . . . 69 ARG CA . 25919 1 922 . 1 1 69 69 ARG CB C 13 29.779 . . 1 . . . . 69 ARG CB . 25919 1 923 . 1 1 69 69 ARG CG C 13 27.176 . . 1 . . . . 69 ARG CG . 25919 1 924 . 1 1 69 69 ARG CD C 13 43.415 . . 1 . . . . 69 ARG CD . 25919 1 925 . 1 1 69 69 ARG N N 15 117.648 . . 1 . . . . 69 ARG N . 25919 1 926 . 1 1 69 69 ARG NE N 15 85.40 . . 1 . . . . 69 ARG NE . 25919 1 927 . 1 1 70 70 ARG H H 1 8.212 . . 1 . . . . 70 ARG H . 25919 1 928 . 1 1 70 70 ARG HA H 1 4.074 . . 1 . . . . 70 ARG HA . 25919 1 929 . 1 1 70 70 ARG HB2 H 1 1.855 . . 2 . . . . 70 ARG HB2 . 25919 1 930 . 1 1 70 70 ARG HB3 H 1 1.855 . . 2 . . . . 70 ARG HB3 . 25919 1 931 . 1 1 70 70 ARG HG2 H 1 1.586 . . 2 . . . . 70 ARG HG2 . 25919 1 932 . 1 1 70 70 ARG HG3 H 1 1.675 . . 2 . . . . 70 ARG HG3 . 25919 1 933 . 1 1 70 70 ARG HD2 H 1 3.134 . . 2 . . . . 70 ARG HD2 . 25919 1 934 . 1 1 70 70 ARG HD3 H 1 3.188 . . 2 . . . . 70 ARG HD3 . 25919 1 935 . 1 1 70 70 ARG HE H 1 7.245 . . 1 . . . . 70 ARG HE . 25919 1 936 . 1 1 70 70 ARG C C 13 178.799 . . 1 . . . . 70 ARG C . 25919 1 937 . 1 1 70 70 ARG CA C 13 58.385 . . 1 . . . . 70 ARG CA . 25919 1 938 . 1 1 70 70 ARG CB C 13 30.043 . . 1 . . . . 70 ARG CB . 25919 1 939 . 1 1 70 70 ARG CG C 13 27.193 . . 1 . . . . 70 ARG CG . 25919 1 940 . 1 1 70 70 ARG CD C 13 43.403 . . 1 . . . . 70 ARG CD . 25919 1 941 . 1 1 70 70 ARG N N 15 124.006 . . 1 . . . . 70 ARG N . 25919 1 942 . 1 1 70 70 ARG NE N 15 85.357 . . 1 . . . . 70 ARG NE . 25919 1 943 . 1 1 71 71 LEU H H 1 7.750 . . 1 . . . . 71 LEU H . 25919 1 944 . 1 1 71 71 LEU HA H 1 4.085 . . 1 . . . . 71 LEU HA . 25919 1 945 . 1 1 71 71 LEU HB2 H 1 1.333 . . 2 . . . . 71 LEU HB2 . 25919 1 946 . 1 1 71 71 LEU HB3 H 1 1.483 . . 2 . . . . 71 LEU HB3 . 25919 1 947 . 1 1 71 71 LEU HG H 1 1.388 . . 1 . . . . 71 LEU HG . 25919 1 948 . 1 1 71 71 LEU HD11 H 1 0.270 . . 2 . . . . 71 LEU MD1 . 25919 1 949 . 1 1 71 71 LEU HD12 H 1 0.270 . . 2 . . . . 71 LEU MD1 . 25919 1 950 . 1 1 71 71 LEU HD13 H 1 0.270 . . 2 . . . . 71 LEU MD1 . 25919 1 951 . 1 1 71 71 LEU HD21 H 1 0.641 . . 2 . . . . 71 LEU MD2 . 25919 1 952 . 1 1 71 71 LEU HD22 H 1 0.641 . . 2 . . . . 71 LEU MD2 . 25919 1 953 . 1 1 71 71 LEU HD23 H 1 0.641 . . 2 . . . . 71 LEU MD2 . 25919 1 954 . 1 1 71 71 LEU CA C 13 55.063 . . 1 . . . . 71 LEU CA . 25919 1 955 . 1 1 71 71 LEU CB C 13 43.100 . . 1 . . . . 71 LEU CB . 25919 1 956 . 1 1 71 71 LEU CG C 13 26.413 . . 1 . . . . 71 LEU CG . 25919 1 957 . 1 1 71 71 LEU CD1 C 13 27.358 . . 2 . . . . 71 LEU CD1 . 25919 1 958 . 1 1 71 71 LEU CD2 C 13 23.240 . . 2 . . . . 71 LEU CD2 . 25919 1 959 . 1 1 71 71 LEU N N 15 117.764 . . 1 . . . . 71 LEU N . 25919 1 960 . 1 1 72 72 GLN H H 1 7.751 . . 1 . . . . 72 GLN H . 25919 1 961 . 1 1 72 72 GLN HA H 1 3.839 . . 1 . . . . 72 GLN HA . 25919 1 962 . 1 1 72 72 GLN HB2 H 1 2.178 . . 2 . . . . 72 GLN HB2 . 25919 1 963 . 1 1 72 72 GLN HB3 H 1 2.218 . . 2 . . . . 72 GLN HB3 . 25919 1 964 . 1 1 72 72 GLN HG2 H 1 2.233 . . 2 . . . . 72 GLN HG2 . 25919 1 965 . 1 1 72 72 GLN HG3 H 1 2.233 . . 2 . . . . 72 GLN HG3 . 25919 1 966 . 1 1 72 72 GLN HE21 H 1 7.569 . . 2 . . . . 72 GLN HE21 . 25919 1 967 . 1 1 72 72 GLN HE22 H 1 6.812 . . 2 . . . . 72 GLN HE22 . 25919 1 968 . 1 1 72 72 GLN C C 13 175.744 . . 1 . . . . 72 GLN C . 25919 1 969 . 1 1 72 72 GLN CA C 13 56.409 . . 1 . . . . 72 GLN CA . 25919 1 970 . 1 1 72 72 GLN CB C 13 25.959 . . 1 . . . . 72 GLN CB . 25919 1 971 . 1 1 72 72 GLN CG C 13 34.345 . . 1 . . . . 72 GLN CG . 25919 1 972 . 1 1 72 72 GLN CD C 13 181.391 . . 1 . . . . 72 GLN CD . 25919 1 973 . 1 1 72 72 GLN N N 15 115.522 . . 1 . . . . 72 GLN N . 25919 1 974 . 1 1 72 72 GLN NE2 N 15 113.046 . . 1 . . . . 72 GLN NE2 . 25919 1 975 . 1 1 73 73 LEU H H 1 7.573 . . 1 . . . . 73 LEU H . 25919 1 976 . 1 1 73 73 LEU HA H 1 4.254 . . 1 . . . . 73 LEU HA . 25919 1 977 . 1 1 73 73 LEU HB2 H 1 1.278 . . 2 . . . . 73 LEU HB2 . 25919 1 978 . 1 1 73 73 LEU HB3 H 1 1.328 . . 2 . . . . 73 LEU HB3 . 25919 1 979 . 1 1 73 73 LEU HG H 1 1.595 . . 1 . . . . 73 LEU HG . 25919 1 980 . 1 1 73 73 LEU HD11 H 1 0.516 . . 2 . . . . 73 LEU MD1 . 25919 1 981 . 1 1 73 73 LEU HD12 H 1 0.516 . . 2 . . . . 73 LEU MD1 . 25919 1 982 . 1 1 73 73 LEU HD13 H 1 0.516 . . 2 . . . . 73 LEU MD1 . 25919 1 983 . 1 1 73 73 LEU HD21 H 1 0.679 . . 2 . . . . 73 LEU MD2 . 25919 1 984 . 1 1 73 73 LEU HD22 H 1 0.679 . . 2 . . . . 73 LEU MD2 . 25919 1 985 . 1 1 73 73 LEU HD23 H 1 0.679 . . 2 . . . . 73 LEU MD2 . 25919 1 986 . 1 1 73 73 LEU C C 13 178.568 . . 1 . . . . 73 LEU C . 25919 1 987 . 1 1 73 73 LEU CA C 13 54.468 . . 1 . . . . 73 LEU CA . 25919 1 988 . 1 1 73 73 LEU CB C 13 42.050 . . 1 . . . . 73 LEU CB . 25919 1 989 . 1 1 73 73 LEU CG C 13 26.014 . . 1 . . . . 73 LEU CG . 25919 1 990 . 1 1 73 73 LEU CD1 C 13 26.342 . . 2 . . . . 73 LEU CD1 . 25919 1 991 . 1 1 73 73 LEU CD2 C 13 22.684 . . 2 . . . . 73 LEU CD2 . 25919 1 992 . 1 1 73 73 LEU N N 15 115.900 . . 1 . . . . 73 LEU N . 25919 1 993 . 1 1 74 74 ASN H H 1 8.949 . . 1 . . . . 74 ASN H . 25919 1 994 . 1 1 74 74 ASN HA H 1 4.684 . . 1 . . . . 74 ASN HA . 25919 1 995 . 1 1 74 74 ASN HB2 H 1 2.812 . . 2 . . . . 74 ASN HB2 . 25919 1 996 . 1 1 74 74 ASN HB3 H 1 2.912 . . 2 . . . . 74 ASN HB3 . 25919 1 997 . 1 1 74 74 ASN HD21 H 1 7.712 . . 2 . . . . 74 ASN HD21 . 25919 1 998 . 1 1 74 74 ASN HD22 H 1 7.037 . . 2 . . . . 74 ASN HD22 . 25919 1 999 . 1 1 74 74 ASN C C 13 174.122 . . 1 . . . . 74 ASN C . 25919 1 1000 . 1 1 74 74 ASN CA C 13 52.724 . . 1 . . . . 74 ASN CA . 25919 1 1001 . 1 1 74 74 ASN CB C 13 39.579 . . 1 . . . . 74 ASN CB . 25919 1 1002 . 1 1 74 74 ASN CG C 13 176.501 . . 1 . . . . 74 ASN CG . 25919 1 1003 . 1 1 74 74 ASN N N 15 122.154 . . 1 . . . . 74 ASN N . 25919 1 1004 . 1 1 74 74 ASN ND2 N 15 114.905 . . 1 . . . . 74 ASN ND2 . 25919 1 1005 . 1 1 75 75 ALA H H 1 8.690 . . 1 . . . . 75 ALA H . 25919 1 1006 . 1 1 75 75 ALA HA H 1 3.972 . . 1 . . . . 75 ALA HA . 25919 1 1007 . 1 1 75 75 ALA C C 13 178.113 . . 1 . . . . 75 ALA C . 25919 1 1008 . 1 1 75 75 ALA CA C 13 54.900 . . 1 . . . . 75 ALA CA . 25919 1 1009 . 1 1 75 75 ALA CB C 13 18.708 . . 1 . . . . 75 ALA CB . 25919 1 1010 . 1 1 75 75 ALA N N 15 124.274 . . 1 . . . . 75 ALA N . 25919 1 1011 . 1 1 76 76 ASN H H 1 8.340 . . 1 . . . . 76 ASN H . 25919 1 1012 . 1 1 76 76 ASN HA H 1 4.589 . . 1 . . . . 76 ASN HA . 25919 1 1013 . 1 1 76 76 ASN HB2 H 1 2.833 . . 2 . . . . 76 ASN HB2 . 25919 1 1014 . 1 1 76 76 ASN HB3 H 1 2.833 . . 2 . . . . 76 ASN HB3 . 25919 1 1015 . 1 1 76 76 ASN HD21 H 1 7.558 . . 2 . . . . 76 ASN HD21 . 25919 1 1016 . 1 1 76 76 ASN HD22 H 1 6.876 . . 2 . . . . 76 ASN HD22 . 25919 1 1017 . 1 1 76 76 ASN C C 13 175.515 . . 1 . . . . 76 ASN C . 25919 1 1018 . 1 1 76 76 ASN CA C 13 53.276 . . 1 . . . . 76 ASN CA . 25919 1 1019 . 1 1 76 76 ASN CB C 13 38.343 . . 1 . . . . 76 ASN CB . 25919 1 1020 . 1 1 76 76 ASN CG C 13 177.365 . . 1 . . . . 76 ASN CG . 25919 1 1021 . 1 1 76 76 ASN N N 15 112.911 . . 1 . . . . 76 ASN N . 25919 1 1022 . 1 1 76 76 ASN ND2 N 15 113.151 . . 1 . . . . 76 ASN ND2 . 25919 1 1023 . 1 1 77 77 GLN H H 1 7.546 . . 1 . . . . 77 GLN H . 25919 1 1024 . 1 1 77 77 GLN HA H 1 4.287 . . 1 . . . . 77 GLN HA . 25919 1 1025 . 1 1 77 77 GLN HB2 H 1 2.001 . . 2 . . . . 77 GLN HB2 . 25919 1 1026 . 1 1 77 77 GLN HB3 H 1 2.161 . . 2 . . . . 77 GLN HB3 . 25919 1 1027 . 1 1 77 77 GLN HG2 H 1 2.324 . . 2 . . . . 77 GLN HG2 . 25919 1 1028 . 1 1 77 77 GLN HG3 H 1 2.397 . . 2 . . . . 77 GLN HG3 . 25919 1 1029 . 1 1 77 77 GLN HE21 H 1 8.224 . . 2 . . . . 77 GLN HE21 . 25919 1 1030 . 1 1 77 77 GLN HE22 H 1 7.315 . . 2 . . . . 77 GLN HE22 . 25919 1 1031 . 1 1 77 77 GLN C C 13 175.053 . . 1 . . . . 77 GLN C . 25919 1 1032 . 1 1 77 77 GLN CA C 13 55.856 . . 1 . . . . 77 GLN CA . 25919 1 1033 . 1 1 77 77 GLN CB C 13 30.320 . . 1 . . . . 77 GLN CB . 25919 1 1034 . 1 1 77 77 GLN CG C 13 35.101 . . 1 . . . . 77 GLN CG . 25919 1 1035 . 1 1 77 77 GLN CD C 13 180.151 . . 1 . . . . 77 GLN CD . 25919 1 1036 . 1 1 77 77 GLN N N 15 121.144 . . 1 . . . . 77 GLN N . 25919 1 1037 . 1 1 77 77 GLN NE2 N 15 115.368 . . 1 . . . . 77 GLN NE2 . 25919 1 1038 . 1 1 78 78 ALA H H 1 8.730 . . 1 . . . . 78 ALA H . 25919 1 1039 . 1 1 78 78 ALA HA H 1 4.179 . . 1 . . . . 78 ALA HA . 25919 1 1040 . 1 1 78 78 ALA C C 13 176.453 . . 1 . . . . 78 ALA C . 25919 1 1041 . 1 1 78 78 ALA CA C 13 52.852 . . 1 . . . . 78 ALA CA . 25919 1 1042 . 1 1 78 78 ALA CB C 13 20.074 . . 1 . . . . 78 ALA CB . 25919 1 1043 . 1 1 78 78 ALA N N 15 131.146 . . 1 . . . . 78 ALA N . 25919 1 1044 . 1 1 79 79 PHE H H 1 7.601 . . 1 . . . . 79 PHE H . 25919 1 1045 . 1 1 79 79 PHE HA H 1 4.453 . . 1 . . . . 79 PHE HA . 25919 1 1046 . 1 1 79 79 PHE HB2 H 1 2.570 . . 2 . . . . 79 PHE HB2 . 25919 1 1047 . 1 1 79 79 PHE HB3 H 1 2.753 . . 2 . . . . 79 PHE HB3 . 25919 1 1048 . 1 1 79 79 PHE HD1 H 1 6.905 . . 3 . . . . 79 PHE HD1 . 25919 1 1049 . 1 1 79 79 PHE HD2 H 1 6.905 . . 3 . . . . 79 PHE HD2 . 25919 1 1050 . 1 1 79 79 PHE HE1 H 1 6.763 . . 3 . . . . 79 PHE HE1 . 25919 1 1051 . 1 1 79 79 PHE HE2 H 1 6.763 . . 3 . . . . 79 PHE HE2 . 25919 1 1052 . 1 1 79 79 PHE HZ H 1 6.577 . . 1 . . . . 79 PHE HZ . 25919 1 1053 . 1 1 79 79 PHE C C 13 171.834 . . 1 . . . . 79 PHE C . 25919 1 1054 . 1 1 79 79 PHE CA C 13 59.115 . . 1 . . . . 79 PHE CA . 25919 1 1055 . 1 1 79 79 PHE CB C 13 42.246 . . 1 . . . . 79 PHE CB . 25919 1 1056 . 1 1 79 79 PHE CD1 C 13 131.533 . . 3 . . . . 79 PHE CD1 . 25919 1 1057 . 1 1 79 79 PHE CD2 C 13 131.533 . . 3 . . . . 79 PHE CD2 . 25919 1 1058 . 1 1 79 79 PHE CE1 C 13 129.845 . . 3 . . . . 79 PHE CE1 . 25919 1 1059 . 1 1 79 79 PHE CE2 C 13 129.845 . . 3 . . . . 79 PHE CE2 . 25919 1 1060 . 1 1 79 79 PHE CZ C 13 128.908 . . 1 . . . . 79 PHE CZ . 25919 1 1061 . 1 1 79 79 PHE N N 15 119.860 . . 1 . . . . 79 PHE N . 25919 1 1062 . 1 1 80 80 PHE H H 1 8.504 . . 1 . . . . 80 PHE H . 25919 1 1063 . 1 1 80 80 PHE HA H 1 4.396 . . 1 . . . . 80 PHE HA . 25919 1 1064 . 1 1 80 80 PHE HB2 H 1 2.409 . . 2 . . . . 80 PHE HB2 . 25919 1 1065 . 1 1 80 80 PHE HB3 H 1 2.777 . . 2 . . . . 80 PHE HB3 . 25919 1 1066 . 1 1 80 80 PHE HD1 H 1 6.920 . . 3 . . . . 80 PHE HD1 . 25919 1 1067 . 1 1 80 80 PHE HD2 H 1 6.920 . . 3 . . . . 80 PHE HD2 . 25919 1 1068 . 1 1 80 80 PHE HE1 H 1 7.203 . . 3 . . . . 80 PHE HE1 . 25919 1 1069 . 1 1 80 80 PHE HE2 H 1 7.203 . . 3 . . . . 80 PHE HE2 . 25919 1 1070 . 1 1 80 80 PHE HZ H 1 7.272 . . 1 . . . . 80 PHE HZ . 25919 1 1071 . 1 1 80 80 PHE C C 13 173.169 . . 1 . . . . 80 PHE C . 25919 1 1072 . 1 1 80 80 PHE CA C 13 56.859 . . 1 . . . . 80 PHE CA . 25919 1 1073 . 1 1 80 80 PHE CB C 13 41.946 . . 1 . . . . 80 PHE CB . 25919 1 1074 . 1 1 80 80 PHE CD1 C 13 132.100 . . 3 . . . . 80 PHE CD1 . 25919 1 1075 . 1 1 80 80 PHE CD2 C 13 132.100 . . 3 . . . . 80 PHE CD2 . 25919 1 1076 . 1 1 80 80 PHE CE1 C 13 131.345 . . 3 . . . . 80 PHE CE1 . 25919 1 1077 . 1 1 80 80 PHE CE2 C 13 131.345 . . 3 . . . . 80 PHE CE2 . 25919 1 1078 . 1 1 80 80 PHE CZ C 13 130.220 . . 1 . . . . 80 PHE CZ . 25919 1 1079 . 1 1 80 80 PHE N N 15 126.800 . . 1 . . . . 80 PHE N . 25919 1 1080 . 1 1 81 81 LEU H H 1 8.159 . . 1 . . . . 81 LEU H . 25919 1 1081 . 1 1 81 81 LEU HA H 1 4.902 . . 1 . . . . 81 LEU HA . 25919 1 1082 . 1 1 81 81 LEU HB2 H 1 1.235 . . 2 . . . . 81 LEU HB2 . 25919 1 1083 . 1 1 81 81 LEU HB3 H 1 1.682 . . 2 . . . . 81 LEU HB3 . 25919 1 1084 . 1 1 81 81 LEU HG H 1 1.461 . . 1 . . . . 81 LEU HG . 25919 1 1085 . 1 1 81 81 LEU HD11 H 1 0.846 . . 2 . . . . 81 LEU MD1 . 25919 1 1086 . 1 1 81 81 LEU HD12 H 1 0.846 . . 2 . . . . 81 LEU MD1 . 25919 1 1087 . 1 1 81 81 LEU HD13 H 1 0.846 . . 2 . . . . 81 LEU MD1 . 25919 1 1088 . 1 1 81 81 LEU HD21 H 1 0.891 . . 2 . . . . 81 LEU MD2 . 25919 1 1089 . 1 1 81 81 LEU HD22 H 1 0.891 . . 2 . . . . 81 LEU MD2 . 25919 1 1090 . 1 1 81 81 LEU HD23 H 1 0.891 . . 2 . . . . 81 LEU MD2 . 25919 1 1091 . 1 1 81 81 LEU CA C 13 53.108 . . 1 . . . . 81 LEU CA . 25919 1 1092 . 1 1 81 81 LEU CB C 13 45.781 . . 1 . . . . 81 LEU CB . 25919 1 1093 . 1 1 81 81 LEU CG C 13 27.020 . . 1 . . . . 81 LEU CG . 25919 1 1094 . 1 1 81 81 LEU CD1 C 13 26.021 . . 2 . . . . 81 LEU CD1 . 25919 1 1095 . 1 1 81 81 LEU CD2 C 13 24.840 . . 2 . . . . 81 LEU CD2 . 25919 1 1096 . 1 1 81 81 LEU N N 15 122.590 . . 1 . . . . 81 LEU N . 25919 1 1097 . 1 1 82 82 LEU H H 1 9.347 . . 1 . . . . 82 LEU H . 25919 1 1098 . 1 1 82 82 LEU HA H 1 4.807 . . 1 . . . . 82 LEU HA . 25919 1 1099 . 1 1 82 82 LEU HB2 H 1 0.992 . . 2 . . . . 82 LEU HB2 . 25919 1 1100 . 1 1 82 82 LEU HB3 H 1 1.507 . . 2 . . . . 82 LEU HB3 . 25919 1 1101 . 1 1 82 82 LEU HG H 1 1.220 . . 1 . . . . 82 LEU HG . 25919 1 1102 . 1 1 82 82 LEU HD11 H 1 0.501 . . 2 . . . . 82 LEU MD1 . 25919 1 1103 . 1 1 82 82 LEU HD12 H 1 0.501 . . 2 . . . . 82 LEU MD1 . 25919 1 1104 . 1 1 82 82 LEU HD13 H 1 0.501 . . 2 . . . . 82 LEU MD1 . 25919 1 1105 . 1 1 82 82 LEU HD21 H 1 0.489 . . 2 . . . . 82 LEU MD2 . 25919 1 1106 . 1 1 82 82 LEU HD22 H 1 0.489 . . 2 . . . . 82 LEU MD2 . 25919 1 1107 . 1 1 82 82 LEU HD23 H 1 0.489 . . 2 . . . . 82 LEU MD2 . 25919 1 1108 . 1 1 82 82 LEU C C 13 174.204 . . 1 . . . . 82 LEU C . 25919 1 1109 . 1 1 82 82 LEU CA C 13 54.200 . . 1 . . . . 82 LEU CA . 25919 1 1110 . 1 1 82 82 LEU CB C 13 43.650 . . 1 . . . . 82 LEU CB . 25919 1 1111 . 1 1 82 82 LEU CG C 13 27.678 . . 1 . . . . 82 LEU CG . 25919 1 1112 . 1 1 82 82 LEU CD1 C 13 24.763 . . 2 . . . . 82 LEU CD1 . 25919 1 1113 . 1 1 82 82 LEU CD2 C 13 24.455 . . 2 . . . . 82 LEU CD2 . 25919 1 1114 . 1 1 82 82 LEU N N 15 126.414 . . 1 . . . . 82 LEU N . 25919 1 1115 . 1 1 83 83 VAL H H 1 8.676 . . 1 . . . . 83 VAL H . 25919 1 1116 . 1 1 83 83 VAL HA H 1 4.466 . . 1 . . . . 83 VAL HA . 25919 1 1117 . 1 1 83 83 VAL HB H 1 2.005 . . 1 . . . . 83 VAL HB . 25919 1 1118 . 1 1 83 83 VAL HG21 H 1 0.972 . . 2 . . . . 83 VAL MG2 . 25919 1 1119 . 1 1 83 83 VAL HG22 H 1 0.972 . . 2 . . . . 83 VAL MG2 . 25919 1 1120 . 1 1 83 83 VAL HG23 H 1 0.972 . . 2 . . . . 83 VAL MG2 . 25919 1 1121 . 1 1 83 83 VAL C C 13 175.891 . . 1 . . . . 83 VAL C . 25919 1 1122 . 1 1 83 83 VAL CA C 13 61.339 . . 1 . . . . 83 VAL CA . 25919 1 1123 . 1 1 83 83 VAL CB C 13 34.013 . . 1 . . . . 83 VAL CB . 25919 1 1124 . 1 1 83 83 VAL CG1 C 13 21.791 . . 2 . . . . 83 VAL CG1 . 25919 1 1125 . 1 1 83 83 VAL CG2 C 13 21.791 . . 2 . . . . 83 VAL CG2 . 25919 1 1126 . 1 1 83 83 VAL N N 15 123.910 . . 1 . . . . 83 VAL N . 25919 1 1127 . 1 1 84 84 ASN H H 1 9.630 . . 1 . . . . 84 ASN H . 25919 1 1128 . 1 1 84 84 ASN HA H 1 4.384 . . 1 . . . . 84 ASN HA . 25919 1 1129 . 1 1 84 84 ASN HB2 H 1 2.905 . . 2 . . . . 84 ASN HB2 . 25919 1 1130 . 1 1 84 84 ASN HB3 H 1 3.264 . . 2 . . . . 84 ASN HB3 . 25919 1 1131 . 1 1 84 84 ASN HD21 H 1 8.541 . . 2 . . . . 84 ASN HD21 . 25919 1 1132 . 1 1 84 84 ASN HD22 H 1 7.131 . . 2 . . . . 84 ASN HD22 . 25919 1 1133 . 1 1 84 84 ASN CA C 13 54.494 . . 1 . . . . 84 ASN CA . 25919 1 1134 . 1 1 84 84 ASN CB C 13 37.933 . . 1 . . . . 84 ASN CB . 25919 1 1135 . 1 1 84 84 ASN N N 15 127.149 . . 1 . . . . 84 ASN N . 25919 1 1136 . 1 1 84 84 ASN ND2 N 15 116.358 . . 1 . . . . 84 ASN ND2 . 25919 1 1137 . 1 1 85 85 GLY H H 1 8.670 . . 1 . . . . 85 GLY H . 25919 1 1138 . 1 1 85 85 GLY HA2 H 1 3.383 . . 2 . . . . 85 GLY HA2 . 25919 1 1139 . 1 1 85 85 GLY HA3 H 1 4.027 . . 2 . . . . 85 GLY HA3 . 25919 1 1140 . 1 1 85 85 GLY C C 13 175.112 . . 1 . . . . 85 GLY C . 25919 1 1141 . 1 1 85 85 GLY CA C 13 45.624 . . 1 . . . . 85 GLY CA . 25919 1 1142 . 1 1 85 85 GLY N N 15 101.905 . . 1 . . . . 85 GLY N . 25919 1 1143 . 1 1 86 86 HIS H H 1 7.927 . . 1 . . . . 86 HIS H . 25919 1 1144 . 1 1 86 86 HIS HA H 1 5.039 . . 1 . . . . 86 HIS HA . 25919 1 1145 . 1 1 86 86 HIS HB2 H 1 3.224 . . 2 . . . . 86 HIS HB2 . 25919 1 1146 . 1 1 86 86 HIS HB3 H 1 3.320 . . 2 . . . . 86 HIS HB3 . 25919 1 1147 . 1 1 86 86 HIS HD2 H 1 7.245 . . 1 . . . . 86 HIS HD2 . 25919 1 1148 . 1 1 86 86 HIS CA C 13 53.890 . . 1 . . . . 86 HIS CA . 25919 1 1149 . 1 1 86 86 HIS CB C 13 30.888 . . 1 . . . . 86 HIS CB . 25919 1 1150 . 1 1 86 86 HIS CD2 C 13 121.408 . . 1 . . . . 86 HIS CD2 . 25919 1 1151 . 1 1 86 86 HIS N N 15 117.905 . . 1 . . . . 86 HIS N . 25919 1 1152 . 1 1 87 87 SER H H 1 8.927 . . 1 . . . . 87 SER H . 25919 1 1153 . 1 1 87 87 SER HA H 1 4.397 . . 1 . . . . 87 SER HA . 25919 1 1154 . 1 1 87 87 SER HB2 H 1 3.894 . . 2 . . . . 87 SER HB2 . 25919 1 1155 . 1 1 87 87 SER HB3 H 1 3.894 . . 2 . . . . 87 SER HB3 . 25919 1 1156 . 1 1 87 87 SER C C 13 175.275 . . 1 . . . . 87 SER C . 25919 1 1157 . 1 1 87 87 SER CA C 13 58.414 . . 1 . . . . 87 SER CA . 25919 1 1158 . 1 1 87 87 SER CB C 13 63.772 . . 1 . . . . 87 SER CB . 25919 1 1159 . 1 1 87 87 SER N N 15 118.646 . . 1 . . . . 87 SER N . 25919 1 1160 . 1 1 88 88 MET H H 1 9.088 . . 1 . . . . 88 MET H . 25919 1 1161 . 1 1 88 88 MET HA H 1 4.851 . . 1 . . . . 88 MET HA . 25919 1 1162 . 1 1 88 88 MET HB2 H 1 2.011 . . 2 . . . . 88 MET HB2 . 25919 1 1163 . 1 1 88 88 MET HB3 H 1 2.158 . . 2 . . . . 88 MET HB3 . 25919 1 1164 . 1 1 88 88 MET HG2 H 1 2.628 . . 2 . . . . 88 MET HG2 . 25919 1 1165 . 1 1 88 88 MET HG3 H 1 2.628 . . 2 . . . . 88 MET HG3 . 25919 1 1166 . 1 1 88 88 MET C C 13 178.796 . . 1 . . . . 88 MET C . 25919 1 1167 . 1 1 88 88 MET CA C 13 54.727 . . 1 . . . . 88 MET CA . 25919 1 1168 . 1 1 88 88 MET CB C 13 33.309 . . 1 . . . . 88 MET CB . 25919 1 1169 . 1 1 88 88 MET CG C 13 32.674 . . 1 . . . . 88 MET CG . 25919 1 1170 . 1 1 88 88 MET CE C 13 18.593 . . 1 . . . . 88 MET CE . 25919 1 1171 . 1 1 88 88 MET N N 15 126.013 . . 1 . . . . 88 MET N . 25919 1 1172 . 1 1 89 89 VAL H H 1 8.144 . . 1 . . . . 89 VAL H . 25919 1 1173 . 1 1 89 89 VAL HA H 1 4.057 . . 1 . . . . 89 VAL HA . 25919 1 1174 . 1 1 89 89 VAL HB H 1 2.192 . . 1 . . . . 89 VAL HB . 25919 1 1175 . 1 1 89 89 VAL HG21 H 1 1.047 . . 2 . . . . 89 VAL MG2 . 25919 1 1176 . 1 1 89 89 VAL HG22 H 1 1.047 . . 2 . . . . 89 VAL MG2 . 25919 1 1177 . 1 1 89 89 VAL HG23 H 1 1.047 . . 2 . . . . 89 VAL MG2 . 25919 1 1178 . 1 1 89 89 VAL C C 13 176.695 . . 1 . . . . 89 VAL C . 25919 1 1179 . 1 1 89 89 VAL CA C 13 63.592 . . 1 . . . . 89 VAL CA . 25919 1 1180 . 1 1 89 89 VAL CB C 13 32.422 . . 1 . . . . 89 VAL CB . 25919 1 1181 . 1 1 89 89 VAL CG1 C 13 21.099 . . 2 . . . . 89 VAL CG1 . 25919 1 1182 . 1 1 89 89 VAL CG2 C 13 21.099 . . 2 . . . . 89 VAL CG2 . 25919 1 1183 . 1 1 89 89 VAL N N 15 121.153 . . 1 . . . . 89 VAL N . 25919 1 1184 . 1 1 90 90 SER H H 1 8.322 . . 1 . . . . 90 SER H . 25919 1 1185 . 1 1 90 90 SER HA H 1 4.561 . . 1 . . . . 90 SER HA . 25919 1 1186 . 1 1 90 90 SER HB2 H 1 3.934 . . 2 . . . . 90 SER HB2 . 25919 1 1187 . 1 1 90 90 SER HB3 H 1 4.043 . . 2 . . . . 90 SER HB3 . 25919 1 1188 . 1 1 90 90 SER C C 13 173.898 . . 1 . . . . 90 SER C . 25919 1 1189 . 1 1 90 90 SER CA C 13 57.895 . . 1 . . . . 90 SER CA . 25919 1 1190 . 1 1 90 90 SER CB C 13 63.133 . . 1 . . . . 90 SER CB . 25919 1 1191 . 1 1 90 90 SER N N 15 116.778 . . 1 . . . . 90 SER N . 25919 1 1192 . 1 1 91 91 VAL H H 1 8.036 . . 1 . . . . 91 VAL H . 25919 1 1193 . 1 1 91 91 VAL HA H 1 4.286 . . 1 . . . . 91 VAL HA . 25919 1 1194 . 1 1 91 91 VAL HB H 1 2.275 . . 1 . . . . 91 VAL HB . 25919 1 1195 . 1 1 91 91 VAL HG21 H 1 1.041 . . 2 . . . . 91 VAL MG2 . 25919 1 1196 . 1 1 91 91 VAL HG22 H 1 1.041 . . 2 . . . . 91 VAL MG2 . 25919 1 1197 . 1 1 91 91 VAL HG23 H 1 1.041 . . 2 . . . . 91 VAL MG2 . 25919 1 1198 . 1 1 91 91 VAL CA C 13 62.846 . . 1 . . . . 91 VAL CA . 25919 1 1199 . 1 1 91 91 VAL CB C 13 32.069 . . 1 . . . . 91 VAL CB . 25919 1 1200 . 1 1 91 91 VAL CG1 C 13 19.561 . . 2 . . . . 91 VAL CG1 . 25919 1 1201 . 1 1 91 91 VAL CG2 C 13 21.577 . . 2 . . . . 91 VAL CG2 . 25919 1 1202 . 1 1 91 91 VAL N N 15 120.735 . . 1 . . . . 91 VAL N . 25919 1 1203 . 1 1 92 92 SER H H 1 8.470 . . 1 . . . . 92 SER H . 25919 1 1204 . 1 1 92 92 SER HA H 1 4.549 . . 1 . . . . 92 SER HA . 25919 1 1205 . 1 1 92 92 SER HB2 H 1 3.896 . . 2 . . . . 92 SER HB2 . 25919 1 1206 . 1 1 92 92 SER HB3 H 1 4.016 . . 2 . . . . 92 SER HB3 . 25919 1 1207 . 1 1 92 92 SER CA C 13 57.813 . . 1 . . . . 92 SER CA . 25919 1 1208 . 1 1 92 92 SER CB C 13 63.488 . . 1 . . . . 92 SER CB . 25919 1 1209 . 1 1 92 92 SER N N 15 118.146 . . 1 . . . . 92 SER N . 25919 1 1210 . 1 1 93 93 THR H H 1 7.382 . . 1 . . . . 93 THR H . 25919 1 1211 . 1 1 93 93 THR HA H 1 4.467 . . 1 . . . . 93 THR HA . 25919 1 1212 . 1 1 93 93 THR HB H 1 3.812 . . 1 . . . . 93 THR HB . 25919 1 1213 . 1 1 93 93 THR HG21 H 1 1.414 . . 1 . . . . 93 THR MG . 25919 1 1214 . 1 1 93 93 THR HG22 H 1 1.414 . . 1 . . . . 93 THR MG . 25919 1 1215 . 1 1 93 93 THR HG23 H 1 1.414 . . 1 . . . . 93 THR MG . 25919 1 1216 . 1 1 93 93 THR CA C 13 61.005 . . 1 . . . . 93 THR CA . 25919 1 1217 . 1 1 93 93 THR CB C 13 70.592 . . 1 . . . . 93 THR CB . 25919 1 1218 . 1 1 93 93 THR CG2 C 13 22.133 . . 1 . . . . 93 THR CG2 . 25919 1 1219 . 1 1 93 93 THR N N 15 119.747 . . 1 . . . . 93 THR N . 25919 1 1220 . 1 1 94 94 PRO HA H 1 4.424 . . 1 . . . . 94 PRO HA . 25919 1 1221 . 1 1 94 94 PRO HB2 H 1 2.108 . . 2 . . . . 94 PRO HB2 . 25919 1 1222 . 1 1 94 94 PRO HB3 H 1 2.468 . . 2 . . . . 94 PRO HB3 . 25919 1 1223 . 1 1 94 94 PRO HG2 H 1 2.118 . . 2 . . . . 94 PRO HG2 . 25919 1 1224 . 1 1 94 94 PRO HG3 H 1 2.159 . . 2 . . . . 94 PRO HG3 . 25919 1 1225 . 1 1 94 94 PRO HD2 H 1 3.812 . . 2 . . . . 94 PRO HD2 . 25919 1 1226 . 1 1 94 94 PRO HD3 H 1 4.074 . . 2 . . . . 94 PRO HD3 . 25919 1 1227 . 1 1 94 94 PRO CA C 13 63.060 . . 1 . . . . 94 PRO CA . 25919 1 1228 . 1 1 94 94 PRO CB C 13 32.798 . . 1 . . . . 94 PRO CB . 25919 1 1229 . 1 1 94 94 PRO CG C 13 28.178 . . 1 . . . . 94 PRO CG . 25919 1 1230 . 1 1 94 94 PRO CD C 13 51.727 . . 1 . . . . 94 PRO CD . 25919 1 1231 . 1 1 95 95 ILE H H 1 9.358 . . 1 . . . . 95 ILE H . 25919 1 1232 . 1 1 95 95 ILE HA H 1 3.984 . . 1 . . . . 95 ILE HA . 25919 1 1233 . 1 1 95 95 ILE HB H 1 1.756 . . 1 . . . . 95 ILE HB . 25919 1 1234 . 1 1 95 95 ILE HG12 H 1 1.198 . . 2 . . . . 95 ILE HG12 . 25919 1 1235 . 1 1 95 95 ILE HG13 H 1 1.375 . . 2 . . . . 95 ILE HG13 . 25919 1 1236 . 1 1 95 95 ILE HG21 H 1 0.911 . . 1 . . . . 95 ILE MG . 25919 1 1237 . 1 1 95 95 ILE HG22 H 1 0.911 . . 1 . . . . 95 ILE MG . 25919 1 1238 . 1 1 95 95 ILE HG23 H 1 0.911 . . 1 . . . . 95 ILE MG . 25919 1 1239 . 1 1 95 95 ILE HD11 H 1 0.693 . . 1 . . . . 95 ILE MD . 25919 1 1240 . 1 1 95 95 ILE HD12 H 1 0.693 . . 1 . . . . 95 ILE MD . 25919 1 1241 . 1 1 95 95 ILE HD13 H 1 0.693 . . 1 . . . . 95 ILE MD . 25919 1 1242 . 1 1 95 95 ILE CA C 13 63.963 . . 1 . . . . 95 ILE CA . 25919 1 1243 . 1 1 95 95 ILE CB C 13 38.200 . . 1 . . . . 95 ILE CB . 25919 1 1244 . 1 1 95 95 ILE CG1 C 13 29.374 . . 1 . . . . 95 ILE CG1 . 25919 1 1245 . 1 1 95 95 ILE CG2 C 13 18.034 . . 1 . . . . 95 ILE CG2 . 25919 1 1246 . 1 1 95 95 ILE CD1 C 13 14.619 . . 1 . . . . 95 ILE CD1 . 25919 1 1247 . 1 1 95 95 ILE N N 15 124.894 . . 1 . . . . 95 ILE N . 25919 1 1248 . 1 1 96 96 SER H H 1 8.202 . . 1 . . . . 96 SER H . 25919 1 1249 . 1 1 96 96 SER HA H 1 4.004 . . 1 . . . . 96 SER HA . 25919 1 1250 . 1 1 96 96 SER HB2 H 1 4.016 . . 2 . . . . 96 SER HB2 . 25919 1 1251 . 1 1 96 96 SER HB3 H 1 4.016 . . 2 . . . . 96 SER HB3 . 25919 1 1252 . 1 1 96 96 SER CA C 13 61.700 . . 1 . . . . 96 SER CA . 25919 1 1253 . 1 1 96 96 SER CB C 13 61.400 . . 1 . . . . 96 SER CB . 25919 1 1254 . 1 1 96 96 SER N N 15 117.523 . . 1 . . . . 96 SER N . 25919 1 1255 . 1 1 97 97 GLU H H 1 7.301 . . 1 . . . . 97 GLU H . 25919 1 1256 . 1 1 97 97 GLU HA H 1 4.282 . . 1 . . . . 97 GLU HA . 25919 1 1257 . 1 1 97 97 GLU HB2 H 1 2.107 . . 2 . . . . 97 GLU HB2 . 25919 1 1258 . 1 1 97 97 GLU HB3 H 1 2.151 . . 2 . . . . 97 GLU HB3 . 25919 1 1259 . 1 1 97 97 GLU HG2 H 1 2.267 . . 2 . . . . 97 GLU HG2 . 25919 1 1260 . 1 1 97 97 GLU HG3 H 1 2.367 . . 2 . . . . 97 GLU HG3 . 25919 1 1261 . 1 1 97 97 GLU CA C 13 58.700 . . 1 . . . . 97 GLU CA . 25919 1 1262 . 1 1 97 97 GLU CB C 13 29.800 . . 1 . . . . 97 GLU CB . 25919 1 1263 . 1 1 97 97 GLU CG C 13 36.510 . . 1 . . . . 97 GLU CG . 25919 1 1264 . 1 1 97 97 GLU N N 15 123.657 . . 1 . . . . 97 GLU N . 25919 1 1265 . 1 1 98 98 VAL H H 1 7.410 . . 1 . . . . 98 VAL H . 25919 1 1266 . 1 1 98 98 VAL HA H 1 3.797 . . 1 . . . . 98 VAL HA . 25919 1 1267 . 1 1 98 98 VAL HB H 1 2.165 . . 1 . . . . 98 VAL HB . 25919 1 1268 . 1 1 98 98 VAL HG21 H 1 1.068 . . 2 . . . . 98 VAL MG2 . 25919 1 1269 . 1 1 98 98 VAL HG22 H 1 1.068 . . 2 . . . . 98 VAL MG2 . 25919 1 1270 . 1 1 98 98 VAL HG23 H 1 1.068 . . 2 . . . . 98 VAL MG2 . 25919 1 1271 . 1 1 98 98 VAL CA C 13 65.949 . . 1 . . . . 98 VAL CA . 25919 1 1272 . 1 1 98 98 VAL CB C 13 32.186 . . 1 . . . . 98 VAL CB . 25919 1 1273 . 1 1 98 98 VAL CG1 C 13 21.800 . . 2 . . . . 98 VAL CG1 . 25919 1 1274 . 1 1 98 98 VAL CG2 C 13 22.126 . . 2 . . . . 98 VAL CG2 . 25919 1 1275 . 1 1 98 98 VAL N N 15 121.907 . . 1 . . . . 98 VAL N . 25919 1 1276 . 1 1 99 99 TYR H H 1 9.071 . . 1 . . . . 99 TYR H . 25919 1 1277 . 1 1 99 99 TYR HA H 1 4.016 . . 1 . . . . 99 TYR HA . 25919 1 1278 . 1 1 99 99 TYR HB2 H 1 3.037 . . 2 . . . . 99 TYR HB2 . 25919 1 1279 . 1 1 99 99 TYR HB3 H 1 3.158 . . 2 . . . . 99 TYR HB3 . 25919 1 1280 . 1 1 99 99 TYR HD1 H 1 7.108 . . 3 . . . . 99 TYR HD1 . 25919 1 1281 . 1 1 99 99 TYR HD2 H 1 7.108 . . 3 . . . . 99 TYR HD2 . 25919 1 1282 . 1 1 99 99 TYR HE1 H 1 6.905 . . 3 . . . . 99 TYR HE1 . 25919 1 1283 . 1 1 99 99 TYR HE2 H 1 6.905 . . 3 . . . . 99 TYR HE2 . 25919 1 1284 . 1 1 99 99 TYR C C 13 175.741 . . 1 . . . . 99 TYR C . 25919 1 1285 . 1 1 99 99 TYR CA C 13 62.229 . . 1 . . . . 99 TYR CA . 25919 1 1286 . 1 1 99 99 TYR CB C 13 38.967 . . 1 . . . . 99 TYR CB . 25919 1 1287 . 1 1 99 99 TYR CD1 C 13 133.783 . . 3 . . . . 99 TYR CD1 . 25919 1 1288 . 1 1 99 99 TYR CD2 C 13 133.783 . . 3 . . . . 99 TYR CD2 . 25919 1 1289 . 1 1 99 99 TYR CE1 C 13 118.033 . . 3 . . . . 99 TYR CE1 . 25919 1 1290 . 1 1 99 99 TYR CE2 C 13 118.033 . . 3 . . . . 99 TYR CE2 . 25919 1 1291 . 1 1 99 99 TYR N N 15 119.526 . . 1 . . . . 99 TYR N . 25919 1 1292 . 1 1 100 100 GLU H H 1 7.342 . . 1 . . . . 100 GLU H . 25919 1 1293 . 1 1 100 100 GLU HA H 1 3.850 . . 1 . . . . 100 GLU HA . 25919 1 1294 . 1 1 100 100 GLU HB2 H 1 2.136 . . 2 . . . . 100 GLU HB2 . 25919 1 1295 . 1 1 100 100 GLU HB3 H 1 2.136 . . 2 . . . . 100 GLU HB3 . 25919 1 1296 . 1 1 100 100 GLU HG2 H 1 2.494 . . 2 . . . . 100 GLU HG2 . 25919 1 1297 . 1 1 100 100 GLU HG3 H 1 2.494 . . 2 . . . . 100 GLU HG3 . 25919 1 1298 . 1 1 100 100 GLU C C 13 178.094 . . 1 . . . . 100 GLU C . 25919 1 1299 . 1 1 100 100 GLU CA C 13 58.920 . . 1 . . . . 100 GLU CA . 25919 1 1300 . 1 1 100 100 GLU CB C 13 29.481 . . 1 . . . . 100 GLU CB . 25919 1 1301 . 1 1 100 100 GLU CG C 13 35.630 . . 1 . . . . 100 GLU CG . 25919 1 1302 . 1 1 100 100 GLU N N 15 114.405 . . 1 . . . . 100 GLU N . 25919 1 1303 . 1 1 101 101 SER H H 1 7.410 . . 1 . . . . 101 SER H . 25919 1 1304 . 1 1 101 101 SER HA H 1 4.529 . . 1 . . . . 101 SER HA . 25919 1 1305 . 1 1 101 101 SER HB2 H 1 3.989 . . 2 . . . . 101 SER HB2 . 25919 1 1306 . 1 1 101 101 SER HB3 H 1 3.989 . . 2 . . . . 101 SER HB3 . 25919 1 1307 . 1 1 101 101 SER C C 13 176.681 . . 1 . . . . 101 SER C . 25919 1 1308 . 1 1 101 101 SER CA C 13 60.313 . . 1 . . . . 101 SER CA . 25919 1 1309 . 1 1 101 101 SER CB C 13 64.703 . . 1 . . . . 101 SER CB . 25919 1 1310 . 1 1 101 101 SER N N 15 109.656 . . 1 . . . . 101 SER N . 25919 1 1311 . 1 1 102 102 GLU H H 1 8.500 . . 1 . . . . 102 GLU H . 25919 1 1312 . 1 1 102 102 GLU HA H 1 4.721 . . 1 . . . . 102 GLU HA . 25919 1 1313 . 1 1 102 102 GLU HB2 H 1 1.658 . . 2 . . . . 102 GLU HB2 . 25919 1 1314 . 1 1 102 102 GLU HB3 H 1 2.272 . . 2 . . . . 102 GLU HB3 . 25919 1 1315 . 1 1 102 102 GLU HG2 H 1 2.246 . . 2 . . . . 102 GLU HG2 . 25919 1 1316 . 1 1 102 102 GLU HG3 H 1 2.398 . . 2 . . . . 102 GLU HG3 . 25919 1 1317 . 1 1 102 102 GLU CA C 13 55.592 . . 1 . . . . 102 GLU CA . 25919 1 1318 . 1 1 102 102 GLU CB C 13 30.564 . . 1 . . . . 102 GLU CB . 25919 1 1319 . 1 1 102 102 GLU CG C 13 35.035 . . 1 . . . . 102 GLU CG . 25919 1 1320 . 1 1 102 102 GLU N N 15 117.283 . . 1 . . . . 102 GLU N . 25919 1 1321 . 1 1 103 103 LYS H H 1 7.777 . . 1 . . . . 103 LYS H . 25919 1 1322 . 1 1 103 103 LYS HA H 1 4.179 . . 1 . . . . 103 LYS HA . 25919 1 1323 . 1 1 103 103 LYS HB2 H 1 1.291 . . 2 . . . . 103 LYS HB2 . 25919 1 1324 . 1 1 103 103 LYS HB3 H 1 1.445 . . 2 . . . . 103 LYS HB3 . 25919 1 1325 . 1 1 103 103 LYS HG2 H 1 1.038 . . 2 . . . . 103 LYS HG2 . 25919 1 1326 . 1 1 103 103 LYS HG3 H 1 1.038 . . 2 . . . . 103 LYS HG3 . 25919 1 1327 . 1 1 103 103 LYS HD2 H 1 0.570 . . 2 . . . . 103 LYS HD2 . 25919 1 1328 . 1 1 103 103 LYS HD3 H 1 1.114 . . 2 . . . . 103 LYS HD3 . 25919 1 1329 . 1 1 103 103 LYS HE2 H 1 2.708 . . 2 . . . . 103 LYS HE2 . 25919 1 1330 . 1 1 103 103 LYS HE3 H 1 2.761 . . 2 . . . . 103 LYS HE3 . 25919 1 1331 . 1 1 103 103 LYS C C 13 175.032 . . 1 . . . . 103 LYS C . 25919 1 1332 . 1 1 103 103 LYS CA C 13 57.154 . . 1 . . . . 103 LYS CA . 25919 1 1333 . 1 1 103 103 LYS CB C 13 32.238 . . 1 . . . . 103 LYS CB . 25919 1 1334 . 1 1 103 103 LYS CG C 13 22.612 . . 1 . . . . 103 LYS CG . 25919 1 1335 . 1 1 103 103 LYS CD C 13 29.129 . . 1 . . . . 103 LYS CD . 25919 1 1336 . 1 1 103 103 LYS CE C 13 42.335 . . 1 . . . . 103 LYS CE . 25919 1 1337 . 1 1 103 103 LYS N N 15 118.772 . . 1 . . . . 103 LYS N . 25919 1 1338 . 1 1 104 104 ASP H H 1 9.030 . . 1 . . . . 104 ASP H . 25919 1 1339 . 1 1 104 104 ASP HA H 1 5.032 . . 1 . . . . 104 ASP HA . 25919 1 1340 . 1 1 104 104 ASP HB2 H 1 3.213 . . 2 . . . . 104 ASP HB2 . 25919 1 1341 . 1 1 104 104 ASP HB3 H 1 3.900 . . 2 . . . . 104 ASP HB3 . 25919 1 1342 . 1 1 104 104 ASP C C 13 177.548 . . 1 . . . . 104 ASP C . 25919 1 1343 . 1 1 104 104 ASP CA C 13 53.882 . . 1 . . . . 104 ASP CA . 25919 1 1344 . 1 1 104 104 ASP CB C 13 43.420 . . 1 . . . . 104 ASP CB . 25919 1 1345 . 1 1 104 104 ASP N N 15 124.024 . . 1 . . . . 104 ASP N . 25919 1 1346 . 1 1 105 105 GLU H H 1 8.894 . . 1 . . . . 105 GLU H . 25919 1 1347 . 1 1 105 105 GLU HA H 1 4.179 . . 1 . . . . 105 GLU HA . 25919 1 1348 . 1 1 105 105 GLU HB2 H 1 2.208 . . 2 . . . . 105 GLU HB2 . 25919 1 1349 . 1 1 105 105 GLU HB3 H 1 2.208 . . 2 . . . . 105 GLU HB3 . 25919 1 1350 . 1 1 105 105 GLU HG2 H 1 2.506 . . 2 . . . . 105 GLU HG2 . 25919 1 1351 . 1 1 105 105 GLU HG3 H 1 2.506 . . 2 . . . . 105 GLU HG3 . 25919 1 1352 . 1 1 105 105 GLU CA C 13 59.526 . . 1 . . . . 105 GLU CA . 25919 1 1353 . 1 1 105 105 GLU CB C 13 30.036 . . 1 . . . . 105 GLU CB . 25919 1 1354 . 1 1 105 105 GLU CG C 13 36.569 . . 1 . . . . 105 GLU CG . 25919 1 1355 . 1 1 105 105 GLU N N 15 125.669 . . 1 . . . . 105 GLU N . 25919 1 1356 . 1 1 106 106 ASP H H 1 9.838 . . 1 . . . . 106 ASP H . 25919 1 1357 . 1 1 106 106 ASP HA H 1 4.180 . . 1 . . . . 106 ASP HA . 25919 1 1358 . 1 1 106 106 ASP HB2 H 1 2.653 . . 2 . . . . 106 ASP HB2 . 25919 1 1359 . 1 1 106 106 ASP HB3 H 1 2.840 . . 2 . . . . 106 ASP HB3 . 25919 1 1360 . 1 1 106 106 ASP C C 13 176.018 . . 1 . . . . 106 ASP C . 25919 1 1361 . 1 1 106 106 ASP CA C 13 54.750 . . 1 . . . . 106 ASP CA . 25919 1 1362 . 1 1 106 106 ASP CB C 13 40.250 . . 1 . . . . 106 ASP CB . 25919 1 1363 . 1 1 106 106 ASP N N 15 119.257 . . 1 . . . . 106 ASP N . 25919 1 1364 . 1 1 107 107 GLY H H 1 7.945 . . 1 . . . . 107 GLY H . 25919 1 1365 . 1 1 107 107 GLY HA2 H 1 3.388 . . 2 . . . . 107 GLY HA2 . 25919 1 1366 . 1 1 107 107 GLY HA3 H 1 4.453 . . 2 . . . . 107 GLY HA3 . 25919 1 1367 . 1 1 107 107 GLY CA C 13 45.125 . . 1 . . . . 107 GLY CA . 25919 1 1368 . 1 1 107 107 GLY N N 15 106.307 . . 1 . . . . 107 GLY N . 25919 1 1369 . 1 1 108 108 PHE H H 1 9.739 . . 1 . . . . 108 PHE H . 25919 1 1370 . 1 1 108 108 PHE HA H 1 4.670 . . 1 . . . . 108 PHE HA . 25919 1 1371 . 1 1 108 108 PHE HB2 H 1 2.082 . . 2 . . . . 108 PHE HB2 . 25919 1 1372 . 1 1 108 108 PHE HB3 H 1 3.531 . . 2 . . . . 108 PHE HB3 . 25919 1 1373 . 1 1 108 108 PHE HD1 H 1 7.103 . . 3 . . . . 108 PHE HD1 . 25919 1 1374 . 1 1 108 108 PHE HD2 H 1 7.103 . . 3 . . . . 108 PHE HD2 . 25919 1 1375 . 1 1 108 108 PHE HE1 H 1 7.276 . . 3 . . . . 108 PHE HE1 . 25919 1 1376 . 1 1 108 108 PHE HE2 H 1 7.276 . . 3 . . . . 108 PHE HE2 . 25919 1 1377 . 1 1 108 108 PHE C C 13 179.501 . . 1 . . . . 108 PHE C . 25919 1 1378 . 1 1 108 108 PHE CA C 13 60.288 . . 1 . . . . 108 PHE CA . 25919 1 1379 . 1 1 108 108 PHE CB C 13 40.506 . . 1 . . . . 108 PHE CB . 25919 1 1380 . 1 1 108 108 PHE CD1 C 13 131.908 . . 3 . . . . 108 PHE CD1 . 25919 1 1381 . 1 1 108 108 PHE CD2 C 13 131.908 . . 3 . . . . 108 PHE CD2 . 25919 1 1382 . 1 1 108 108 PHE CE1 C 13 130.408 . . 3 . . . . 108 PHE CE1 . 25919 1 1383 . 1 1 108 108 PHE CE2 C 13 130.408 . . 3 . . . . 108 PHE CE2 . 25919 1 1384 . 1 1 108 108 PHE N N 15 124.389 . . 1 . . . . 108 PHE N . 25919 1 1385 . 1 1 109 109 LEU H H 1 7.968 . . 1 . . . . 109 LEU H . 25919 1 1386 . 1 1 109 109 LEU HA H 1 5.038 . . 1 . . . . 109 LEU HA . 25919 1 1387 . 1 1 109 109 LEU HB2 H 1 1.491 . . 2 . . . . 109 LEU HB2 . 25919 1 1388 . 1 1 109 109 LEU HB3 H 1 2.280 . . 2 . . . . 109 LEU HB3 . 25919 1 1389 . 1 1 109 109 LEU HG H 1 1.500 . . 1 . . . . 109 LEU HG . 25919 1 1390 . 1 1 109 109 LEU HD11 H 1 0.843 . . 2 . . . . 109 LEU MD1 . 25919 1 1391 . 1 1 109 109 LEU HD12 H 1 0.843 . . 2 . . . . 109 LEU MD1 . 25919 1 1392 . 1 1 109 109 LEU HD13 H 1 0.843 . . 2 . . . . 109 LEU MD1 . 25919 1 1393 . 1 1 109 109 LEU HD21 H 1 0.953 . . 2 . . . . 109 LEU MD2 . 25919 1 1394 . 1 1 109 109 LEU HD22 H 1 0.953 . . 2 . . . . 109 LEU MD2 . 25919 1 1395 . 1 1 109 109 LEU HD23 H 1 0.953 . . 2 . . . . 109 LEU MD2 . 25919 1 1396 . 1 1 109 109 LEU CA C 13 53.479 . . 1 . . . . 109 LEU CA . 25919 1 1397 . 1 1 109 109 LEU CB C 13 45.197 . . 1 . . . . 109 LEU CB . 25919 1 1398 . 1 1 109 109 LEU CG C 13 27.232 . . 1 . . . . 109 LEU CG . 25919 1 1399 . 1 1 109 109 LEU CD1 C 13 26.700 . . 2 . . . . 109 LEU CD1 . 25919 1 1400 . 1 1 109 109 LEU CD2 C 13 24.690 . . 2 . . . . 109 LEU CD2 . 25919 1 1401 . 1 1 109 109 LEU N N 15 120.814 . . 1 . . . . 109 LEU N . 25919 1 1402 . 1 1 110 110 TYR H H 1 9.349 . . 1 . . . . 110 TYR H . 25919 1 1403 . 1 1 110 110 TYR HA H 1 4.907 . . 1 . . . . 110 TYR HA . 25919 1 1404 . 1 1 110 110 TYR HB2 H 1 2.947 . . 2 . . . . 110 TYR HB2 . 25919 1 1405 . 1 1 110 110 TYR HB3 H 1 3.058 . . 2 . . . . 110 TYR HB3 . 25919 1 1406 . 1 1 110 110 TYR HD1 H 1 7.345 . . 3 . . . . 110 TYR HD1 . 25919 1 1407 . 1 1 110 110 TYR HD2 H 1 7.345 . . 3 . . . . 110 TYR HD2 . 25919 1 1408 . 1 1 110 110 TYR HE1 H 1 7.257 . . 3 . . . . 110 TYR HE1 . 25919 1 1409 . 1 1 110 110 TYR HE2 H 1 7.257 . . 3 . . . . 110 TYR HE2 . 25919 1 1410 . 1 1 110 110 TYR CA C 13 59.259 . . 1 . . . . 110 TYR CA . 25919 1 1411 . 1 1 110 110 TYR CB C 13 39.469 . . 1 . . . . 110 TYR CB . 25919 1 1412 . 1 1 110 110 TYR CD1 C 13 132.845 . . 3 . . . . 110 TYR CD1 . 25919 1 1413 . 1 1 110 110 TYR CD2 C 13 132.845 . . 3 . . . . 110 TYR CD2 . 25919 1 1414 . 1 1 110 110 TYR CE1 C 13 119.345 . . 3 . . . . 110 TYR CE1 . 25919 1 1415 . 1 1 110 110 TYR CE2 C 13 119.345 . . 3 . . . . 110 TYR CE2 . 25919 1 1416 . 1 1 110 110 TYR N N 15 127.403 . . 1 . . . . 110 TYR N . 25919 1 1417 . 1 1 111 111 MET H H 1 9.575 . . 1 . . . . 111 MET H . 25919 1 1418 . 1 1 111 111 MET HA H 1 5.543 . . 1 . . . . 111 MET HA . 25919 1 1419 . 1 1 111 111 MET HB2 H 1 1.958 . . 2 . . . . 111 MET HB2 . 25919 1 1420 . 1 1 111 111 MET HB3 H 1 1.958 . . 2 . . . . 111 MET HB3 . 25919 1 1421 . 1 1 111 111 MET HG2 H 1 2.452 . . 2 . . . . 111 MET HG2 . 25919 1 1422 . 1 1 111 111 MET HG3 H 1 2.452 . . 2 . . . . 111 MET HG3 . 25919 1 1423 . 1 1 111 111 MET CA C 13 54.341 . . 1 . . . . 111 MET CA . 25919 1 1424 . 1 1 111 111 MET CB C 13 36.894 . . 1 . . . . 111 MET CB . 25919 1 1425 . 1 1 111 111 MET CG C 13 33.578 . . 1 . . . . 111 MET CG . 25919 1 1426 . 1 1 111 111 MET CE C 13 19.131 . . 1 . . . . 111 MET CE . 25919 1 1427 . 1 1 111 111 MET N N 15 120.344 . . 1 . . . . 111 MET N . 25919 1 1428 . 1 1 112 112 VAL H H 1 8.730 . . 1 . . . . 112 VAL H . 25919 1 1429 . 1 1 112 112 VAL HA H 1 5.938 . . 1 . . . . 112 VAL HA . 25919 1 1430 . 1 1 112 112 VAL HB H 1 1.926 . . 1 . . . . 112 VAL HB . 25919 1 1431 . 1 1 112 112 VAL HG21 H 1 1.033 . . 2 . . . . 112 VAL MG2 . 25919 1 1432 . 1 1 112 112 VAL HG22 H 1 1.033 . . 2 . . . . 112 VAL MG2 . 25919 1 1433 . 1 1 112 112 VAL HG23 H 1 1.033 . . 2 . . . . 112 VAL MG2 . 25919 1 1434 . 1 1 112 112 VAL C C 13 176.696 . . 1 . . . . 112 VAL C . 25919 1 1435 . 1 1 112 112 VAL CA C 13 59.068 . . 1 . . . . 112 VAL CA . 25919 1 1436 . 1 1 112 112 VAL CB C 13 36.180 . . 1 . . . . 112 VAL CB . 25919 1 1437 . 1 1 112 112 VAL CG1 C 13 21.350 . . 2 . . . . 112 VAL CG1 . 25919 1 1438 . 1 1 112 112 VAL CG2 C 13 21.780 . . 2 . . . . 112 VAL CG2 . 25919 1 1439 . 1 1 112 112 VAL N N 15 121.026 . . 1 . . . . 112 VAL N . 25919 1 1440 . 1 1 113 113 TYR H H 1 8.172 . . 1 . . . . 113 TYR H . 25919 1 1441 . 1 1 113 113 TYR HA H 1 6.143 . . 1 . . . . 113 TYR HA . 25919 1 1442 . 1 1 113 113 TYR HB2 H 1 2.443 . . 2 . . . . 113 TYR HB2 . 25919 1 1443 . 1 1 113 113 TYR HB3 H 1 2.737 . . 2 . . . . 113 TYR HB3 . 25919 1 1444 . 1 1 113 113 TYR HD1 H 1 6.834 . . 3 . . . . 113 TYR HD1 . 25919 1 1445 . 1 1 113 113 TYR HD2 H 1 6.834 . . 3 . . . . 113 TYR HD2 . 25919 1 1446 . 1 1 113 113 TYR HE1 H 1 6.687 . . 3 . . . . 113 TYR HE1 . 25919 1 1447 . 1 1 113 113 TYR HE2 H 1 6.687 . . 3 . . . . 113 TYR HE2 . 25919 1 1448 . 1 1 113 113 TYR C C 13 173.533 . . 1 . . . . 113 TYR C . 25919 1 1449 . 1 1 113 113 TYR CA C 13 54.165 . . 1 . . . . 113 TYR CA . 25919 1 1450 . 1 1 113 113 TYR CB C 13 43.667 . . 1 . . . . 113 TYR CB . 25919 1 1451 . 1 1 113 113 TYR CD1 C 13 133.783 . . 3 . . . . 113 TYR CD1 . 25919 1 1452 . 1 1 113 113 TYR CD2 C 13 133.783 . . 3 . . . . 113 TYR CD2 . 25919 1 1453 . 1 1 113 113 TYR CE1 C 13 117.095 . . 3 . . . . 113 TYR CE1 . 25919 1 1454 . 1 1 113 113 TYR CE2 C 13 117.095 . . 3 . . . . 113 TYR CE2 . 25919 1 1455 . 1 1 113 113 TYR N N 15 119.995 . . 1 . . . . 113 TYR N . 25919 1 1456 . 1 1 114 114 ALA H H 1 8.499 . . 1 . . . . 114 ALA H . 25919 1 1457 . 1 1 114 114 ALA HA H 1 4.750 . . 1 . . . . 114 ALA HA . 25919 1 1458 . 1 1 114 114 ALA C C 13 176.007 . . 1 . . . . 114 ALA C . 25919 1 1459 . 1 1 114 114 ALA CA C 13 51.356 . . 1 . . . . 114 ALA CA . 25919 1 1460 . 1 1 114 114 ALA CB C 13 24.623 . . 1 . . . . 114 ALA CB . 25919 1 1461 . 1 1 114 114 ALA N N 15 120.454 . . 1 . . . . 114 ALA N . 25919 1 1462 . 1 1 115 115 SER H H 1 9.823 . . 1 . . . . 115 SER H . 25919 1 1463 . 1 1 115 115 SER HA H 1 4.505 . . 1 . . . . 115 SER HA . 25919 1 1464 . 1 1 115 115 SER HB2 H 1 3.893 . . 2 . . . . 115 SER HB2 . 25919 1 1465 . 1 1 115 115 SER HB3 H 1 4.316 . . 2 . . . . 115 SER HB3 . 25919 1 1466 . 1 1 115 115 SER C C 13 172.860 . . 1 . . . . 115 SER C . 25919 1 1467 . 1 1 115 115 SER CA C 13 58.837 . . 1 . . . . 115 SER CA . 25919 1 1468 . 1 1 115 115 SER CB C 13 63.798 . . 1 . . . . 115 SER CB . 25919 1 1469 . 1 1 115 115 SER N N 15 115.279 . . 1 . . . . 115 SER N . 25919 1 1470 . 1 1 116 116 GLN H H 1 7.165 . . 1 . . . . 116 GLN H . 25919 1 1471 . 1 1 116 116 GLN HA H 1 4.453 . . 1 . . . . 116 GLN HA . 25919 1 1472 . 1 1 116 116 GLN HB2 H 1 1.754 . . 2 . . . . 116 GLN HB2 . 25919 1 1473 . 1 1 116 116 GLN HB3 H 1 1.969 . . 2 . . . . 116 GLN HB3 . 25919 1 1474 . 1 1 116 116 GLN HG2 H 1 2.015 . . 2 . . . . 116 GLN HG2 . 25919 1 1475 . 1 1 116 116 GLN HG3 H 1 2.082 . . 2 . . . . 116 GLN HG3 . 25919 1 1476 . 1 1 116 116 GLN HE21 H 1 7.510 . . 2 . . . . 116 GLN HE21 . 25919 1 1477 . 1 1 116 116 GLN HE22 H 1 6.854 . . 2 . . . . 116 GLN HE22 . 25919 1 1478 . 1 1 116 116 GLN C C 13 173.181 . . 1 . . . . 116 GLN C . 25919 1 1479 . 1 1 116 116 GLN CA C 13 54.024 . . 1 . . . . 116 GLN CA . 25919 1 1480 . 1 1 116 116 GLN CB C 13 32.179 . . 1 . . . . 116 GLN CB . 25919 1 1481 . 1 1 116 116 GLN CG C 13 33.347 . . 1 . . . . 116 GLN CG . 25919 1 1482 . 1 1 116 116 GLN CD C 13 180.452 . . 1 . . . . 116 GLN CD . 25919 1 1483 . 1 1 116 116 GLN N N 15 117.398 . . 1 . . . . 116 GLN N . 25919 1 1484 . 1 1 116 116 GLN NE2 N 15 113.241 . . 1 . . . . 116 GLN NE2 . 25919 1 1485 . 1 1 117 117 GLU H H 1 7.873 . . 1 . . . . 117 GLU H . 25919 1 1486 . 1 1 117 117 GLU HA H 1 3.224 . . 1 . . . . 117 GLU HA . 25919 1 1487 . 1 1 117 117 GLU HB2 H 1 1.120 . . 2 . . . . 117 GLU HB2 . 25919 1 1488 . 1 1 117 117 GLU HB3 H 1 1.255 . . 2 . . . . 117 GLU HB3 . 25919 1 1489 . 1 1 117 117 GLU HG2 H 1 1.510 . . 2 . . . . 117 GLU HG2 . 25919 1 1490 . 1 1 117 117 GLU HG3 H 1 1.660 . . 2 . . . . 117 GLU HG3 . 25919 1 1491 . 1 1 117 117 GLU C C 13 175.451 . . 1 . . . . 117 GLU C . 25919 1 1492 . 1 1 117 117 GLU CA C 13 56.917 . . 1 . . . . 117 GLU CA . 25919 1 1493 . 1 1 117 117 GLU CB C 13 30.206 . . 1 . . . . 117 GLU CB . 25919 1 1494 . 1 1 117 117 GLU CG C 13 36.398 . . 1 . . . . 117 GLU CG . 25919 1 1495 . 1 1 117 117 GLU N N 15 118.885 . . 1 . . . . 117 GLU N . 25919 1 1496 . 1 1 118 118 THR H H 1 6.988 . . 1 . . . . 118 THR H . 25919 1 1497 . 1 1 118 118 THR HA H 1 4.074 . . 1 . . . . 118 THR HA . 25919 1 1498 . 1 1 118 118 THR HB H 1 3.921 . . 1 . . . . 118 THR HB . 25919 1 1499 . 1 1 118 118 THR HG21 H 1 0.911 . . 1 . . . . 118 THR MG . 25919 1 1500 . 1 1 118 118 THR HG22 H 1 0.911 . . 1 . . . . 118 THR MG . 25919 1 1501 . 1 1 118 118 THR HG23 H 1 0.911 . . 1 . . . . 118 THR MG . 25919 1 1502 . 1 1 118 118 THR C C 13 173.234 . . 1 . . . . 118 THR C . 25919 1 1503 . 1 1 118 118 THR CA C 13 60.300 . . 1 . . . . 118 THR CA . 25919 1 1504 . 1 1 118 118 THR CB C 13 70.118 . . 1 . . . . 118 THR CB . 25919 1 1505 . 1 1 118 118 THR CG2 C 13 21.250 . . 1 . . . . 118 THR CG2 . 25919 1 1506 . 1 1 118 118 THR N N 15 110.883 . . 1 . . . . 118 THR N . 25919 1 1507 . 1 1 119 119 PHE H H 1 8.122 . . 1 . . . . 119 PHE H . 25919 1 1508 . 1 1 119 119 PHE HA H 1 4.397 . . 1 . . . . 119 PHE HA . 25919 1 1509 . 1 1 119 119 PHE HB2 H 1 2.638 . . 2 . . . . 119 PHE HB2 . 25919 1 1510 . 1 1 119 119 PHE HB3 H 1 2.984 . . 2 . . . . 119 PHE HB3 . 25919 1 1511 . 1 1 119 119 PHE HD1 H 1 6.754 . . 3 . . . . 119 PHE HD1 . 25919 1 1512 . 1 1 119 119 PHE HD2 H 1 6.754 . . 3 . . . . 119 PHE HD2 . 25919 1 1513 . 1 1 119 119 PHE HE1 H 1 6.758 . . 3 . . . . 119 PHE HE1 . 25919 1 1514 . 1 1 119 119 PHE HE2 H 1 6.758 . . 3 . . . . 119 PHE HE2 . 25919 1 1515 . 1 1 119 119 PHE HZ H 1 6.768 . . 1 . . . . 119 PHE HZ . 25919 1 1516 . 1 1 119 119 PHE C C 13 175.045 . . 1 . . . . 119 PHE C . 25919 1 1517 . 1 1 119 119 PHE CA C 13 56.810 . . 1 . . . . 119 PHE CA . 25919 1 1518 . 1 1 119 119 PHE CB C 13 39.349 . . 1 . . . . 119 PHE CB . 25919 1 1519 . 1 1 119 119 PHE CD1 C 13 131.533 . . 3 . . . . 119 PHE CD1 . 25919 1 1520 . 1 1 119 119 PHE CD2 C 13 131.533 . . 3 . . . . 119 PHE CD2 . 25919 1 1521 . 1 1 119 119 PHE CE1 C 13 130.780 . . 3 . . . . 119 PHE CE1 . 25919 1 1522 . 1 1 119 119 PHE CE2 C 13 130.780 . . 3 . . . . 119 PHE CE2 . 25919 1 1523 . 1 1 119 119 PHE CZ C 13 129.283 . . 1 . . . . 119 PHE CZ . 25919 1 1524 . 1 1 119 119 PHE N N 15 122.773 . . 1 . . . . 119 PHE N . 25919 1 1525 . 1 1 120 120 GLY H H 1 7.845 . . 1 . . . . 120 GLY H . 25919 1 1526 . 1 1 120 120 GLY HA3 H 1 3.758 . . 2 . . . . 120 GLY HA3 . 25919 1 1527 . 1 1 120 120 GLY CA C 13 46.177 . . 1 . . . . 120 GLY CA . 25919 1 1528 . 1 1 120 120 GLY N N 15 116.195 . . 1 . . . . 120 GLY N . 25919 1 1529 . 2 2 2 2 TYR H H 1 8.216 . . 1 . . . B 11 TYR H . 25919 1 1530 . 2 2 2 2 TYR HA H 1 4.400 . . 1 . . . B 11 TYR HA . 25919 1 1531 . 2 2 2 2 TYR HD1 H 1 7.207 . . 3 . . . B 11 TYR HD1 . 25919 1 1532 . 2 2 2 2 TYR HD2 H 1 7.207 . . 3 . . . B 11 TYR HD2 . 25919 1 1533 . 2 2 2 2 TYR HE1 H 1 6.926 . . 3 . . . B 11 TYR HE1 . 25919 1 1534 . 2 2 2 2 TYR HE2 H 1 6.926 . . 3 . . . B 11 TYR HE2 . 25919 1 1535 . 2 2 3 3 GLU H H 1 8.245 . . 1 . . . B 12 GLU H . 25919 1 1536 . 2 2 3 3 GLU HA H 1 4.598 . . 1 . . . B 12 GLU HA . 25919 1 1537 . 2 2 3 3 GLU HB2 H 1 2.550 . . 2 . . . B 12 GLU HB2 . 25919 1 1538 . 2 2 3 3 GLU HB3 H 1 2.628 . . 2 . . . B 12 GLU HB3 . 25919 1 1539 . 2 2 3 3 GLU HG2 H 1 1.952 . . 2 . . . B 12 GLU HG2 . 25919 1 1540 . 2 2 3 3 GLU HG3 H 1 2.062 . . 2 . . . B 12 GLU HG3 . 25919 1 1541 . 2 2 4 4 SER H H 1 8.150 . . 1 . . . B 13 SER H . 25919 1 1542 . 2 2 4 4 SER HA H 1 4.420 . . 1 . . . B 13 SER HA . 25919 1 1543 . 2 2 4 4 SER HB2 H 1 4.430 . . 2 . . . B 13 SER HB2 . 25919 1 1544 . 2 2 4 4 SER HB3 H 1 4.450 . . 2 . . . B 13 SER HB3 . 25919 1 1545 . 2 2 5 5 ASP H H 1 8.434 . . 1 . . . B 14 ASP H . 25919 1 1546 . 2 2 5 5 ASP HA H 1 4.650 . . 1 . . . B 14 ASP HA . 25919 1 1547 . 2 2 5 5 ASP HB2 H 1 2.658 . . 2 . . . B 14 ASP HB2 . 25919 1 1548 . 2 2 5 5 ASP HB3 H 1 2.792 . . 2 . . . B 14 ASP HB3 . 25919 1 1549 . 2 2 6 6 ASP H H 1 8.301 . . 1 . . . B 15 ASP H . 25919 1 1550 . 2 2 6 6 ASP HA H 1 4.696 . . 1 . . . B 15 ASP HA . 25919 1 1551 . 2 2 6 6 ASP HB2 H 1 2.778 . . 2 . . . B 15 ASP HB2 . 25919 1 1552 . 2 2 6 6 ASP HB3 H 1 2.602 . . 2 . . . B 15 ASP HB3 . 25919 1 1553 . 2 2 7 7 ASP H H 1 8.361 . . 1 . . . B 16 ASP H . 25919 1 1554 . 2 2 7 7 ASP HA H 1 4.654 . . 1 . . . B 16 ASP HA . 25919 1 1555 . 2 2 7 7 ASP HB2 H 1 2.594 . . 2 . . . B 16 ASP HB2 . 25919 1 1556 . 2 2 7 7 ASP HB3 H 1 2.789 . . 2 . . . B 16 ASP HB3 . 25919 1 1557 . 2 2 9 9 TYR HA H 1 4.531 . . 1 . . . B 18 TYR HA . 25919 1 1558 . 2 2 9 9 TYR HB2 H 1 2.997 . . 2 . . . B 18 TYR HB2 . 25919 1 1559 . 2 2 9 9 TYR HB3 H 1 3.082 . . 2 . . . B 18 TYR HB3 . 25919 1 1560 . 2 2 9 9 TYR HD1 H 1 7.130 . . 3 . . . B 18 TYR HD1 . 25919 1 1561 . 2 2 9 9 TYR HD2 H 1 7.130 . . 3 . . . B 18 TYR HD2 . 25919 1 1562 . 2 2 9 9 TYR HE1 H 1 6.838 . . 3 . . . B 18 TYR HE1 . 25919 1 1563 . 2 2 9 9 TYR HE2 H 1 6.838 . . 3 . . . B 18 TYR HE2 . 25919 1 1564 . 2 2 9 9 TYR HH H 1 6.782 . . 1 . . . B 18 TYR HH . 25919 1 1565 . 2 2 10 10 GLU H H 1 8.413 . . 1 . . . B 19 GLU H . 25919 1 1566 . 2 2 10 10 GLU HA H 1 4.270 . . 1 . . . B 19 GLU HA . 25919 1 1567 . 2 2 10 10 GLU HB2 H 1 1.901 . . 2 . . . B 19 GLU HB2 . 25919 1 1568 . 2 2 10 10 GLU HB3 H 1 2.009 . . 2 . . . B 19 GLU HB3 . 25919 1 1569 . 2 2 10 10 GLU HG3 H 1 2.235 . . 2 . . . B 19 GLU HG3 . 25919 1 1570 . 2 2 11 11 VAL H H 1 8.870 . . 1 . . . B 20 VAL H . 25919 1 1571 . 2 2 11 11 VAL HA H 1 4.306 . . 1 . . . B 20 VAL HA . 25919 1 1572 . 2 2 11 11 VAL HB H 1 2.041 . . 1 . . . B 20 VAL HB . 25919 1 1573 . 2 2 11 11 VAL HG11 H 1 0.800 . . 2 . . . B 20 VAL HG11 . 25919 1 1574 . 2 2 11 11 VAL HG12 H 1 0.800 . . 2 . . . B 20 VAL HG12 . 25919 1 1575 . 2 2 11 11 VAL HG13 H 1 0.800 . . 2 . . . B 20 VAL HG13 . 25919 1 1576 . 2 2 11 11 VAL HG21 H 1 0.827 . . 2 . . . B 20 VAL HG21 . 25919 1 1577 . 2 2 11 11 VAL HG22 H 1 0.827 . . 2 . . . B 20 VAL HG22 . 25919 1 1578 . 2 2 11 11 VAL HG23 H 1 0.827 . . 2 . . . B 20 VAL HG23 . 25919 1 1579 . 2 2 12 12 LEU H H 1 8.649 . . 1 . . . B 21 LEU H . 25919 1 1580 . 2 2 12 12 LEU HA H 1 4.310 . . 1 . . . B 21 LEU HA . 25919 1 1581 . 2 2 12 12 LEU HB2 H 1 1.593 . . 2 . . . B 21 LEU HB2 . 25919 1 1582 . 2 2 12 12 LEU HB3 H 1 1.747 . . 2 . . . B 21 LEU HB3 . 25919 1 1583 . 2 2 12 12 LEU HG H 1 1.647 . . 1 . . . B 21 LEU HG . 25919 1 1584 . 2 2 12 12 LEU HD11 H 1 0.935 . . 2 . . . B 21 LEU HD11 . 25919 1 1585 . 2 2 12 12 LEU HD12 H 1 0.935 . . 2 . . . B 21 LEU HD12 . 25919 1 1586 . 2 2 12 12 LEU HD13 H 1 0.935 . . 2 . . . B 21 LEU HD13 . 25919 1 1587 . 2 2 12 12 LEU HD21 H 1 0.847 . . 2 . . . B 21 LEU HD21 . 25919 1 1588 . 2 2 12 12 LEU HD22 H 1 0.847 . . 2 . . . B 21 LEU HD22 . 25919 1 1589 . 2 2 12 12 LEU HD23 H 1 0.847 . . 2 . . . B 21 LEU HD23 . 25919 1 1590 . 2 2 13 13 ASP H H 1 8.124 . . 1 . . . B 22 ASP H . 25919 1 1591 . 2 2 13 13 ASP HA H 1 4.699 . . 1 . . . B 22 ASP HA . 25919 1 1592 . 2 2 13 13 ASP HB2 H 1 2.568 . . 2 . . . B 22 ASP HB2 . 25919 1 1593 . 2 2 13 13 ASP HB3 H 1 2.719 . . 2 . . . B 22 ASP HB3 . 25919 1 1594 . 2 2 14 14 LEU HG H 1 1.763 . . 1 . . . B 23 LEU HG . 25919 1 1595 . 2 2 14 14 LEU HD11 H 1 0.785 . . 2 . . . B 23 LEU HD11 . 25919 1 1596 . 2 2 14 14 LEU HD12 H 1 0.785 . . 2 . . . B 23 LEU HD12 . 25919 1 1597 . 2 2 14 14 LEU HD13 H 1 0.785 . . 2 . . . B 23 LEU HD13 . 25919 1 1598 . 2 2 14 14 LEU HD21 H 1 0.531 . . 2 . . . B 23 LEU HD21 . 25919 1 1599 . 2 2 14 14 LEU HD22 H 1 0.531 . . 2 . . . B 23 LEU HD22 . 25919 1 1600 . 2 2 14 14 LEU HD23 H 1 0.531 . . 2 . . . B 23 LEU HD23 . 25919 1 1601 . 2 2 15 15 THR H H 1 8.139 . . 1 . . . B 24 THR H . 25919 1 1602 . 2 2 15 15 THR HA H 1 4.222 . . 1 . . . B 24 THR HA . 25919 1 1603 . 2 2 15 15 THR HB H 1 4.111 . . 1 . . . B 24 THR HB . 25919 1 1604 . 2 2 15 15 THR HG21 H 1 1.114 . . 1 . . . B 24 THR HG21 . 25919 1 1605 . 2 2 15 15 THR HG22 H 1 1.114 . . 1 . . . B 24 THR HG22 . 25919 1 1606 . 2 2 15 15 THR HG23 H 1 1.114 . . 1 . . . B 24 THR HG23 . 25919 1 1607 . 2 2 16 16 GLU H H 1 8.190 . . 1 . . . B 25 GLU H . 25919 1 1608 . 2 2 16 16 GLU HA H 1 4.241 . . 1 . . . B 25 GLU HA . 25919 1 1609 . 2 2 16 16 GLU HB2 H 1 1.821 . . 2 . . . B 25 GLU HB2 . 25919 1 1610 . 2 2 16 16 GLU HB3 H 1 1.962 . . 2 . . . B 25 GLU HB3 . 25919 1 1611 . 2 2 16 16 GLU HG2 H 1 2.110 . . 2 . . . B 25 GLU HG2 . 25919 1 1612 . 2 2 16 16 GLU HG3 H 1 2.183 . . 2 . . . B 25 GLU HG3 . 25919 1 1613 . 2 2 17 17 TYR H H 1 7.594 . . 1 . . . B 26 TYR H . 25919 1 1614 . 2 2 17 17 TYR HA H 1 4.343 . . 1 . . . B 26 TYR HA . 25919 1 1615 . 2 2 17 17 TYR HB2 H 1 2.828 . . 2 . . . B 26 TYR HB2 . 25919 1 1616 . 2 2 17 17 TYR HB3 H 1 3.059 . . 2 . . . B 26 TYR HB3 . 25919 1 1617 . 2 2 17 17 TYR HD1 H 1 7.052 . . 3 . . . B 26 TYR HD1 . 25919 1 1618 . 2 2 17 17 TYR HD2 H 1 7.052 . . 3 . . . B 26 TYR HD2 . 25919 1 1619 . 2 2 17 17 TYR HE1 H 1 6.785 . . 3 . . . B 26 TYR HE1 . 25919 1 1620 . 2 2 17 17 TYR HE2 H 1 6.785 . . 3 . . . B 26 TYR HE2 . 25919 1 stop_ save_