data_25324 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25324 _Entry.Title ; NMR solution structure of ligand-free OAA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-11-10 _Entry.Accession_date 2014-11-10 _Entry.Last_release_date 2015-04-20 _Entry.Original_release_date 2015-04-20 _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 Donghan Lee . . . . 25324 2 Marta Carneiro . G. . . 25324 3 Leonardus Koharudin . M.I. . . 25324 4 Christian Griesinger . . . . 25324 5 Angela Gronenborn . M. . . 25324 6 David Ban . . . . 25324 7 'T. Michael' Sabo . . . . 25324 8 Pablo Trigo-Mourino . . . . 25324 9 Adam Mazur . . . . 25324 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' . 25324 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Protein . 25324 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25324 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 511 25324 '15N chemical shifts' 157 25324 '1H chemical shifts' 839 25324 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2015-04-20 . original BMRB . 25324 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2MWH 'BMRB Entry Tracking System' 25324 stop_ save_ ############### # Citations # ############### save_CS _Citation.Sf_category citations _Citation.Sf_framecode CS _Citation.Entry_ID 25324 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Sampling of glycan-bound conformers by the anti-HIV lectin Oscillatoria agardhii agglutinin in the absence of sugar ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Marta Carneiro . G. . . 25324 1 2 Leonardus Koharudin . M.I. . . 25324 1 3 David Ban . . . . 25324 1 4 'T. Michael' Sabo . . . . 25324 1 5 Pablo Trigo-Mourino . . . . 25324 1 6 Adam Mazur . . . . 25324 1 7 Christian Griesinger . . . . 25324 1 8 Angela Gronenborn . M. . . 25324 1 9 Donghan Lee . . . . 25324 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25324 _Assembly.ID 1 _Assembly.Name 'ligand-free OAA' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 $entity A . yes native no no . . . 25324 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 25324 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _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 ; ALYNVENQWGGSSAPWNEGG QWEIGSRSDQNVVAINVESG DDGQTLNGTMTYAGEGPIGF RATLLGNNSYEVENQWGGDS APWHSGGNWILGSRENQNVV AINVESGDDGQTLNGTMTYA GEGPIGFKGTLT ; _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 132 _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 27843.732 _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 2 ALA . 25324 1 2 3 LEU . 25324 1 3 4 TYR . 25324 1 4 5 ASN . 25324 1 5 6 VAL . 25324 1 6 7 GLU . 25324 1 7 8 ASN . 25324 1 8 9 GLN . 25324 1 9 10 TRP . 25324 1 10 11 GLY . 25324 1 11 12 GLY . 25324 1 12 13 SER . 25324 1 13 14 SER . 25324 1 14 15 ALA . 25324 1 15 16 PRO . 25324 1 16 17 TRP . 25324 1 17 18 ASN . 25324 1 18 19 GLU . 25324 1 19 20 GLY . 25324 1 20 21 GLY . 25324 1 21 22 GLN . 25324 1 22 23 TRP . 25324 1 23 24 GLU . 25324 1 24 25 ILE . 25324 1 25 26 GLY . 25324 1 26 27 SER . 25324 1 27 28 ARG . 25324 1 28 29 SER . 25324 1 29 30 ASP . 25324 1 30 31 GLN . 25324 1 31 32 ASN . 25324 1 32 33 VAL . 25324 1 33 34 VAL . 25324 1 34 35 ALA . 25324 1 35 36 ILE . 25324 1 36 37 ASN . 25324 1 37 38 VAL . 25324 1 38 39 GLU . 25324 1 39 40 SER . 25324 1 40 41 GLY . 25324 1 41 42 ASP . 25324 1 42 43 ASP . 25324 1 43 44 GLY . 25324 1 44 45 GLN . 25324 1 45 46 THR . 25324 1 46 47 LEU . 25324 1 47 48 ASN . 25324 1 48 49 GLY . 25324 1 49 50 THR . 25324 1 50 51 MET . 25324 1 51 52 THR . 25324 1 52 53 TYR . 25324 1 53 54 ALA . 25324 1 54 55 GLY . 25324 1 55 56 GLU . 25324 1 56 57 GLY . 25324 1 57 58 PRO . 25324 1 58 59 ILE . 25324 1 59 60 GLY . 25324 1 60 61 PHE . 25324 1 61 62 ARG . 25324 1 62 63 ALA . 25324 1 63 64 THR . 25324 1 64 65 LEU . 25324 1 65 66 LEU . 25324 1 66 67 GLY . 25324 1 67 68 ASN . 25324 1 68 69 ASN . 25324 1 69 70 SER . 25324 1 70 71 TYR . 25324 1 71 72 GLU . 25324 1 72 73 VAL . 25324 1 73 74 GLU . 25324 1 74 75 ASN . 25324 1 75 76 GLN . 25324 1 76 77 TRP . 25324 1 77 78 GLY . 25324 1 78 79 GLY . 25324 1 79 80 ASP . 25324 1 80 81 SER . 25324 1 81 82 ALA . 25324 1 82 83 PRO . 25324 1 83 84 TRP . 25324 1 84 85 HIS . 25324 1 85 86 SER . 25324 1 86 87 GLY . 25324 1 87 88 GLY . 25324 1 88 89 ASN . 25324 1 89 90 TRP . 25324 1 90 91 ILE . 25324 1 91 92 LEU . 25324 1 92 93 GLY . 25324 1 93 94 SER . 25324 1 94 95 ARG . 25324 1 95 96 GLU . 25324 1 96 97 ASN . 25324 1 97 98 GLN . 25324 1 98 99 ASN . 25324 1 99 100 VAL . 25324 1 100 101 VAL . 25324 1 101 102 ALA . 25324 1 102 103 ILE . 25324 1 103 104 ASN . 25324 1 104 105 VAL . 25324 1 105 106 GLU . 25324 1 106 107 SER . 25324 1 107 108 GLY . 25324 1 108 109 ASP . 25324 1 109 110 ASP . 25324 1 110 111 GLY . 25324 1 111 112 GLN . 25324 1 112 113 THR . 25324 1 113 114 LEU . 25324 1 114 115 ASN . 25324 1 115 116 GLY . 25324 1 116 117 THR . 25324 1 117 118 MET . 25324 1 118 119 THR . 25324 1 119 120 TYR . 25324 1 120 121 ALA . 25324 1 121 122 GLY . 25324 1 122 123 GLU . 25324 1 123 124 GLY . 25324 1 124 125 PRO . 25324 1 125 126 ILE . 25324 1 126 127 GLY . 25324 1 127 128 PHE . 25324 1 128 129 LYS . 25324 1 129 130 GLY . 25324 1 130 131 THR . 25324 1 131 132 LEU . 25324 1 132 133 THR . 25324 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 25324 1 . LEU 2 2 25324 1 . TYR 3 3 25324 1 . ASN 4 4 25324 1 . VAL 5 5 25324 1 . GLU 6 6 25324 1 . ASN 7 7 25324 1 . GLN 8 8 25324 1 . TRP 9 9 25324 1 . GLY 10 10 25324 1 . GLY 11 11 25324 1 . SER 12 12 25324 1 . SER 13 13 25324 1 . ALA 14 14 25324 1 . PRO 15 15 25324 1 . TRP 16 16 25324 1 . ASN 17 17 25324 1 . GLU 18 18 25324 1 . GLY 19 19 25324 1 . GLY 20 20 25324 1 . GLN 21 21 25324 1 . TRP 22 22 25324 1 . GLU 23 23 25324 1 . ILE 24 24 25324 1 . GLY 25 25 25324 1 . SER 26 26 25324 1 . ARG 27 27 25324 1 . SER 28 28 25324 1 . ASP 29 29 25324 1 . GLN 30 30 25324 1 . ASN 31 31 25324 1 . VAL 32 32 25324 1 . VAL 33 33 25324 1 . ALA 34 34 25324 1 . ILE 35 35 25324 1 . ASN 36 36 25324 1 . VAL 37 37 25324 1 . GLU 38 38 25324 1 . SER 39 39 25324 1 . GLY 40 40 25324 1 . ASP 41 41 25324 1 . ASP 42 42 25324 1 . GLY 43 43 25324 1 . GLN 44 44 25324 1 . THR 45 45 25324 1 . LEU 46 46 25324 1 . ASN 47 47 25324 1 . GLY 48 48 25324 1 . THR 49 49 25324 1 . MET 50 50 25324 1 . THR 51 51 25324 1 . TYR 52 52 25324 1 . ALA 53 53 25324 1 . GLY 54 54 25324 1 . GLU 55 55 25324 1 . GLY 56 56 25324 1 . PRO 57 57 25324 1 . ILE 58 58 25324 1 . GLY 59 59 25324 1 . PHE 60 60 25324 1 . ARG 61 61 25324 1 . ALA 62 62 25324 1 . THR 63 63 25324 1 . LEU 64 64 25324 1 . LEU 65 65 25324 1 . GLY 66 66 25324 1 . ASN 67 67 25324 1 . ASN 68 68 25324 1 . SER 69 69 25324 1 . TYR 70 70 25324 1 . GLU 71 71 25324 1 . VAL 72 72 25324 1 . GLU 73 73 25324 1 . ASN 74 74 25324 1 . GLN 75 75 25324 1 . TRP 76 76 25324 1 . GLY 77 77 25324 1 . GLY 78 78 25324 1 . ASP 79 79 25324 1 . SER 80 80 25324 1 . ALA 81 81 25324 1 . PRO 82 82 25324 1 . TRP 83 83 25324 1 . HIS 84 84 25324 1 . SER 85 85 25324 1 . GLY 86 86 25324 1 . GLY 87 87 25324 1 . ASN 88 88 25324 1 . TRP 89 89 25324 1 . ILE 90 90 25324 1 . LEU 91 91 25324 1 . GLY 92 92 25324 1 . SER 93 93 25324 1 . ARG 94 94 25324 1 . GLU 95 95 25324 1 . ASN 96 96 25324 1 . GLN 97 97 25324 1 . ASN 98 98 25324 1 . VAL 99 99 25324 1 . VAL 100 100 25324 1 . ALA 101 101 25324 1 . ILE 102 102 25324 1 . ASN 103 103 25324 1 . VAL 104 104 25324 1 . GLU 105 105 25324 1 . SER 106 106 25324 1 . GLY 107 107 25324 1 . ASP 108 108 25324 1 . ASP 109 109 25324 1 . GLY 110 110 25324 1 . GLN 111 111 25324 1 . THR 112 112 25324 1 . LEU 113 113 25324 1 . ASN 114 114 25324 1 . GLY 115 115 25324 1 . THR 116 116 25324 1 . MET 117 117 25324 1 . THR 118 118 25324 1 . TYR 119 119 25324 1 . ALA 120 120 25324 1 . GLY 121 121 25324 1 . GLU 122 122 25324 1 . GLY 123 123 25324 1 . PRO 124 124 25324 1 . ILE 125 125 25324 1 . GLY 126 126 25324 1 . PHE 127 127 25324 1 . LYS 128 128 25324 1 . GLY 129 129 25324 1 . THR 130 130 25324 1 . LEU 131 131 25324 1 . THR 132 132 25324 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25324 _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 . 1160 organism . 'Planktothrix agardhii' cyanobacteria . . Bacteria . Planktothrix agardhii . . . . . . . . . . . . . 25324 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 25324 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . PET26B . . . 25324 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25324 _Sample.ID 1 _Sample.Type 'liquid crystal' _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 OAA '[U-100% 15N]' . . 1 $entity . . 500 . . uM . . . . 25324 1 2 'sodium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 1 3 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 1 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 25324 1 5 N-octylpentaoxyethylene 'natural abundance' . . . . . . 5 . . '% w/w (C8E5/water)' . . . . 25324 1 6 octanol 'natural abundance' . . . . . . 0.87 . . 'molar ratio C8E5/octanol' . . . . 25324 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25324 1 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25324 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25324 _Sample.ID 2 _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 OAA '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 2 . . mM . . . . 25324 2 2 'sodium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 2 3 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 2 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 25324 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25324 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25324 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25324 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 OAA '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 2 . . mM . . . . 25324 3 2 'sodium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 3 3 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 25324 3 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 25324 3 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 25324 3 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 25324 _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 pH 5 . pH 25324 1 pressure 1 . atm 25324 1 temperature 298 . K 25324 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25324 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25324 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25324 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25324 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25324 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25324 2 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 25324 _Software.ID 3 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 25324 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25324 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25324 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25324 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 25324 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 25324 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25324 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 25324 1 2 spectrometer_2 Bruker Avance . 700 . . . 25324 1 3 spectrometer_3 Bruker Avance . 800 . . . 25324 1 4 spectrometer_4 Bruker Avance . 900 . . . 25324 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 25324 _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 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 25324 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 25324 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25324 1 4 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 25324 1 5 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 25324 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25324 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 25324 1 8 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 25324 1 9 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25324 1 10 '2D 1H-15N IPAP-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25324 1 11 '2D 1H-15N IPAP-HSQC' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25324 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 25324 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.772 internal indirect 0.25144953 . . . . . 25324 1 H 1 water protons . . . . ppm 4.772 internal direct 1.0 . . . . . 25324 1 N 15 water protons . . . . ppm 4.772 internal indirect 0.101329118 . . . . . 25324 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 25324 _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' . . . 25324 1 2 '2D 1H-13C HSQC aliphatic' . . . 25324 1 3 '2D 1H-13C HSQC aromatic' . . . 25324 1 4 '3D HNCA' . . . 25324 1 5 '3D HNCO' . . . 25324 1 6 '3D HCCH-TOCSY' . . . 25324 1 7 '3D 1H-15N NOESY' . . . 25324 1 8 '3D 1H-13C NOESY aliphatic' . . . 25324 1 9 '3D 1H-13C NOESY aromatic' . . . 25324 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 ALA HA H 1 3.978 0.020 . 1 . . . A 2 ALA HA . 25324 1 2 . 1 1 1 1 ALA HB1 H 1 1.502 0.020 . 1 . . . A 2 ALA HB1 . 25324 1 3 . 1 1 1 1 ALA HB2 H 1 1.502 0.020 . 1 . . . A 2 ALA HB2 . 25324 1 4 . 1 1 1 1 ALA HB3 H 1 1.502 0.020 . 1 . . . A 2 ALA HB3 . 25324 1 5 . 1 1 1 1 ALA C C 13 172.190 0.3 . 1 . . . A 2 ALA C . 25324 1 6 . 1 1 1 1 ALA CA C 13 51.103 0.3 . 1 . . . A 2 ALA CA . 25324 1 7 . 1 1 1 1 ALA CB C 13 19.865 0.3 . 1 . . . A 2 ALA CB . 25324 1 8 . 1 1 2 2 LEU H H 1 8.711 0.020 . 1 . . . A 3 LEU H . 25324 1 9 . 1 1 2 2 LEU HA H 1 5.157 0.020 . 1 . . . A 3 LEU HA . 25324 1 10 . 1 1 2 2 LEU HB2 H 1 1.547 0.020 . 2 . . . A 3 LEU HB2 . 25324 1 11 . 1 1 2 2 LEU HB3 H 1 1.475 0.020 . 2 . . . A 3 LEU HB3 . 25324 1 12 . 1 1 2 2 LEU HG H 1 1.501 0.020 . 1 . . . A 3 LEU HG . 25324 1 13 . 1 1 2 2 LEU HD11 H 1 0.896 0.020 . 2 . . . A 3 LEU HD11 . 25324 1 14 . 1 1 2 2 LEU HD12 H 1 0.896 0.020 . 2 . . . A 3 LEU HD12 . 25324 1 15 . 1 1 2 2 LEU HD13 H 1 0.896 0.020 . 2 . . . A 3 LEU HD13 . 25324 1 16 . 1 1 2 2 LEU HD21 H 1 0.834 0.020 . 2 . . . A 3 LEU HD21 . 25324 1 17 . 1 1 2 2 LEU HD22 H 1 0.834 0.020 . 2 . . . A 3 LEU HD22 . 25324 1 18 . 1 1 2 2 LEU HD23 H 1 0.834 0.020 . 2 . . . A 3 LEU HD23 . 25324 1 19 . 1 1 2 2 LEU C C 13 175.786 0.3 . 1 . . . A 3 LEU C . 25324 1 20 . 1 1 2 2 LEU CA C 13 54.284 0.3 . 1 . . . A 3 LEU CA . 25324 1 21 . 1 1 2 2 LEU CB C 13 43.330 0.3 . 1 . . . A 3 LEU CB . 25324 1 22 . 1 1 2 2 LEU CG C 13 26.831 0.3 . 1 . . . A 3 LEU CG . 25324 1 23 . 1 1 2 2 LEU CD1 C 13 24.157 0.3 . 1 . . . A 3 LEU CD1 . 25324 1 24 . 1 1 2 2 LEU CD2 C 13 24.189 0.3 . 1 . . . A 3 LEU CD2 . 25324 1 25 . 1 1 2 2 LEU N N 15 123.202 0.3 . 1 . . . A 3 LEU N . 25324 1 26 . 1 1 3 3 TYR H H 1 9.142 0.020 . 1 . . . A 4 TYR H . 25324 1 27 . 1 1 3 3 TYR HA H 1 5.024 0.020 . 1 . . . A 4 TYR HA . 25324 1 28 . 1 1 3 3 TYR HB2 H 1 2.437 0.020 . 2 . . . A 4 TYR HB2 . 25324 1 29 . 1 1 3 3 TYR HB3 H 1 2.198 0.020 . 2 . . . A 4 TYR HB3 . 25324 1 30 . 1 1 3 3 TYR HD1 H 1 6.692 0.020 . 1 . . . A 4 TYR HD1 . 25324 1 31 . 1 1 3 3 TYR HD2 H 1 6.692 0.020 . 1 . . . A 4 TYR HD2 . 25324 1 32 . 1 1 3 3 TYR HE1 H 1 6.656 0.020 . 1 . . . A 4 TYR HE1 . 25324 1 33 . 1 1 3 3 TYR HE2 H 1 6.656 0.020 . 1 . . . A 4 TYR HE2 . 25324 1 34 . 1 1 3 3 TYR C C 13 175.953 0.3 . 1 . . . A 4 TYR C . 25324 1 35 . 1 1 3 3 TYR CA C 13 56.377 0.3 . 1 . . . A 4 TYR CA . 25324 1 36 . 1 1 3 3 TYR CB C 13 41.655 0.3 . 1 . . . A 4 TYR CB . 25324 1 37 . 1 1 3 3 TYR CD1 C 13 131.853 0.3 . 1 . . . A 4 TYR CD1 . 25324 1 38 . 1 1 3 3 TYR CE1 C 13 118.210 0.3 . 1 . . . A 4 TYR CE1 . 25324 1 39 . 1 1 3 3 TYR N N 15 120.906 0.3 . 1 . . . A 4 TYR N . 25324 1 40 . 1 1 4 4 ASN H H 1 8.787 0.020 . 1 . . . A 5 ASN H . 25324 1 41 . 1 1 4 4 ASN HA H 1 5.116 0.020 . 1 . . . A 5 ASN HA . 25324 1 42 . 1 1 4 4 ASN HB2 H 1 2.626 0.020 . 1 . . . A 5 ASN HB2 . 25324 1 43 . 1 1 4 4 ASN HB3 H 1 2.626 0.020 . 1 . . . A 5 ASN HB3 . 25324 1 44 . 1 1 4 4 ASN HD21 H 1 7.734 0.020 . 1 . . . A 5 ASN HD21 . 25324 1 45 . 1 1 4 4 ASN HD22 H 1 7.096 0.020 . 1 . . . A 5 ASN HD22 . 25324 1 46 . 1 1 4 4 ASN C C 13 174.953 0.3 . 1 . . . A 5 ASN C . 25324 1 47 . 1 1 4 4 ASN CA C 13 52.947 0.3 . 1 . . . A 5 ASN CA . 25324 1 48 . 1 1 4 4 ASN CB C 13 38.891 0.3 . 1 . . . A 5 ASN CB . 25324 1 49 . 1 1 4 4 ASN N N 15 120.496 0.3 . 1 . . . A 5 ASN N . 25324 1 50 . 1 1 4 4 ASN ND2 N 15 114.076 0.3 . 1 . . . A 5 ASN ND2 . 25324 1 51 . 1 1 5 5 VAL H H 1 8.806 0.020 . 1 . . . A 6 VAL H . 25324 1 52 . 1 1 5 5 VAL HA H 1 4.362 0.020 . 1 . . . A 6 VAL HA . 25324 1 53 . 1 1 5 5 VAL HB H 1 1.269 0.020 . 1 . . . A 6 VAL HB . 25324 1 54 . 1 1 5 5 VAL HG11 H 1 -0.298 0.020 . 2 . . . A 6 VAL HG11 . 25324 1 55 . 1 1 5 5 VAL HG12 H 1 -0.298 0.020 . 2 . . . A 6 VAL HG12 . 25324 1 56 . 1 1 5 5 VAL HG13 H 1 -0.298 0.020 . 2 . . . A 6 VAL HG13 . 25324 1 57 . 1 1 5 5 VAL HG21 H 1 -0.383 0.020 . 2 . . . A 6 VAL HG21 . 25324 1 58 . 1 1 5 5 VAL HG22 H 1 -0.383 0.020 . 2 . . . A 6 VAL HG22 . 25324 1 59 . 1 1 5 5 VAL HG23 H 1 -0.383 0.020 . 2 . . . A 6 VAL HG23 . 25324 1 60 . 1 1 5 5 VAL C C 13 174.955 0.3 . 1 . . . A 6 VAL C . 25324 1 61 . 1 1 5 5 VAL CA C 13 61.433 0.3 . 1 . . . A 6 VAL CA . 25324 1 62 . 1 1 5 5 VAL CB C 13 33.331 0.3 . 1 . . . A 6 VAL CB . 25324 1 63 . 1 1 5 5 VAL CG1 C 13 20.674 0.3 . 1 . . . A 6 VAL CG1 . 25324 1 64 . 1 1 5 5 VAL CG2 C 13 20.616 0.3 . 1 . . . A 6 VAL CG2 . 25324 1 65 . 1 1 5 5 VAL N N 15 127.428 0.3 . 1 . . . A 6 VAL N . 25324 1 66 . 1 1 6 6 GLU H H 1 8.800 0.020 . 1 . . . A 7 GLU H . 25324 1 67 . 1 1 6 6 GLU HA H 1 4.982 0.020 . 1 . . . A 7 GLU HA . 25324 1 68 . 1 1 6 6 GLU HB2 H 1 1.684 0.020 . 1 . . . A 7 GLU HB2 . 25324 1 69 . 1 1 6 6 GLU HB3 H 1 1.684 0.020 . 1 . . . A 7 GLU HB3 . 25324 1 70 . 1 1 6 6 GLU HG2 H 1 2.050 0.020 . 1 . . . A 7 GLU HG2 . 25324 1 71 . 1 1 6 6 GLU HG3 H 1 2.050 0.020 . 1 . . . A 7 GLU HG3 . 25324 1 72 . 1 1 6 6 GLU C C 13 174.551 0.3 . 1 . . . A 7 GLU C . 25324 1 73 . 1 1 6 6 GLU CA C 13 53.789 0.3 . 1 . . . A 7 GLU CA . 25324 1 74 . 1 1 6 6 GLU CB C 13 34.567 0.3 . 1 . . . A 7 GLU CB . 25324 1 75 . 1 1 6 6 GLU CG C 13 35.740 0.3 . 1 . . . A 7 GLU CG . 25324 1 76 . 1 1 6 6 GLU N N 15 124.355 0.3 . 1 . . . A 7 GLU N . 25324 1 77 . 1 1 7 7 ASN H H 1 9.320 0.020 . 1 . . . A 8 ASN H . 25324 1 78 . 1 1 7 7 ASN HA H 1 6.041 0.020 . 1 . . . A 8 ASN HA . 25324 1 79 . 1 1 7 7 ASN HB2 H 1 2.869 0.020 . 2 . . . A 8 ASN HB2 . 25324 1 80 . 1 1 7 7 ASN HB3 H 1 2.565 0.020 . 2 . . . A 8 ASN HB3 . 25324 1 81 . 1 1 7 7 ASN HD21 H 1 8.015 0.020 . 1 . . . A 8 ASN HD21 . 25324 1 82 . 1 1 7 7 ASN HD22 H 1 5.804 0.020 . 1 . . . A 8 ASN HD22 . 25324 1 83 . 1 1 7 7 ASN C C 13 172.709 0.3 . 1 . . . A 8 ASN C . 25324 1 84 . 1 1 7 7 ASN CA C 13 51.617 0.3 . 1 . . . A 8 ASN CA . 25324 1 85 . 1 1 7 7 ASN CB C 13 45.585 0.3 . 1 . . . A 8 ASN CB . 25324 1 86 . 1 1 7 7 ASN N N 15 116.231 0.3 . 1 . . . A 8 ASN N . 25324 1 87 . 1 1 7 7 ASN ND2 N 15 105.455 0.3 . 1 . . . A 8 ASN ND2 . 25324 1 88 . 1 1 8 8 GLN H H 1 6.887 0.020 . 1 . . . A 9 GLN H . 25324 1 89 . 1 1 8 8 GLN HA H 1 4.174 0.020 . 1 . . . A 9 GLN HA . 25324 1 90 . 1 1 8 8 GLN HB2 H 1 0.831 0.020 . 2 . . . A 9 GLN HB2 . 25324 1 91 . 1 1 8 8 GLN HB3 H 1 -0.797 0.020 . 2 . . . A 9 GLN HB3 . 25324 1 92 . 1 1 8 8 GLN HG2 H 1 1.189 0.020 . 2 . . . A 9 GLN HG2 . 25324 1 93 . 1 1 8 8 GLN HG3 H 1 1.053 0.020 . 2 . . . A 9 GLN HG3 . 25324 1 94 . 1 1 8 8 GLN HE21 H 1 7.373 0.020 . 1 . . . A 9 GLN HE21 . 25324 1 95 . 1 1 8 8 GLN HE22 H 1 5.876 0.020 . 1 . . . A 9 GLN HE22 . 25324 1 96 . 1 1 8 8 GLN C C 13 173.454 0.3 . 1 . . . A 9 GLN C . 25324 1 97 . 1 1 8 8 GLN CA C 13 53.960 0.3 . 1 . . . A 9 GLN CA . 25324 1 98 . 1 1 8 8 GLN CB C 13 30.691 0.3 . 1 . . . A 9 GLN CB . 25324 1 99 . 1 1 8 8 GLN CG C 13 33.195 0.3 . 1 . . . A 9 GLN CG . 25324 1 100 . 1 1 8 8 GLN N N 15 120.762 0.3 . 1 . . . A 9 GLN N . 25324 1 101 . 1 1 8 8 GLN NE2 N 15 113.656 0.3 . 1 . . . A 9 GLN NE2 . 25324 1 102 . 1 1 9 9 TRP H H 1 8.518 0.020 . 1 . . . A 10 TRP H . 25324 1 103 . 1 1 9 9 TRP HA H 1 4.988 0.020 . 1 . . . A 10 TRP HA . 25324 1 104 . 1 1 9 9 TRP HB2 H 1 3.365 0.020 . 2 . . . A 10 TRP HB2 . 25324 1 105 . 1 1 9 9 TRP HB3 H 1 3.237 0.020 . 2 . . . A 10 TRP HB3 . 25324 1 106 . 1 1 9 9 TRP HD1 H 1 7.140 0.020 . 1 . . . A 10 TRP HD1 . 25324 1 107 . 1 1 9 9 TRP HE1 H 1 10.281 0.020 . 1 . . . A 10 TRP HE1 . 25324 1 108 . 1 1 9 9 TRP HE3 H 1 7.446 0.020 . 1 . . . A 10 TRP HE3 . 25324 1 109 . 1 1 9 9 TRP HZ2 H 1 7.447 0.020 . 1 . . . A 10 TRP HZ2 . 25324 1 110 . 1 1 9 9 TRP HZ3 H 1 7.079 0.020 . 1 . . . A 10 TRP HZ3 . 25324 1 111 . 1 1 9 9 TRP HH2 H 1 7.232 0.020 . 1 . . . A 10 TRP HH2 . 25324 1 112 . 1 1 9 9 TRP C C 13 175.281 0.3 . 1 . . . A 10 TRP C . 25324 1 113 . 1 1 9 9 TRP CA C 13 56.293 0.3 . 1 . . . A 10 TRP CA . 25324 1 114 . 1 1 9 9 TRP CB C 13 29.742 0.3 . 1 . . . A 10 TRP CB . 25324 1 115 . 1 1 9 9 TRP CD1 C 13 127.037 0.3 . 1 . . . A 10 TRP CD1 . 25324 1 116 . 1 1 9 9 TRP CE3 C 13 120.073 0.3 . 1 . . . A 10 TRP CE3 . 25324 1 117 . 1 1 9 9 TRP CZ2 C 13 114.898 0.3 . 1 . . . A 10 TRP CZ2 . 25324 1 118 . 1 1 9 9 TRP CZ3 C 13 121.633 0.3 . 1 . . . A 10 TRP CZ3 . 25324 1 119 . 1 1 9 9 TRP CH2 C 13 124.424 0.3 . 1 . . . A 10 TRP CH2 . 25324 1 120 . 1 1 9 9 TRP N N 15 127.775 0.3 . 1 . . . A 10 TRP N . 25324 1 121 . 1 1 9 9 TRP NE1 N 15 130.415 0.3 . 1 . . . A 10 TRP NE1 . 25324 1 122 . 1 1 10 10 GLY H H 1 8.461 0.020 . 1 . . . A 11 GLY H . 25324 1 123 . 1 1 10 10 GLY HA2 H 1 4.085 0.020 . 2 . . . A 11 GLY HA2 . 25324 1 124 . 1 1 10 10 GLY HA3 H 1 3.773 0.020 . 2 . . . A 11 GLY HA3 . 25324 1 125 . 1 1 10 10 GLY C C 13 174.733 0.3 . 1 . . . A 11 GLY C . 25324 1 126 . 1 1 10 10 GLY CA C 13 44.836 0.3 . 1 . . . A 11 GLY CA . 25324 1 127 . 1 1 10 10 GLY N N 15 107.838 0.3 . 1 . . . A 11 GLY N . 25324 1 128 . 1 1 11 11 GLY H H 1 8.138 0.020 . 1 . . . A 12 GLY H . 25324 1 129 . 1 1 11 11 GLY HA2 H 1 4.395 0.020 . 2 . . . A 12 GLY HA2 . 25324 1 130 . 1 1 11 11 GLY HA3 H 1 3.750 0.020 . 2 . . . A 12 GLY HA3 . 25324 1 131 . 1 1 11 11 GLY C C 13 174.133 0.3 . 1 . . . A 12 GLY C . 25324 1 132 . 1 1 11 11 GLY CA C 13 43.789 0.3 . 1 . . . A 12 GLY CA . 25324 1 133 . 1 1 11 11 GLY N N 15 109.696 0.3 . 1 . . . A 12 GLY N . 25324 1 134 . 1 1 12 12 SER H H 1 8.215 0.020 . 1 . . . A 13 SER H . 25324 1 135 . 1 1 12 12 SER HA H 1 4.092 0.020 . 1 . . . A 13 SER HA . 25324 1 136 . 1 1 12 12 SER HB2 H 1 3.972 0.020 . 2 . . . A 13 SER HB2 . 25324 1 137 . 1 1 12 12 SER HB3 H 1 3.898 0.020 . 2 . . . A 13 SER HB3 . 25324 1 138 . 1 1 12 12 SER C C 13 175.622 0.3 . 1 . . . A 13 SER C . 25324 1 139 . 1 1 12 12 SER CA C 13 60.494 0.3 . 1 . . . A 13 SER CA . 25324 1 140 . 1 1 12 12 SER CB C 13 63.028 0.3 . 1 . . . A 13 SER CB . 25324 1 141 . 1 1 12 12 SER N N 15 111.308 0.3 . 1 . . . A 13 SER N . 25324 1 142 . 1 1 13 13 SER H H 1 8.213 0.020 . 1 . . . A 14 SER H . 25324 1 143 . 1 1 13 13 SER HA H 1 4.566 0.020 . 1 . . . A 14 SER HA . 25324 1 144 . 1 1 13 13 SER HB2 H 1 3.910 0.020 . 2 . . . A 14 SER HB2 . 25324 1 145 . 1 1 13 13 SER HB3 H 1 3.850 0.020 . 2 . . . A 14 SER HB3 . 25324 1 146 . 1 1 13 13 SER C C 13 173.532 0.3 . 1 . . . A 14 SER C . 25324 1 147 . 1 1 13 13 SER CA C 13 57.317 0.3 . 1 . . . A 14 SER CA . 25324 1 148 . 1 1 13 13 SER CB C 13 63.230 0.3 . 1 . . . A 14 SER CB . 25324 1 149 . 1 1 13 13 SER N N 15 115.290 0.3 . 1 . . . A 14 SER N . 25324 1 150 . 1 1 14 14 ALA H H 1 7.308 0.020 . 1 . . . A 15 ALA H . 25324 1 151 . 1 1 14 14 ALA HA H 1 4.403 0.020 . 1 . . . A 15 ALA HA . 25324 1 152 . 1 1 14 14 ALA HB1 H 1 1.244 0.020 . 1 . . . A 15 ALA HB1 . 25324 1 153 . 1 1 14 14 ALA HB2 H 1 1.244 0.020 . 1 . . . A 15 ALA HB2 . 25324 1 154 . 1 1 14 14 ALA HB3 H 1 1.244 0.020 . 1 . . . A 15 ALA HB3 . 25324 1 155 . 1 1 14 14 ALA CA C 13 50.464 0.3 . 1 . . . A 15 ALA CA . 25324 1 156 . 1 1 14 14 ALA CB C 13 18.229 0.3 . 1 . . . A 15 ALA CB . 25324 1 157 . 1 1 14 14 ALA N N 15 126.470 0.3 . 1 . . . A 15 ALA N . 25324 1 158 . 1 1 15 15 PRO HA H 1 4.409 0.020 . 1 . . . A 16 PRO HA . 25324 1 159 . 1 1 15 15 PRO HB2 H 1 2.299 0.020 . 2 . . . A 16 PRO HB2 . 25324 1 160 . 1 1 15 15 PRO HB3 H 1 1.752 0.020 . 2 . . . A 16 PRO HB3 . 25324 1 161 . 1 1 15 15 PRO HG2 H 1 1.956 0.020 . 1 . . . A 16 PRO HG2 . 25324 1 162 . 1 1 15 15 PRO HG3 H 1 1.956 0.020 . 1 . . . A 16 PRO HG3 . 25324 1 163 . 1 1 15 15 PRO HD2 H 1 3.734 0.020 . 2 . . . A 16 PRO HD2 . 25324 1 164 . 1 1 15 15 PRO HD3 H 1 3.531 0.020 . 2 . . . A 16 PRO HD3 . 25324 1 165 . 1 1 15 15 PRO C C 13 175.627 0.3 . 1 . . . A 16 PRO C . 25324 1 166 . 1 1 15 15 PRO CA C 13 62.392 0.3 . 1 . . . A 16 PRO CA . 25324 1 167 . 1 1 15 15 PRO CB C 13 32.137 0.3 . 1 . . . A 16 PRO CB . 25324 1 168 . 1 1 15 15 PRO CG C 13 27.240 0.3 . 1 . . . A 16 PRO CG . 25324 1 169 . 1 1 15 15 PRO CD C 13 50.071 0.3 . 1 . . . A 16 PRO CD . 25324 1 170 . 1 1 16 16 TRP H H 1 8.380 0.020 . 1 . . . A 17 TRP H . 25324 1 171 . 1 1 16 16 TRP HA H 1 4.318 0.020 . 1 . . . A 17 TRP HA . 25324 1 172 . 1 1 16 16 TRP HB2 H 1 2.974 0.020 . 2 . . . A 17 TRP HB2 . 25324 1 173 . 1 1 16 16 TRP HB3 H 1 2.844 0.020 . 2 . . . A 17 TRP HB3 . 25324 1 174 . 1 1 16 16 TRP HD1 H 1 7.224 0.020 . 1 . . . A 17 TRP HD1 . 25324 1 175 . 1 1 16 16 TRP HE1 H 1 10.025 0.020 . 1 . . . A 17 TRP HE1 . 25324 1 176 . 1 1 16 16 TRP HE3 H 1 6.917 0.020 . 1 . . . A 17 TRP HE3 . 25324 1 177 . 1 1 16 16 TRP HZ2 H 1 7.369 0.020 . 1 . . . A 17 TRP HZ2 . 25324 1 178 . 1 1 16 16 TRP HZ3 H 1 6.602 0.020 . 1 . . . A 17 TRP HZ3 . 25324 1 179 . 1 1 16 16 TRP HH2 H 1 6.970 0.020 . 1 . . . A 17 TRP HH2 . 25324 1 180 . 1 1 16 16 TRP C C 13 175.951 0.3 . 1 . . . A 17 TRP C . 25324 1 181 . 1 1 16 16 TRP CA C 13 56.915 0.3 . 1 . . . A 17 TRP CA . 25324 1 182 . 1 1 16 16 TRP CB C 13 29.409 0.3 . 1 . . . A 17 TRP CB . 25324 1 183 . 1 1 16 16 TRP CD1 C 13 127.083 0.3 . 1 . . . A 17 TRP CD1 . 25324 1 184 . 1 1 16 16 TRP CE3 C 13 119.113 0.3 . 1 . . . A 17 TRP CE3 . 25324 1 185 . 1 1 16 16 TRP CZ2 C 13 115.518 0.3 . 1 . . . A 17 TRP CZ2 . 25324 1 186 . 1 1 16 16 TRP CZ3 C 13 121.859 0.3 . 1 . . . A 17 TRP CZ3 . 25324 1 187 . 1 1 16 16 TRP CH2 C 13 123.481 0.3 . 1 . . . A 17 TRP CH2 . 25324 1 188 . 1 1 16 16 TRP N N 15 120.228 0.3 . 1 . . . A 17 TRP N . 25324 1 189 . 1 1 16 16 TRP NE1 N 15 129.795 0.3 . 1 . . . A 17 TRP NE1 . 25324 1 190 . 1 1 17 17 ASN H H 1 9.094 0.020 . 1 . . . A 18 ASN H . 25324 1 191 . 1 1 17 17 ASN HA H 1 5.086 0.020 . 1 . . . A 18 ASN HA . 25324 1 192 . 1 1 17 17 ASN HB2 H 1 2.743 0.020 . 2 . . . A 18 ASN HB2 . 25324 1 193 . 1 1 17 17 ASN HB3 H 1 2.338 0.020 . 2 . . . A 18 ASN HB3 . 25324 1 194 . 1 1 17 17 ASN HD21 H 1 6.448 0.020 . 1 . . . A 18 ASN HD21 . 25324 1 195 . 1 1 17 17 ASN HD22 H 1 6.116 0.020 . 1 . . . A 18 ASN HD22 . 25324 1 196 . 1 1 17 17 ASN C C 13 174.793 0.3 . 1 . . . A 18 ASN C . 25324 1 197 . 1 1 17 17 ASN CA C 13 51.601 0.3 . 1 . . . A 18 ASN CA . 25324 1 198 . 1 1 17 17 ASN CB C 13 42.648 0.3 . 1 . . . A 18 ASN CB . 25324 1 199 . 1 1 17 17 ASN N N 15 120.663 0.3 . 1 . . . A 18 ASN N . 25324 1 200 . 1 1 17 17 ASN ND2 N 15 113.295 0.3 . 1 . . . A 18 ASN ND2 . 25324 1 201 . 1 1 18 18 GLU H H 1 9.013 0.020 . 1 . . . A 19 GLU H . 25324 1 202 . 1 1 18 18 GLU HA H 1 4.139 0.020 . 1 . . . A 19 GLU HA . 25324 1 203 . 1 1 18 18 GLU HB2 H 1 2.230 0.020 . 1 . . . A 19 GLU HB2 . 25324 1 204 . 1 1 18 18 GLU HB3 H 1 2.230 0.020 . 1 . . . A 19 GLU HB3 . 25324 1 205 . 1 1 18 18 GLU HG2 H 1 2.505 0.020 . 1 . . . A 19 GLU HG2 . 25324 1 206 . 1 1 18 18 GLU HG3 H 1 2.505 0.020 . 1 . . . A 19 GLU HG3 . 25324 1 207 . 1 1 18 18 GLU C C 13 176.869 0.3 . 1 . . . A 19 GLU C . 25324 1 208 . 1 1 18 18 GLU CA C 13 58.600 0.3 . 1 . . . A 19 GLU CA . 25324 1 209 . 1 1 18 18 GLU CB C 13 29.382 0.3 . 1 . . . A 19 GLU CB . 25324 1 210 . 1 1 18 18 GLU CG C 13 35.406 0.3 . 1 . . . A 19 GLU CG . 25324 1 211 . 1 1 18 18 GLU N N 15 122.202 0.3 . 1 . . . A 19 GLU N . 25324 1 212 . 1 1 19 19 GLY H H 1 8.926 0.020 . 1 . . . A 20 GLY H . 25324 1 213 . 1 1 19 19 GLY HA2 H 1 4.777 0.020 . 2 . . . A 20 GLY HA2 . 25324 1 214 . 1 1 19 19 GLY HA3 H 1 3.330 0.020 . 2 . . . A 20 GLY HA3 . 25324 1 215 . 1 1 19 19 GLY C C 13 174.878 0.3 . 1 . . . A 20 GLY C . 25324 1 216 . 1 1 19 19 GLY CA C 13 44.995 0.3 . 1 . . . A 20 GLY CA . 25324 1 217 . 1 1 19 19 GLY N N 15 112.893 0.3 . 1 . . . A 20 GLY N . 25324 1 218 . 1 1 20 20 GLY H H 1 8.258 0.020 . 1 . . . A 21 GLY H . 25324 1 219 . 1 1 20 20 GLY HA2 H 1 4.529 0.020 . 2 . . . A 21 GLY HA2 . 25324 1 220 . 1 1 20 20 GLY HA3 H 1 4.059 0.020 . 2 . . . A 21 GLY HA3 . 25324 1 221 . 1 1 20 20 GLY C C 13 171.623 0.3 . 1 . . . A 21 GLY C . 25324 1 222 . 1 1 20 20 GLY CA C 13 44.398 0.3 . 1 . . . A 21 GLY CA . 25324 1 223 . 1 1 20 20 GLY N N 15 110.354 0.3 . 1 . . . A 21 GLY N . 25324 1 224 . 1 1 21 21 GLN H H 1 8.564 0.020 . 1 . . . A 22 GLN H . 25324 1 225 . 1 1 21 21 GLN HA H 1 5.677 0.020 . 1 . . . A 22 GLN HA . 25324 1 226 . 1 1 21 21 GLN HB2 H 1 2.125 0.020 . 2 . . . A 22 GLN HB2 . 25324 1 227 . 1 1 21 21 GLN HB3 H 1 2.015 0.020 . 2 . . . A 22 GLN HB3 . 25324 1 228 . 1 1 21 21 GLN HG2 H 1 2.457 0.020 . 2 . . . A 22 GLN HG2 . 25324 1 229 . 1 1 21 21 GLN HG3 H 1 2.378 0.020 . 2 . . . A 22 GLN HG3 . 25324 1 230 . 1 1 21 21 GLN HE21 H 1 7.766 0.020 . 1 . . . A 22 GLN HE21 . 25324 1 231 . 1 1 21 21 GLN HE22 H 1 6.922 0.020 . 1 . . . A 22 GLN HE22 . 25324 1 232 . 1 1 21 21 GLN C C 13 175.957 0.3 . 1 . . . A 22 GLN C . 25324 1 233 . 1 1 21 21 GLN CA C 13 54.944 0.3 . 1 . . . A 22 GLN CA . 25324 1 234 . 1 1 21 21 GLN CB C 13 31.085 0.3 . 1 . . . A 22 GLN CB . 25324 1 235 . 1 1 21 21 GLN CG C 13 34.717 0.3 . 1 . . . A 22 GLN CG . 25324 1 236 . 1 1 21 21 GLN N N 15 117.541 0.3 . 1 . . . A 22 GLN N . 25324 1 237 . 1 1 21 21 GLN NE2 N 15 112.588 0.3 . 1 . . . A 22 GLN NE2 . 25324 1 238 . 1 1 22 22 TRP H H 1 9.347 0.020 . 1 . . . A 23 TRP H . 25324 1 239 . 1 1 22 22 TRP HA H 1 5.199 0.020 . 1 . . . A 23 TRP HA . 25324 1 240 . 1 1 22 22 TRP HB2 H 1 3.933 0.020 . 2 . . . A 23 TRP HB2 . 25324 1 241 . 1 1 22 22 TRP HB3 H 1 2.799 0.020 . 2 . . . A 23 TRP HB3 . 25324 1 242 . 1 1 22 22 TRP HD1 H 1 7.015 0.020 . 1 . . . A 23 TRP HD1 . 25324 1 243 . 1 1 22 22 TRP HE1 H 1 9.801 0.020 . 1 . . . A 23 TRP HE1 . 25324 1 244 . 1 1 22 22 TRP HE3 H 1 7.672 0.020 . 1 . . . A 23 TRP HE3 . 25324 1 245 . 1 1 22 22 TRP HZ2 H 1 7.730 0.020 . 1 . . . A 23 TRP HZ2 . 25324 1 246 . 1 1 22 22 TRP HZ3 H 1 6.891 0.020 . 1 . . . A 23 TRP HZ3 . 25324 1 247 . 1 1 22 22 TRP HH2 H 1 7.185 0.020 . 1 . . . A 23 TRP HH2 . 25324 1 248 . 1 1 22 22 TRP CA C 13 54.531 0.3 . 1 . . . A 23 TRP CA . 25324 1 249 . 1 1 22 22 TRP CB C 13 31.683 0.3 . 1 . . . A 23 TRP CB . 25324 1 250 . 1 1 22 22 TRP CD1 C 13 125.690 0.3 . 1 . . . A 23 TRP CD1 . 25324 1 251 . 1 1 22 22 TRP CE3 C 13 121.160 0.3 . 1 . . . A 23 TRP CE3 . 25324 1 252 . 1 1 22 22 TRP CZ2 C 13 114.262 0.3 . 1 . . . A 23 TRP CZ2 . 25324 1 253 . 1 1 22 22 TRP CZ3 C 13 121.201 0.3 . 1 . . . A 23 TRP CZ3 . 25324 1 254 . 1 1 22 22 TRP CH2 C 13 125.701 0.3 . 1 . . . A 23 TRP CH2 . 25324 1 255 . 1 1 22 22 TRP N N 15 127.208 0.3 . 1 . . . A 23 TRP N . 25324 1 256 . 1 1 22 22 TRP NE1 N 15 127.602 0.3 . 1 . . . A 23 TRP NE1 . 25324 1 257 . 1 1 23 23 GLU H H 1 9.296 0.020 . 1 . . . A 24 GLU H . 25324 1 258 . 1 1 23 23 GLU HA H 1 5.508 0.020 . 1 . . . A 24 GLU HA . 25324 1 259 . 1 1 23 23 GLU HB2 H 1 2.251 0.020 . 1 . . . A 24 GLU HB2 . 25324 1 260 . 1 1 23 23 GLU HB3 H 1 2.251 0.020 . 1 . . . A 24 GLU HB3 . 25324 1 261 . 1 1 23 23 GLU HG2 H 1 2.147 0.020 . 1 . . . A 24 GLU HG2 . 25324 1 262 . 1 1 23 23 GLU HG3 H 1 2.147 0.020 . 1 . . . A 24 GLU HG3 . 25324 1 263 . 1 1 23 23 GLU C C 13 174.222 0.3 . 1 . . . A 24 GLU C . 25324 1 264 . 1 1 23 23 GLU CA C 13 55.591 0.3 . 1 . . . A 24 GLU CA . 25324 1 265 . 1 1 23 23 GLU CB C 13 30.615 0.3 . 1 . . . A 24 GLU CB . 25324 1 266 . 1 1 23 23 GLU CG C 13 35.124 0.3 . 1 . . . A 24 GLU CG . 25324 1 267 . 1 1 23 23 GLU N N 15 123.504 0.3 . 1 . . . A 24 GLU N . 25324 1 268 . 1 1 24 24 ILE H H 1 8.635 0.020 . 1 . . . A 25 ILE H . 25324 1 269 . 1 1 24 24 ILE HA H 1 3.436 0.020 . 1 . . . A 25 ILE HA . 25324 1 270 . 1 1 24 24 ILE HB H 1 1.616 0.020 . 1 . . . A 25 ILE HB . 25324 1 271 . 1 1 24 24 ILE HG12 H 1 0.902 0.020 . 1 . . . A 25 ILE HG12 . 25324 1 272 . 1 1 24 24 ILE HG13 H 1 0.902 0.020 . 1 . . . A 25 ILE HG13 . 25324 1 273 . 1 1 24 24 ILE HG21 H 1 0.330 0.020 . 1 . . . A 25 ILE HG21 . 25324 1 274 . 1 1 24 24 ILE HG22 H 1 0.330 0.020 . 1 . . . A 25 ILE HG22 . 25324 1 275 . 1 1 24 24 ILE HG23 H 1 0.330 0.020 . 1 . . . A 25 ILE HG23 . 25324 1 276 . 1 1 24 24 ILE HD11 H 1 0.382 0.020 . 1 . . . A 25 ILE HD11 . 25324 1 277 . 1 1 24 24 ILE HD12 H 1 0.382 0.020 . 1 . . . A 25 ILE HD12 . 25324 1 278 . 1 1 24 24 ILE HD13 H 1 0.382 0.020 . 1 . . . A 25 ILE HD13 . 25324 1 279 . 1 1 24 24 ILE C C 13 175.790 0.3 . 1 . . . A 25 ILE C . 25324 1 280 . 1 1 24 24 ILE CA C 13 59.627 0.3 . 1 . . . A 25 ILE CA . 25324 1 281 . 1 1 24 24 ILE CB C 13 40.952 0.3 . 1 . . . A 25 ILE CB . 25324 1 282 . 1 1 24 24 ILE CG1 C 13 27.016 0.3 . 1 . . . A 25 ILE CG1 . 25324 1 283 . 1 1 24 24 ILE CG2 C 13 17.185 0.3 . 1 . . . A 25 ILE CG2 . 25324 1 284 . 1 1 24 24 ILE CD1 C 13 12.385 0.3 . 1 . . . A 25 ILE CD1 . 25324 1 285 . 1 1 24 24 ILE N N 15 123.447 0.3 . 1 . . . A 25 ILE N . 25324 1 286 . 1 1 25 25 GLY H H 1 3.381 0.020 . 1 . . . A 26 GLY H . 25324 1 287 . 1 1 25 25 GLY HA2 H 1 4.522 0.020 . 2 . . . A 26 GLY HA2 . 25324 1 288 . 1 1 25 25 GLY HA3 H 1 3.268 0.020 . 2 . . . A 26 GLY HA3 . 25324 1 289 . 1 1 25 25 GLY C C 13 172.122 0.3 . 1 . . . A 26 GLY C . 25324 1 290 . 1 1 25 25 GLY CA C 13 44.078 0.3 . 1 . . . A 26 GLY CA . 25324 1 291 . 1 1 25 25 GLY N N 15 111.544 0.3 . 1 . . . A 26 GLY N . 25324 1 292 . 1 1 26 26 SER H H 1 8.212 0.020 . 1 . . . A 27 SER H . 25324 1 293 . 1 1 26 26 SER HA H 1 4.876 0.020 . 1 . . . A 27 SER HA . 25324 1 294 . 1 1 26 26 SER HB2 H 1 4.174 0.020 . 2 . . . A 27 SER HB2 . 25324 1 295 . 1 1 26 26 SER HB3 H 1 3.999 0.020 . 2 . . . A 27 SER HB3 . 25324 1 296 . 1 1 26 26 SER C C 13 174.113 0.3 . 1 . . . A 27 SER C . 25324 1 297 . 1 1 26 26 SER CA C 13 56.954 0.3 . 1 . . . A 27 SER CA . 25324 1 298 . 1 1 26 26 SER CB C 13 64.554 0.3 . 1 . . . A 27 SER CB . 25324 1 299 . 1 1 26 26 SER N N 15 112.279 0.3 . 1 . . . A 27 SER N . 25324 1 300 . 1 1 27 27 ARG H H 1 7.849 0.020 . 1 . . . A 28 ARG H . 25324 1 301 . 1 1 27 27 ARG HA H 1 4.763 0.020 . 1 . . . A 28 ARG HA . 25324 1 302 . 1 1 27 27 ARG HB2 H 1 1.869 0.020 . 1 . . . A 28 ARG HB2 . 25324 1 303 . 1 1 27 27 ARG HB3 H 1 1.869 0.020 . 1 . . . A 28 ARG HB3 . 25324 1 304 . 1 1 27 27 ARG HG2 H 1 1.250 0.020 . 1 . . . A 28 ARG HG2 . 25324 1 305 . 1 1 27 27 ARG HG3 H 1 1.250 0.020 . 1 . . . A 28 ARG HG3 . 25324 1 306 . 1 1 27 27 ARG HD2 H 1 2.681 0.020 . 1 . . . A 28 ARG HD2 . 25324 1 307 . 1 1 27 27 ARG HD3 H 1 2.681 0.020 . 1 . . . A 28 ARG HD3 . 25324 1 308 . 1 1 27 27 ARG HE H 1 6.454 0.020 . 1 . . . A 28 ARG HE . 25324 1 309 . 1 1 27 27 ARG C C 13 176.119 0.3 . 1 . . . A 28 ARG C . 25324 1 310 . 1 1 27 27 ARG CA C 13 55.117 0.3 . 1 . . . A 28 ARG CA . 25324 1 311 . 1 1 27 27 ARG CB C 13 31.830 0.3 . 1 . . . A 28 ARG CB . 25324 1 312 . 1 1 27 27 ARG CG C 13 26.471 0.3 . 1 . . . A 28 ARG CG . 25324 1 313 . 1 1 27 27 ARG CD C 13 43.204 0.3 . 1 . . . A 28 ARG CD . 25324 1 314 . 1 1 27 27 ARG N N 15 120.872 0.3 . 1 . . . A 28 ARG N . 25324 1 315 . 1 1 27 27 ARG NE N 15 84.869 0.3 . 1 . . . A 28 ARG NE . 25324 1 316 . 1 1 28 28 SER H H 1 8.892 0.020 . 1 . . . A 29 SER H . 25324 1 317 . 1 1 28 28 SER HA H 1 4.192 0.020 . 1 . . . A 29 SER HA . 25324 1 318 . 1 1 28 28 SER HB2 H 1 3.866 0.020 . 1 . . . A 29 SER HB2 . 25324 1 319 . 1 1 28 28 SER HB3 H 1 3.866 0.020 . 1 . . . A 29 SER HB3 . 25324 1 320 . 1 1 28 28 SER C C 13 174.622 0.3 . 1 . . . A 29 SER C . 25324 1 321 . 1 1 28 28 SER CA C 13 60.072 0.3 . 1 . . . A 29 SER CA . 25324 1 322 . 1 1 28 28 SER CB C 13 62.876 0.3 . 1 . . . A 29 SER CB . 25324 1 323 . 1 1 28 28 SER N N 15 118.985 0.3 . 1 . . . A 29 SER N . 25324 1 324 . 1 1 29 29 ASP H H 1 8.441 0.020 . 1 . . . A 30 ASP H . 25324 1 325 . 1 1 29 29 ASP HA H 1 4.618 0.020 . 1 . . . A 30 ASP HA . 25324 1 326 . 1 1 29 29 ASP HB2 H 1 2.738 0.020 . 2 . . . A 30 ASP HB2 . 25324 1 327 . 1 1 29 29 ASP HB3 H 1 2.614 0.020 . 2 . . . A 30 ASP HB3 . 25324 1 328 . 1 1 29 29 ASP C C 13 175.101 0.3 . 1 . . . A 30 ASP C . 25324 1 329 . 1 1 29 29 ASP CA C 13 53.052 0.3 . 1 . . . A 30 ASP CA . 25324 1 330 . 1 1 29 29 ASP CB C 13 40.523 0.3 . 1 . . . A 30 ASP CB . 25324 1 331 . 1 1 29 29 ASP N N 15 117.632 0.3 . 1 . . . A 30 ASP N . 25324 1 332 . 1 1 30 30 GLN H H 1 7.029 0.020 . 1 . . . A 31 GLN H . 25324 1 333 . 1 1 30 30 GLN HA H 1 4.485 0.020 . 1 . . . A 31 GLN HA . 25324 1 334 . 1 1 30 30 GLN HB2 H 1 1.926 0.020 . 2 . . . A 31 GLN HB2 . 25324 1 335 . 1 1 30 30 GLN HB3 H 1 1.564 0.020 . 2 . . . A 31 GLN HB3 . 25324 1 336 . 1 1 30 30 GLN HG2 H 1 2.277 0.020 . 1 . . . A 31 GLN HG2 . 25324 1 337 . 1 1 30 30 GLN HG3 H 1 2.277 0.020 . 1 . . . A 31 GLN HG3 . 25324 1 338 . 1 1 30 30 GLN HE21 H 1 7.575 0.020 . 1 . . . A 31 GLN HE21 . 25324 1 339 . 1 1 30 30 GLN HE22 H 1 6.867 0.020 . 1 . . . A 31 GLN HE22 . 25324 1 340 . 1 1 30 30 GLN C C 13 173.453 0.3 . 1 . . . A 31 GLN C . 25324 1 341 . 1 1 30 30 GLN CA C 13 54.868 0.3 . 1 . . . A 31 GLN CA . 25324 1 342 . 1 1 30 30 GLN CB C 13 33.249 0.3 . 1 . . . A 31 GLN CB . 25324 1 343 . 1 1 30 30 GLN CG C 13 34.213 0.3 . 1 . . . A 31 GLN CG . 25324 1 344 . 1 1 30 30 GLN N N 15 118.273 0.3 . 1 . . . A 31 GLN N . 25324 1 345 . 1 1 30 30 GLN NE2 N 15 112.991 0.3 . 1 . . . A 31 GLN NE2 . 25324 1 346 . 1 1 31 31 ASN H H 1 8.713 0.020 . 1 . . . A 32 ASN H . 25324 1 347 . 1 1 31 31 ASN HA H 1 5.120 0.020 . 1 . . . A 32 ASN HA . 25324 1 348 . 1 1 31 31 ASN HB2 H 1 2.902 0.020 . 2 . . . A 32 ASN HB2 . 25324 1 349 . 1 1 31 31 ASN HB3 H 1 2.692 0.020 . 2 . . . A 32 ASN HB3 . 25324 1 350 . 1 1 31 31 ASN HD21 H 1 7.473 0.020 . 1 . . . A 32 ASN HD21 . 25324 1 351 . 1 1 31 31 ASN HD22 H 1 6.836 0.020 . 1 . . . A 32 ASN HD22 . 25324 1 352 . 1 1 31 31 ASN C C 13 175.198 0.3 . 1 . . . A 32 ASN C . 25324 1 353 . 1 1 31 31 ASN CA C 13 51.869 0.3 . 1 . . . A 32 ASN CA . 25324 1 354 . 1 1 31 31 ASN CB C 13 39.630 0.3 . 1 . . . A 32 ASN CB . 25324 1 355 . 1 1 31 31 ASN N N 15 120.865 0.3 . 1 . . . A 32 ASN N . 25324 1 356 . 1 1 31 31 ASN ND2 N 15 111.560 0.3 . 1 . . . A 32 ASN ND2 . 25324 1 357 . 1 1 32 32 VAL H H 1 8.542 0.020 . 1 . . . A 33 VAL H . 25324 1 358 . 1 1 32 32 VAL HA H 1 3.705 0.020 . 1 . . . A 33 VAL HA . 25324 1 359 . 1 1 32 32 VAL HB H 1 1.714 0.020 . 1 . . . A 33 VAL HB . 25324 1 360 . 1 1 32 32 VAL HG11 H 1 0.742 0.020 . 2 . . . A 33 VAL HG11 . 25324 1 361 . 1 1 32 32 VAL HG12 H 1 0.742 0.020 . 2 . . . A 33 VAL HG12 . 25324 1 362 . 1 1 32 32 VAL HG13 H 1 0.742 0.020 . 2 . . . A 33 VAL HG13 . 25324 1 363 . 1 1 32 32 VAL HG21 H 1 0.624 0.020 . 2 . . . A 33 VAL HG21 . 25324 1 364 . 1 1 32 32 VAL HG22 H 1 0.624 0.020 . 2 . . . A 33 VAL HG22 . 25324 1 365 . 1 1 32 32 VAL HG23 H 1 0.624 0.020 . 2 . . . A 33 VAL HG23 . 25324 1 366 . 1 1 32 32 VAL C C 13 174.950 0.3 . 1 . . . A 33 VAL C . 25324 1 367 . 1 1 32 32 VAL CA C 13 63.847 0.3 . 1 . . . A 33 VAL CA . 25324 1 368 . 1 1 32 32 VAL CB C 13 32.350 0.3 . 1 . . . A 33 VAL CB . 25324 1 369 . 1 1 32 32 VAL CG1 C 13 23.733 0.3 . 1 . . . A 33 VAL CG1 . 25324 1 370 . 1 1 32 32 VAL CG2 C 13 21.926 0.3 . 1 . . . A 33 VAL CG2 . 25324 1 371 . 1 1 32 32 VAL N N 15 122.111 0.3 . 1 . . . A 33 VAL N . 25324 1 372 . 1 1 33 33 VAL H H 1 8.744 0.020 . 1 . . . A 34 VAL H . 25324 1 373 . 1 1 33 33 VAL HA H 1 4.645 0.020 . 1 . . . A 34 VAL HA . 25324 1 374 . 1 1 33 33 VAL HB H 1 2.522 0.020 . 1 . . . A 34 VAL HB . 25324 1 375 . 1 1 33 33 VAL HG11 H 1 0.822 0.020 . 2 . . . A 34 VAL HG11 . 25324 1 376 . 1 1 33 33 VAL HG12 H 1 0.822 0.020 . 2 . . . A 34 VAL HG12 . 25324 1 377 . 1 1 33 33 VAL HG13 H 1 0.822 0.020 . 2 . . . A 34 VAL HG13 . 25324 1 378 . 1 1 33 33 VAL HG21 H 1 0.651 0.020 . 2 . . . A 34 VAL HG21 . 25324 1 379 . 1 1 33 33 VAL HG22 H 1 0.651 0.020 . 2 . . . A 34 VAL HG22 . 25324 1 380 . 1 1 33 33 VAL HG23 H 1 0.651 0.020 . 2 . . . A 34 VAL HG23 . 25324 1 381 . 1 1 33 33 VAL C C 13 175.574 0.3 . 1 . . . A 34 VAL C . 25324 1 382 . 1 1 33 33 VAL CA C 13 59.974 0.3 . 1 . . . A 34 VAL CA . 25324 1 383 . 1 1 33 33 VAL CB C 13 33.029 0.3 . 1 . . . A 34 VAL CB . 25324 1 384 . 1 1 33 33 VAL CG1 C 13 20.479 0.3 . 1 . . . A 34 VAL CG1 . 25324 1 385 . 1 1 33 33 VAL CG2 C 13 18.170 0.3 . 1 . . . A 34 VAL CG2 . 25324 1 386 . 1 1 33 33 VAL N N 15 113.282 0.3 . 1 . . . A 34 VAL N . 25324 1 387 . 1 1 34 34 ALA H H 1 7.677 0.020 . 1 . . . A 35 ALA H . 25324 1 388 . 1 1 34 34 ALA HA H 1 4.803 0.020 . 1 . . . A 35 ALA HA . 25324 1 389 . 1 1 34 34 ALA HB1 H 1 1.472 0.020 . 1 . . . A 35 ALA HB1 . 25324 1 390 . 1 1 34 34 ALA HB2 H 1 1.472 0.020 . 1 . . . A 35 ALA HB2 . 25324 1 391 . 1 1 34 34 ALA HB3 H 1 1.472 0.020 . 1 . . . A 35 ALA HB3 . 25324 1 392 . 1 1 34 34 ALA C C 13 175.947 0.3 . 1 . . . A 35 ALA C . 25324 1 393 . 1 1 34 34 ALA CA C 13 53.250 0.3 . 1 . . . A 35 ALA CA . 25324 1 394 . 1 1 34 34 ALA CB C 13 21.628 0.3 . 1 . . . A 35 ALA CB . 25324 1 395 . 1 1 34 34 ALA N N 15 122.102 0.3 . 1 . . . A 35 ALA N . 25324 1 396 . 1 1 35 35 ILE H H 1 8.126 0.020 . 1 . . . A 36 ILE H . 25324 1 397 . 1 1 35 35 ILE HA H 1 4.028 0.020 . 1 . . . A 36 ILE HA . 25324 1 398 . 1 1 35 35 ILE HB H 1 1.363 0.020 . 1 . . . A 36 ILE HB . 25324 1 399 . 1 1 35 35 ILE HG12 H 1 1.236 0.020 . 2 . . . A 36 ILE HG12 . 25324 1 400 . 1 1 35 35 ILE HG13 H 1 0.717 0.020 . 2 . . . A 36 ILE HG13 . 25324 1 401 . 1 1 35 35 ILE HG21 H 1 0.457 0.020 . 1 . . . A 36 ILE HG21 . 25324 1 402 . 1 1 35 35 ILE HG22 H 1 0.457 0.020 . 1 . . . A 36 ILE HG22 . 25324 1 403 . 1 1 35 35 ILE HG23 H 1 0.457 0.020 . 1 . . . A 36 ILE HG23 . 25324 1 404 . 1 1 35 35 ILE HD11 H 1 0.592 0.020 . 1 . . . A 36 ILE HD11 . 25324 1 405 . 1 1 35 35 ILE HD12 H 1 0.592 0.020 . 1 . . . A 36 ILE HD12 . 25324 1 406 . 1 1 35 35 ILE HD13 H 1 0.592 0.020 . 1 . . . A 36 ILE HD13 . 25324 1 407 . 1 1 35 35 ILE C C 13 173.116 0.3 . 1 . . . A 36 ILE C . 25324 1 408 . 1 1 35 35 ILE CA C 13 62.182 0.3 . 1 . . . A 36 ILE CA . 25324 1 409 . 1 1 35 35 ILE CB C 13 42.485 0.3 . 1 . . . A 36 ILE CB . 25324 1 410 . 1 1 35 35 ILE CG1 C 13 27.663 0.3 . 1 . . . A 36 ILE CG1 . 25324 1 411 . 1 1 35 35 ILE CG2 C 13 17.891 0.3 . 1 . . . A 36 ILE CG2 . 25324 1 412 . 1 1 35 35 ILE CD1 C 13 14.019 0.3 . 1 . . . A 36 ILE CD1 . 25324 1 413 . 1 1 35 35 ILE N N 15 118.005 0.3 . 1 . . . A 36 ILE N . 25324 1 414 . 1 1 36 36 ASN H H 1 8.577 0.020 . 1 . . . A 37 ASN H . 25324 1 415 . 1 1 36 36 ASN HA H 1 5.681 0.020 . 1 . . . A 37 ASN HA . 25324 1 416 . 1 1 36 36 ASN HB2 H 1 2.772 0.020 . 2 . . . A 37 ASN HB2 . 25324 1 417 . 1 1 36 36 ASN HB3 H 1 2.580 0.020 . 2 . . . A 37 ASN HB3 . 25324 1 418 . 1 1 36 36 ASN HD21 H 1 7.429 0.020 . 1 . . . A 37 ASN HD21 . 25324 1 419 . 1 1 36 36 ASN HD22 H 1 6.626 0.020 . 1 . . . A 37 ASN HD22 . 25324 1 420 . 1 1 36 36 ASN C C 13 174.854 0.3 . 1 . . . A 37 ASN C . 25324 1 421 . 1 1 36 36 ASN CA C 13 52.530 0.3 . 1 . . . A 37 ASN CA . 25324 1 422 . 1 1 36 36 ASN CB C 13 38.853 0.3 . 1 . . . A 37 ASN CB . 25324 1 423 . 1 1 36 36 ASN N N 15 125.632 0.3 . 1 . . . A 37 ASN N . 25324 1 424 . 1 1 36 36 ASN ND2 N 15 110.032 0.3 . 1 . . . A 37 ASN ND2 . 25324 1 425 . 1 1 37 37 VAL H H 1 8.874 0.020 . 1 . . . A 38 VAL H . 25324 1 426 . 1 1 37 37 VAL HA H 1 5.203 0.020 . 1 . . . A 38 VAL HA . 25324 1 427 . 1 1 37 37 VAL HB H 1 1.571 0.020 . 1 . . . A 38 VAL HB . 25324 1 428 . 1 1 37 37 VAL HG11 H 1 0.017 0.020 . 2 . . . A 38 VAL HG11 . 25324 1 429 . 1 1 37 37 VAL HG12 H 1 0.017 0.020 . 2 . . . A 38 VAL HG12 . 25324 1 430 . 1 1 37 37 VAL HG13 H 1 0.017 0.020 . 2 . . . A 38 VAL HG13 . 25324 1 431 . 1 1 37 37 VAL HG21 H 1 0.317 0.020 . 2 . . . A 38 VAL HG21 . 25324 1 432 . 1 1 37 37 VAL HG22 H 1 0.317 0.020 . 2 . . . A 38 VAL HG22 . 25324 1 433 . 1 1 37 37 VAL HG23 H 1 0.317 0.020 . 2 . . . A 38 VAL HG23 . 25324 1 434 . 1 1 37 37 VAL C C 13 174.854 0.3 . 1 . . . A 38 VAL C . 25324 1 435 . 1 1 37 37 VAL CA C 13 57.980 0.3 . 1 . . . A 38 VAL CA . 25324 1 436 . 1 1 37 37 VAL CB C 13 36.044 0.3 . 1 . . . A 38 VAL CB . 25324 1 437 . 1 1 37 37 VAL CG1 C 13 21.104 0.3 . 1 . . . A 38 VAL CG1 . 25324 1 438 . 1 1 37 37 VAL CG2 C 13 19.183 0.3 . 1 . . . A 38 VAL CG2 . 25324 1 439 . 1 1 37 37 VAL N N 15 114.223 0.3 . 1 . . . A 38 VAL N . 25324 1 440 . 1 1 38 38 GLU H H 1 8.761 0.020 . 1 . . . A 39 GLU H . 25324 1 441 . 1 1 38 38 GLU HA H 1 5.082 0.020 . 1 . . . A 39 GLU HA . 25324 1 442 . 1 1 38 38 GLU HB2 H 1 2.098 0.020 . 1 . . . A 39 GLU HB2 . 25324 1 443 . 1 1 38 38 GLU HB3 H 1 2.098 0.020 . 1 . . . A 39 GLU HB3 . 25324 1 444 . 1 1 38 38 GLU HG2 H 1 2.254 0.020 . 1 . . . A 39 GLU HG2 . 25324 1 445 . 1 1 38 38 GLU HG3 H 1 2.254 0.020 . 1 . . . A 39 GLU HG3 . 25324 1 446 . 1 1 38 38 GLU C C 13 174.548 0.3 . 1 . . . A 39 GLU C . 25324 1 447 . 1 1 38 38 GLU CA C 13 54.993 0.3 . 1 . . . A 39 GLU CA . 25324 1 448 . 1 1 38 38 GLU CB C 13 33.578 0.3 . 1 . . . A 39 GLU CB . 25324 1 449 . 1 1 38 38 GLU CG C 13 34.529 0.3 . 1 . . . A 39 GLU CG . 25324 1 450 . 1 1 38 38 GLU N N 15 118.277 0.3 . 1 . . . A 39 GLU N . 25324 1 451 . 1 1 39 39 SER H H 1 8.500 0.020 . 1 . . . A 40 SER H . 25324 1 452 . 1 1 39 39 SER HA H 1 5.265 0.020 . 1 . . . A 40 SER HA . 25324 1 453 . 1 1 39 39 SER HB2 H 1 4.184 0.020 . 2 . . . A 40 SER HB2 . 25324 1 454 . 1 1 39 39 SER HB3 H 1 3.675 0.020 . 2 . . . A 40 SER HB3 . 25324 1 455 . 1 1 39 39 SER C C 13 175.783 0.3 . 1 . . . A 40 SER C . 25324 1 456 . 1 1 39 39 SER CA C 13 55.880 0.3 . 1 . . . A 40 SER CA . 25324 1 457 . 1 1 39 39 SER CB C 13 65.911 0.3 . 1 . . . A 40 SER CB . 25324 1 458 . 1 1 39 39 SER N N 15 114.960 0.3 . 1 . . . A 40 SER N . 25324 1 459 . 1 1 40 40 GLY H H 1 9.533 0.020 . 1 . . . A 41 GLY H . 25324 1 460 . 1 1 40 40 GLY HA2 H 1 4.721 0.020 . 2 . . . A 41 GLY HA2 . 25324 1 461 . 1 1 40 40 GLY HA3 H 1 3.714 0.020 . 2 . . . A 41 GLY HA3 . 25324 1 462 . 1 1 40 40 GLY C C 13 174.119 0.3 . 1 . . . A 41 GLY C . 25324 1 463 . 1 1 40 40 GLY CA C 13 44.688 0.3 . 1 . . . A 41 GLY CA . 25324 1 464 . 1 1 40 40 GLY N N 15 117.567 0.3 . 1 . . . A 41 GLY N . 25324 1 465 . 1 1 41 41 ASP H H 1 8.644 0.020 . 1 . . . A 42 ASP H . 25324 1 466 . 1 1 41 41 ASP HA H 1 4.800 0.020 . 1 . . . A 42 ASP HA . 25324 1 467 . 1 1 41 41 ASP HB2 H 1 3.006 0.020 . 2 . . . A 42 ASP HB2 . 25324 1 468 . 1 1 41 41 ASP HB3 H 1 2.390 0.020 . 2 . . . A 42 ASP HB3 . 25324 1 469 . 1 1 41 41 ASP C C 13 176.121 0.3 . 1 . . . A 42 ASP C . 25324 1 470 . 1 1 41 41 ASP CA C 13 52.146 0.3 . 1 . . . A 42 ASP CA . 25324 1 471 . 1 1 41 41 ASP CB C 13 39.354 0.3 . 1 . . . A 42 ASP CB . 25324 1 472 . 1 1 41 41 ASP N N 15 122.141 0.3 . 1 . . . A 42 ASP N . 25324 1 473 . 1 1 42 42 ASP H H 1 9.111 0.020 . 1 . . . A 43 ASP H . 25324 1 474 . 1 1 42 42 ASP HA H 1 4.229 0.020 . 1 . . . A 43 ASP HA . 25324 1 475 . 1 1 42 42 ASP HB2 H 1 2.969 0.020 . 2 . . . A 43 ASP HB2 . 25324 1 476 . 1 1 42 42 ASP HB3 H 1 2.836 0.020 . 2 . . . A 43 ASP HB3 . 25324 1 477 . 1 1 42 42 ASP C C 13 176.018 0.3 . 1 . . . A 43 ASP C . 25324 1 478 . 1 1 42 42 ASP CA C 13 55.249 0.3 . 1 . . . A 43 ASP CA . 25324 1 479 . 1 1 42 42 ASP CB C 13 38.559 0.3 . 1 . . . A 43 ASP CB . 25324 1 480 . 1 1 42 42 ASP N N 15 116.025 0.3 . 1 . . . A 43 ASP N . 25324 1 481 . 1 1 43 43 GLY H H 1 9.063 0.020 . 1 . . . A 44 GLY H . 25324 1 482 . 1 1 43 43 GLY HA2 H 1 4.202 0.020 . 2 . . . A 44 GLY HA2 . 25324 1 483 . 1 1 43 43 GLY HA3 H 1 3.621 0.020 . 2 . . . A 44 GLY HA3 . 25324 1 484 . 1 1 43 43 GLY C C 13 173.922 0.3 . 1 . . . A 44 GLY C . 25324 1 485 . 1 1 43 43 GLY CA C 13 45.301 0.3 . 1 . . . A 44 GLY CA . 25324 1 486 . 1 1 43 43 GLY N N 15 104.263 0.3 . 1 . . . A 44 GLY N . 25324 1 487 . 1 1 44 44 GLN H H 1 7.356 0.020 . 1 . . . A 45 GLN H . 25324 1 488 . 1 1 44 44 GLN HA H 1 4.086 0.020 . 1 . . . A 45 GLN HA . 25324 1 489 . 1 1 44 44 GLN HB2 H 1 2.105 0.020 . 2 . . . A 45 GLN HB2 . 25324 1 490 . 1 1 44 44 GLN HB3 H 1 2.005 0.020 . 2 . . . A 45 GLN HB3 . 25324 1 491 . 1 1 44 44 GLN HG2 H 1 2.476 0.020 . 2 . . . A 45 GLN HG2 . 25324 1 492 . 1 1 44 44 GLN HG3 H 1 2.376 0.020 . 2 . . . A 45 GLN HG3 . 25324 1 493 . 1 1 44 44 GLN HE21 H 1 7.442 0.020 . 1 . . . A 45 GLN HE21 . 25324 1 494 . 1 1 44 44 GLN HE22 H 1 6.798 0.020 . 1 . . . A 45 GLN HE22 . 25324 1 495 . 1 1 44 44 GLN C C 13 176.284 0.3 . 1 . . . A 45 GLN C . 25324 1 496 . 1 1 44 44 GLN CA C 13 58.118 0.3 . 1 . . . A 45 GLN CA . 25324 1 497 . 1 1 44 44 GLN CB C 13 27.674 0.3 . 1 . . . A 45 GLN CB . 25324 1 498 . 1 1 44 44 GLN CG C 13 33.793 0.3 . 1 . . . A 45 GLN CG . 25324 1 499 . 1 1 44 44 GLN N N 15 121.691 0.3 . 1 . . . A 45 GLN N . 25324 1 500 . 1 1 44 44 GLN NE2 N 15 112.410 0.3 . 1 . . . A 45 GLN NE2 . 25324 1 501 . 1 1 45 45 THR H H 1 10.123 0.020 . 1 . . . A 46 THR H . 25324 1 502 . 1 1 45 45 THR HA H 1 5.355 0.020 . 1 . . . A 46 THR HA . 25324 1 503 . 1 1 45 45 THR HB H 1 4.120 0.020 . 1 . . . A 46 THR HB . 25324 1 504 . 1 1 45 45 THR HG21 H 1 1.232 0.020 . 1 . . . A 46 THR HG21 . 25324 1 505 . 1 1 45 45 THR HG22 H 1 1.232 0.020 . 1 . . . A 46 THR HG22 . 25324 1 506 . 1 1 45 45 THR HG23 H 1 1.232 0.020 . 1 . . . A 46 THR HG23 . 25324 1 507 . 1 1 45 45 THR C C 13 174.451 0.3 . 1 . . . A 46 THR C . 25324 1 508 . 1 1 45 45 THR CA C 13 59.644 0.3 . 1 . . . A 46 THR CA . 25324 1 509 . 1 1 45 45 THR CB C 13 72.714 0.3 . 1 . . . A 46 THR CB . 25324 1 510 . 1 1 45 45 THR CG2 C 13 22.151 0.3 . 1 . . . A 46 THR CG2 . 25324 1 511 . 1 1 45 45 THR N N 15 111.843 0.3 . 1 . . . A 46 THR N . 25324 1 512 . 1 1 46 46 LEU H H 1 8.364 0.020 . 1 . . . A 47 LEU H . 25324 1 513 . 1 1 46 46 LEU HA H 1 4.807 0.020 . 1 . . . A 47 LEU HA . 25324 1 514 . 1 1 46 46 LEU HB2 H 1 1.412 0.020 . 2 . . . A 47 LEU HB2 . 25324 1 515 . 1 1 46 46 LEU HB3 H 1 0.961 0.020 . 2 . . . A 47 LEU HB3 . 25324 1 516 . 1 1 46 46 LEU HG H 1 1.376 0.020 . 1 . . . A 47 LEU HG . 25324 1 517 . 1 1 46 46 LEU HD11 H 1 0.134 0.020 . 2 . . . A 47 LEU HD11 . 25324 1 518 . 1 1 46 46 LEU HD12 H 1 0.134 0.020 . 2 . . . A 47 LEU HD12 . 25324 1 519 . 1 1 46 46 LEU HD13 H 1 0.134 0.020 . 2 . . . A 47 LEU HD13 . 25324 1 520 . 1 1 46 46 LEU HD21 H 1 0.474 0.020 . 2 . . . A 47 LEU HD21 . 25324 1 521 . 1 1 46 46 LEU HD22 H 1 0.474 0.020 . 2 . . . A 47 LEU HD22 . 25324 1 522 . 1 1 46 46 LEU HD23 H 1 0.474 0.020 . 2 . . . A 47 LEU HD23 . 25324 1 523 . 1 1 46 46 LEU C C 13 175.487 0.3 . 1 . . . A 47 LEU C . 25324 1 524 . 1 1 46 46 LEU CA C 13 53.070 0.3 . 1 . . . A 47 LEU CA . 25324 1 525 . 1 1 46 46 LEU CB C 13 48.003 0.3 . 1 . . . A 47 LEU CB . 25324 1 526 . 1 1 46 46 LEU CG C 13 26.182 0.3 . 1 . . . A 47 LEU CG . 25324 1 527 . 1 1 46 46 LEU CD1 C 13 25.317 0.3 . 1 . . . A 47 LEU CD1 . 25324 1 528 . 1 1 46 46 LEU CD2 C 13 23.361 0.3 . 1 . . . A 47 LEU CD2 . 25324 1 529 . 1 1 46 46 LEU N N 15 119.302 0.3 . 1 . . . A 47 LEU N . 25324 1 530 . 1 1 47 47 ASN H H 1 8.748 0.020 . 1 . . . A 48 ASN H . 25324 1 531 . 1 1 47 47 ASN HA H 1 5.729 0.020 . 1 . . . A 48 ASN HA . 25324 1 532 . 1 1 47 47 ASN HB2 H 1 2.889 0.020 . 2 . . . A 48 ASN HB2 . 25324 1 533 . 1 1 47 47 ASN HB3 H 1 2.763 0.020 . 2 . . . A 48 ASN HB3 . 25324 1 534 . 1 1 47 47 ASN HD21 H 1 7.580 0.020 . 1 . . . A 48 ASN HD21 . 25324 1 535 . 1 1 47 47 ASN HD22 H 1 6.870 0.020 . 1 . . . A 48 ASN HD22 . 25324 1 536 . 1 1 47 47 ASN C C 13 174.460 0.3 . 1 . . . A 48 ASN C . 25324 1 537 . 1 1 47 47 ASN CA C 13 52.739 0.3 . 1 . . . A 48 ASN CA . 25324 1 538 . 1 1 47 47 ASN CB C 13 43.413 0.3 . 1 . . . A 48 ASN CB . 25324 1 539 . 1 1 47 47 ASN N N 15 116.844 0.3 . 1 . . . A 48 ASN N . 25324 1 540 . 1 1 47 47 ASN ND2 N 15 113.524 0.3 . 1 . . . A 48 ASN ND2 . 25324 1 541 . 1 1 48 48 GLY H H 1 8.744 0.020 . 1 . . . A 49 GLY H . 25324 1 542 . 1 1 48 48 GLY HA2 H 1 5.223 0.020 . 2 . . . A 49 GLY HA2 . 25324 1 543 . 1 1 48 48 GLY HA3 H 1 4.105 0.020 . 2 . . . A 49 GLY HA3 . 25324 1 544 . 1 1 48 48 GLY C C 13 172.126 0.3 . 1 . . . A 49 GLY C . 25324 1 545 . 1 1 48 48 GLY CA C 13 46.491 0.3 . 1 . . . A 49 GLY CA . 25324 1 546 . 1 1 48 48 GLY N N 15 109.417 0.3 . 1 . . . A 49 GLY N . 25324 1 547 . 1 1 49 49 THR H H 1 8.799 0.020 . 1 . . . A 50 THR H . 25324 1 548 . 1 1 49 49 THR HA H 1 5.556 0.020 . 1 . . . A 50 THR HA . 25324 1 549 . 1 1 49 49 THR HB H 1 4.241 0.020 . 1 . . . A 50 THR HB . 25324 1 550 . 1 1 49 49 THR HG21 H 1 1.197 0.020 . 1 . . . A 50 THR HG21 . 25324 1 551 . 1 1 49 49 THR HG22 H 1 1.197 0.020 . 1 . . . A 50 THR HG22 . 25324 1 552 . 1 1 49 49 THR HG23 H 1 1.197 0.020 . 1 . . . A 50 THR HG23 . 25324 1 553 . 1 1 49 49 THR C C 13 171.790 0.3 . 1 . . . A 50 THR C . 25324 1 554 . 1 1 49 49 THR CA C 13 59.371 0.3 . 1 . . . A 50 THR CA . 25324 1 555 . 1 1 49 49 THR CB C 13 72.799 0.3 . 1 . . . A 50 THR CB . 25324 1 556 . 1 1 49 49 THR CG2 C 13 20.285 0.3 . 1 . . . A 50 THR CG2 . 25324 1 557 . 1 1 49 49 THR N N 15 119.162 0.3 . 1 . . . A 50 THR N . 25324 1 558 . 1 1 50 50 MET H H 1 9.062 0.020 . 1 . . . A 51 MET H . 25324 1 559 . 1 1 50 50 MET HA H 1 4.886 0.020 . 1 . . . A 51 MET HA . 25324 1 560 . 1 1 50 50 MET HB2 H 1 1.728 0.020 . 1 . . . A 51 MET HB2 . 25324 1 561 . 1 1 50 50 MET HB3 H 1 1.728 0.020 . 1 . . . A 51 MET HB3 . 25324 1 562 . 1 1 50 50 MET HG2 H 1 2.357 0.020 . 2 . . . A 51 MET HG2 . 25324 1 563 . 1 1 50 50 MET HG3 H 1 2.147 0.020 . 2 . . . A 51 MET HG3 . 25324 1 564 . 1 1 50 50 MET HE1 H 1 1.531 0.020 . 1 . . . A 51 MET HE1 . 25324 1 565 . 1 1 50 50 MET HE2 H 1 1.531 0.020 . 1 . . . A 51 MET HE2 . 25324 1 566 . 1 1 50 50 MET HE3 H 1 1.531 0.020 . 1 . . . A 51 MET HE3 . 25324 1 567 . 1 1 50 50 MET C C 13 172.708 0.3 . 1 . . . A 51 MET C . 25324 1 568 . 1 1 50 50 MET CA C 13 54.722 0.3 . 1 . . . A 51 MET CA . 25324 1 569 . 1 1 50 50 MET CB C 13 34.557 0.3 . 1 . . . A 51 MET CB . 25324 1 570 . 1 1 50 50 MET CG C 13 30.027 0.3 . 1 . . . A 51 MET CG . 25324 1 571 . 1 1 50 50 MET CE C 13 17.861 0.3 . 1 . . . A 51 MET CE . 25324 1 572 . 1 1 50 50 MET N N 15 115.232 0.3 . 1 . . . A 51 MET N . 25324 1 573 . 1 1 51 51 THR H H 1 8.685 0.020 . 1 . . . A 52 THR H . 25324 1 574 . 1 1 51 51 THR HA H 1 4.682 0.020 . 1 . . . A 52 THR HA . 25324 1 575 . 1 1 51 51 THR HB H 1 3.647 0.020 . 1 . . . A 52 THR HB . 25324 1 576 . 1 1 51 51 THR HG21 H 1 1.023 0.020 . 1 . . . A 52 THR HG21 . 25324 1 577 . 1 1 51 51 THR HG22 H 1 1.023 0.020 . 1 . . . A 52 THR HG22 . 25324 1 578 . 1 1 51 51 THR HG23 H 1 1.023 0.020 . 1 . . . A 52 THR HG23 . 25324 1 579 . 1 1 51 51 THR C C 13 173.952 0.3 . 1 . . . A 52 THR C . 25324 1 580 . 1 1 51 51 THR CA C 13 61.395 0.3 . 1 . . . A 52 THR CA . 25324 1 581 . 1 1 51 51 THR CB C 13 71.734 0.3 . 1 . . . A 52 THR CB . 25324 1 582 . 1 1 51 51 THR CG2 C 13 22.587 0.3 . 1 . . . A 52 THR CG2 . 25324 1 583 . 1 1 51 51 THR N N 15 113.697 0.3 . 1 . . . A 52 THR N . 25324 1 584 . 1 1 52 52 TYR H H 1 10.112 0.020 . 1 . . . A 53 TYR H . 25324 1 585 . 1 1 52 52 TYR HA H 1 4.800 0.020 . 1 . . . A 53 TYR HA . 25324 1 586 . 1 1 52 52 TYR HB2 H 1 2.761 0.020 . 2 . . . A 53 TYR HB2 . 25324 1 587 . 1 1 52 52 TYR HB3 H 1 2.538 0.020 . 2 . . . A 53 TYR HB3 . 25324 1 588 . 1 1 52 52 TYR HD1 H 1 6.910 0.020 . 1 . . . A 53 TYR HD1 . 25324 1 589 . 1 1 52 52 TYR HD2 H 1 6.910 0.020 . 1 . . . A 53 TYR HD2 . 25324 1 590 . 1 1 52 52 TYR HE1 H 1 7.047 0.020 . 1 . . . A 53 TYR HE1 . 25324 1 591 . 1 1 52 52 TYR HE2 H 1 7.047 0.020 . 1 . . . A 53 TYR HE2 . 25324 1 592 . 1 1 52 52 TYR C C 13 175.214 0.3 . 1 . . . A 53 TYR C . 25324 1 593 . 1 1 52 52 TYR CA C 13 58.881 0.3 . 1 . . . A 53 TYR CA . 25324 1 594 . 1 1 52 52 TYR CB C 13 40.512 0.3 . 1 . . . A 53 TYR CB . 25324 1 595 . 1 1 52 52 TYR CD1 C 13 132.880 0.3 . 1 . . . A 53 TYR CD1 . 25324 1 596 . 1 1 52 52 TYR CE1 C 13 118.386 0.3 . 1 . . . A 53 TYR CE1 . 25324 1 597 . 1 1 52 52 TYR N N 15 129.086 0.3 . 1 . . . A 53 TYR N . 25324 1 598 . 1 1 53 53 ALA H H 1 8.704 0.020 . 1 . . . A 54 ALA H . 25324 1 599 . 1 1 53 53 ALA HA H 1 4.002 0.020 . 1 . . . A 54 ALA HA . 25324 1 600 . 1 1 53 53 ALA HB1 H 1 1.417 0.020 . 1 . . . A 54 ALA HB1 . 25324 1 601 . 1 1 53 53 ALA HB2 H 1 1.417 0.020 . 1 . . . A 54 ALA HB2 . 25324 1 602 . 1 1 53 53 ALA HB3 H 1 1.417 0.020 . 1 . . . A 54 ALA HB3 . 25324 1 603 . 1 1 53 53 ALA C C 13 178.285 0.3 . 1 . . . A 54 ALA C . 25324 1 604 . 1 1 53 53 ALA CA C 13 53.971 0.3 . 1 . . . A 54 ALA CA . 25324 1 605 . 1 1 53 53 ALA CB C 13 18.717 0.3 . 1 . . . A 54 ALA CB . 25324 1 606 . 1 1 53 53 ALA N N 15 119.947 0.3 . 1 . . . A 54 ALA N . 25324 1 607 . 1 1 54 54 GLY H H 1 8.745 0.020 . 1 . . . A 55 GLY H . 25324 1 608 . 1 1 54 54 GLY HA2 H 1 4.202 0.020 . 2 . . . A 55 GLY HA2 . 25324 1 609 . 1 1 54 54 GLY HA3 H 1 3.714 0.020 . 2 . . . A 55 GLY HA3 . 25324 1 610 . 1 1 54 54 GLY C C 13 173.903 0.3 . 1 . . . A 55 GLY C . 25324 1 611 . 1 1 54 54 GLY CA C 13 45.016 0.3 . 1 . . . A 55 GLY CA . 25324 1 612 . 1 1 54 54 GLY N N 15 110.940 0.3 . 1 . . . A 55 GLY N . 25324 1 613 . 1 1 55 55 GLU H H 1 8.039 0.020 . 1 . . . A 56 GLU H . 25324 1 614 . 1 1 55 55 GLU HA H 1 4.709 0.020 . 1 . . . A 56 GLU HA . 25324 1 615 . 1 1 55 55 GLU HB2 H 1 2.392 0.020 . 1 . . . A 56 GLU HB2 . 25324 1 616 . 1 1 55 55 GLU HB3 H 1 2.392 0.020 . 1 . . . A 56 GLU HB3 . 25324 1 617 . 1 1 55 55 GLU HG2 H 1 2.174 0.020 . 2 . . . A 56 GLU HG2 . 25324 1 618 . 1 1 55 55 GLU HG3 H 1 1.980 0.020 . 2 . . . A 56 GLU HG3 . 25324 1 619 . 1 1 55 55 GLU C C 13 175.906 0.3 . 1 . . . A 56 GLU C . 25324 1 620 . 1 1 55 55 GLU CA C 13 54.423 0.3 . 1 . . . A 56 GLU CA . 25324 1 621 . 1 1 55 55 GLU CB C 13 32.824 0.3 . 1 . . . A 56 GLU CB . 25324 1 622 . 1 1 55 55 GLU CG C 13 36.333 0.3 . 1 . . . A 56 GLU CG . 25324 1 623 . 1 1 55 55 GLU N N 15 120.073 0.3 . 1 . . . A 56 GLU N . 25324 1 624 . 1 1 56 56 GLY H H 1 7.937 0.020 . 1 . . . A 57 GLY H . 25324 1 625 . 1 1 56 56 GLY HA2 H 1 4.557 0.020 . 2 . . . A 57 GLY HA2 . 25324 1 626 . 1 1 56 56 GLY HA3 H 1 3.789 0.020 . 2 . . . A 57 GLY HA3 . 25324 1 627 . 1 1 56 56 GLY CA C 13 43.802 0.3 . 1 . . . A 57 GLY CA . 25324 1 628 . 1 1 56 56 GLY N N 15 105.298 0.3 . 1 . . . A 57 GLY N . 25324 1 629 . 1 1 57 57 PRO HA H 1 4.934 0.020 . 1 . . . A 58 PRO HA . 25324 1 630 . 1 1 57 57 PRO HB2 H 1 2.089 0.020 . 2 . . . A 58 PRO HB2 . 25324 1 631 . 1 1 57 57 PRO HB3 H 1 1.752 0.020 . 2 . . . A 58 PRO HB3 . 25324 1 632 . 1 1 57 57 PRO HG2 H 1 2.045 0.020 . 2 . . . A 58 PRO HG2 . 25324 1 633 . 1 1 57 57 PRO HG3 H 1 1.956 0.020 . 2 . . . A 58 PRO HG3 . 25324 1 634 . 1 1 57 57 PRO HD2 H 1 3.626 0.020 . 1 . . . A 58 PRO HD2 . 25324 1 635 . 1 1 57 57 PRO HD3 H 1 3.626 0.020 . 1 . . . A 58 PRO HD3 . 25324 1 636 . 1 1 57 57 PRO C C 13 177.785 0.3 . 1 . . . A 58 PRO C . 25324 1 637 . 1 1 57 57 PRO CA C 13 63.132 0.3 . 1 . . . A 58 PRO CA . 25324 1 638 . 1 1 57 57 PRO CB C 13 31.840 0.3 . 1 . . . A 58 PRO CB . 25324 1 639 . 1 1 57 57 PRO CG C 13 27.347 0.3 . 1 . . . A 58 PRO CG . 25324 1 640 . 1 1 57 57 PRO CD C 13 49.050 0.3 . 1 . . . A 58 PRO CD . 25324 1 641 . 1 1 58 58 ILE H H 1 9.600 0.020 . 1 . . . A 59 ILE H . 25324 1 642 . 1 1 58 58 ILE HA H 1 4.988 0.020 . 1 . . . A 59 ILE HA . 25324 1 643 . 1 1 58 58 ILE HB H 1 2.323 0.020 . 1 . . . A 59 ILE HB . 25324 1 644 . 1 1 58 58 ILE HG12 H 1 1.666 0.020 . 2 . . . A 59 ILE HG12 . 25324 1 645 . 1 1 58 58 ILE HG13 H 1 1.414 0.020 . 2 . . . A 59 ILE HG13 . 25324 1 646 . 1 1 58 58 ILE HG21 H 1 1.236 0.020 . 1 . . . A 59 ILE HG21 . 25324 1 647 . 1 1 58 58 ILE HG22 H 1 1.236 0.020 . 1 . . . A 59 ILE HG22 . 25324 1 648 . 1 1 58 58 ILE HG23 H 1 1.236 0.020 . 1 . . . A 59 ILE HG23 . 25324 1 649 . 1 1 58 58 ILE HD11 H 1 1.130 0.020 . 1 . . . A 59 ILE HD11 . 25324 1 650 . 1 1 58 58 ILE HD12 H 1 1.130 0.020 . 1 . . . A 59 ILE HD12 . 25324 1 651 . 1 1 58 58 ILE HD13 H 1 1.130 0.020 . 1 . . . A 59 ILE HD13 . 25324 1 652 . 1 1 58 58 ILE C C 13 175.688 0.3 . 1 . . . A 59 ILE C . 25324 1 653 . 1 1 58 58 ILE CA C 13 59.543 0.3 . 1 . . . A 59 ILE CA . 25324 1 654 . 1 1 58 58 ILE CB C 13 42.288 0.3 . 1 . . . A 59 ILE CB . 25324 1 655 . 1 1 58 58 ILE CG1 C 13 24.371 0.3 . 1 . . . A 59 ILE CG1 . 25324 1 656 . 1 1 58 58 ILE CG2 C 13 17.854 0.3 . 1 . . . A 59 ILE CG2 . 25324 1 657 . 1 1 58 58 ILE CD1 C 13 14.144 0.3 . 1 . . . A 59 ILE CD1 . 25324 1 658 . 1 1 58 58 ILE N N 15 117.386 0.3 . 1 . . . A 59 ILE N . 25324 1 659 . 1 1 59 59 GLY H H 1 8.957 0.020 . 1 . . . A 60 GLY H . 25324 1 660 . 1 1 59 59 GLY HA2 H 1 4.457 0.020 . 2 . . . A 60 GLY HA2 . 25324 1 661 . 1 1 59 59 GLY HA3 H 1 3.834 0.020 . 2 . . . A 60 GLY HA3 . 25324 1 662 . 1 1 59 59 GLY C C 13 173.787 0.3 . 1 . . . A 60 GLY C . 25324 1 663 . 1 1 59 59 GLY CA C 13 46.235 0.3 . 1 . . . A 60 GLY CA . 25324 1 664 . 1 1 59 59 GLY N N 15 107.164 0.3 . 1 . . . A 60 GLY N . 25324 1 665 . 1 1 60 60 PHE H H 1 8.788 0.020 . 1 . . . A 61 PHE H . 25324 1 666 . 1 1 60 60 PHE HA H 1 5.223 0.020 . 1 . . . A 61 PHE HA . 25324 1 667 . 1 1 60 60 PHE HB2 H 1 2.574 0.020 . 2 . . . A 61 PHE HB2 . 25324 1 668 . 1 1 60 60 PHE HB3 H 1 2.330 0.020 . 2 . . . A 61 PHE HB3 . 25324 1 669 . 1 1 60 60 PHE HD1 H 1 6.655 0.020 . 1 . . . A 61 PHE HD1 . 25324 1 670 . 1 1 60 60 PHE HD2 H 1 6.655 0.020 . 1 . . . A 61 PHE HD2 . 25324 1 671 . 1 1 60 60 PHE HE1 H 1 6.242 0.020 . 1 . . . A 61 PHE HE1 . 25324 1 672 . 1 1 60 60 PHE HE2 H 1 6.242 0.020 . 1 . . . A 61 PHE HE2 . 25324 1 673 . 1 1 60 60 PHE HZ H 1 6.055 0.020 . 1 . . . A 61 PHE HZ . 25324 1 674 . 1 1 60 60 PHE C C 13 173.126 0.3 . 1 . . . A 61 PHE C . 25324 1 675 . 1 1 60 60 PHE CA C 13 56.861 0.3 . 1 . . . A 61 PHE CA . 25324 1 676 . 1 1 60 60 PHE CB C 13 43.217 0.3 . 1 . . . A 61 PHE CB . 25324 1 677 . 1 1 60 60 PHE CD1 C 13 131.368 0.3 . 1 . . . A 61 PHE CD1 . 25324 1 678 . 1 1 60 60 PHE CE1 C 13 131.651 0.3 . 1 . . . A 61 PHE CE1 . 25324 1 679 . 1 1 60 60 PHE CZ C 13 128.222 0.3 . 1 . . . A 61 PHE CZ . 25324 1 680 . 1 1 60 60 PHE N N 15 124.597 0.3 . 1 . . . A 61 PHE N . 25324 1 681 . 1 1 61 61 ARG H H 1 8.405 0.020 . 1 . . . A 62 ARG H . 25324 1 682 . 1 1 61 61 ARG HA H 1 5.132 0.020 . 1 . . . A 62 ARG HA . 25324 1 683 . 1 1 61 61 ARG HB2 H 1 1.487 0.020 . 2 . . . A 62 ARG HB2 . 25324 1 684 . 1 1 61 61 ARG HB3 H 1 1.292 0.020 . 2 . . . A 62 ARG HB3 . 25324 1 685 . 1 1 61 61 ARG HG2 H 1 1.020 0.020 . 1 . . . A 62 ARG HG2 . 25324 1 686 . 1 1 61 61 ARG HG3 H 1 1.020 0.020 . 1 . . . A 62 ARG HG3 . 25324 1 687 . 1 1 61 61 ARG HD2 H 1 2.086 0.020 . 1 . . . A 62 ARG HD2 . 25324 1 688 . 1 1 61 61 ARG HD3 H 1 2.086 0.020 . 1 . . . A 62 ARG HD3 . 25324 1 689 . 1 1 61 61 ARG HE H 1 6.115 0.020 . 1 . . . A 62 ARG HE . 25324 1 690 . 1 1 61 61 ARG C C 13 172.456 0.3 . 1 . . . A 62 ARG C . 25324 1 691 . 1 1 61 61 ARG CA C 13 54.954 0.3 . 1 . . . A 62 ARG CA . 25324 1 692 . 1 1 61 61 ARG CB C 13 32.870 0.3 . 1 . . . A 62 ARG CB . 25324 1 693 . 1 1 61 61 ARG CG C 13 25.212 0.3 . 1 . . . A 62 ARG CG . 25324 1 694 . 1 1 61 61 ARG CD C 13 42.739 0.3 . 1 . . . A 62 ARG CD . 25324 1 695 . 1 1 61 61 ARG N N 15 129.706 0.3 . 1 . . . A 62 ARG N . 25324 1 696 . 1 1 61 61 ARG NE N 15 83.993 0.3 . 1 . . . A 62 ARG NE . 25324 1 697 . 1 1 62 62 ALA H H 1 8.628 0.020 . 1 . . . A 63 ALA H . 25324 1 698 . 1 1 62 62 ALA HA H 1 5.345 0.020 . 1 . . . A 63 ALA HA . 25324 1 699 . 1 1 62 62 ALA HB1 H 1 1.031 0.020 . 1 . . . A 63 ALA HB1 . 25324 1 700 . 1 1 62 62 ALA HB2 H 1 1.031 0.020 . 1 . . . A 63 ALA HB2 . 25324 1 701 . 1 1 62 62 ALA HB3 H 1 1.031 0.020 . 1 . . . A 63 ALA HB3 . 25324 1 702 . 1 1 62 62 ALA C C 13 176.120 0.3 . 1 . . . A 63 ALA C . 25324 1 703 . 1 1 62 62 ALA CA C 13 49.919 0.3 . 1 . . . A 63 ALA CA . 25324 1 704 . 1 1 62 62 ALA CB C 13 24.773 0.3 . 1 . . . A 63 ALA CB . 25324 1 705 . 1 1 62 62 ALA N N 15 122.744 0.3 . 1 . . . A 63 ALA N . 25324 1 706 . 1 1 63 63 THR H H 1 8.315 0.020 . 1 . . . A 64 THR H . 25324 1 707 . 1 1 63 63 THR HA H 1 4.848 0.020 . 1 . . . A 64 THR HA . 25324 1 708 . 1 1 63 63 THR HB H 1 3.863 0.020 . 1 . . . A 64 THR HB . 25324 1 709 . 1 1 63 63 THR HG21 H 1 1.127 0.020 . 1 . . . A 64 THR HG21 . 25324 1 710 . 1 1 63 63 THR HG22 H 1 1.127 0.020 . 1 . . . A 64 THR HG22 . 25324 1 711 . 1 1 63 63 THR HG23 H 1 1.127 0.020 . 1 . . . A 64 THR HG23 . 25324 1 712 . 1 1 63 63 THR C C 13 172.957 0.3 . 1 . . . A 64 THR C . 25324 1 713 . 1 1 63 63 THR CA C 13 61.211 0.3 . 1 . . . A 64 THR CA . 25324 1 714 . 1 1 63 63 THR CB C 13 71.064 0.3 . 1 . . . A 64 THR CB . 25324 1 715 . 1 1 63 63 THR CG2 C 13 20.937 0.3 . 1 . . . A 64 THR CG2 . 25324 1 716 . 1 1 63 63 THR N N 15 116.855 0.3 . 1 . . . A 64 THR N . 25324 1 717 . 1 1 64 64 LEU H H 1 8.877 0.020 . 1 . . . A 65 LEU H . 25324 1 718 . 1 1 64 64 LEU HA H 1 3.362 0.020 . 1 . . . A 65 LEU HA . 25324 1 719 . 1 1 64 64 LEU HB2 H 1 1.782 0.020 . 2 . . . A 65 LEU HB2 . 25324 1 720 . 1 1 64 64 LEU HB3 H 1 1.351 0.020 . 2 . . . A 65 LEU HB3 . 25324 1 721 . 1 1 64 64 LEU HG H 1 1.024 0.020 . 1 . . . A 65 LEU HG . 25324 1 722 . 1 1 64 64 LEU HD11 H 1 0.736 0.020 . 2 . . . A 65 LEU HD11 . 25324 1 723 . 1 1 64 64 LEU HD12 H 1 0.736 0.020 . 2 . . . A 65 LEU HD12 . 25324 1 724 . 1 1 64 64 LEU HD13 H 1 0.736 0.020 . 2 . . . A 65 LEU HD13 . 25324 1 725 . 1 1 64 64 LEU HD21 H 1 0.289 0.020 . 2 . . . A 65 LEU HD21 . 25324 1 726 . 1 1 64 64 LEU HD22 H 1 0.289 0.020 . 2 . . . A 65 LEU HD22 . 25324 1 727 . 1 1 64 64 LEU HD23 H 1 0.289 0.020 . 2 . . . A 65 LEU HD23 . 25324 1 728 . 1 1 64 64 LEU C C 13 176.459 0.3 . 1 . . . A 65 LEU C . 25324 1 729 . 1 1 64 64 LEU CA C 13 55.687 0.3 . 1 . . . A 65 LEU CA . 25324 1 730 . 1 1 64 64 LEU CB C 13 41.711 0.3 . 1 . . . A 65 LEU CB . 25324 1 731 . 1 1 64 64 LEU CG C 13 26.525 0.3 . 1 . . . A 65 LEU CG . 25324 1 732 . 1 1 64 64 LEU CD1 C 13 26.429 0.3 . 1 . . . A 65 LEU CD1 . 25324 1 733 . 1 1 64 64 LEU CD2 C 13 20.296 0.3 . 1 . . . A 65 LEU CD2 . 25324 1 734 . 1 1 64 64 LEU N N 15 129.360 0.3 . 1 . . . A 65 LEU N . 25324 1 735 . 1 1 65 65 LEU H H 1 9.320 0.020 . 1 . . . A 66 LEU H . 25324 1 736 . 1 1 65 65 LEU HA H 1 4.376 0.020 . 1 . . . A 66 LEU HA . 25324 1 737 . 1 1 65 65 LEU HB2 H 1 1.565 0.020 . 2 . . . A 66 LEU HB2 . 25324 1 738 . 1 1 65 65 LEU HB3 H 1 1.492 0.020 . 2 . . . A 66 LEU HB3 . 25324 1 739 . 1 1 65 65 LEU HG H 1 1.626 0.020 . 1 . . . A 66 LEU HG . 25324 1 740 . 1 1 65 65 LEU HD11 H 1 0.812 0.020 . 2 . . . A 66 LEU HD11 . 25324 1 741 . 1 1 65 65 LEU HD12 H 1 0.812 0.020 . 2 . . . A 66 LEU HD12 . 25324 1 742 . 1 1 65 65 LEU HD13 H 1 0.812 0.020 . 2 . . . A 66 LEU HD13 . 25324 1 743 . 1 1 65 65 LEU HD21 H 1 0.759 0.020 . 2 . . . A 66 LEU HD21 . 25324 1 744 . 1 1 65 65 LEU HD22 H 1 0.759 0.020 . 2 . . . A 66 LEU HD22 . 25324 1 745 . 1 1 65 65 LEU HD23 H 1 0.759 0.020 . 2 . . . A 66 LEU HD23 . 25324 1 746 . 1 1 65 65 LEU C C 13 177.621 0.3 . 1 . . . A 66 LEU C . 25324 1 747 . 1 1 65 65 LEU CA C 13 54.700 0.3 . 1 . . . A 66 LEU CA . 25324 1 748 . 1 1 65 65 LEU CB C 13 42.302 0.3 . 1 . . . A 66 LEU CB . 25324 1 749 . 1 1 65 65 LEU CG C 13 26.494 0.3 . 1 . . . A 66 LEU CG . 25324 1 750 . 1 1 65 65 LEU CD1 C 13 25.155 0.3 . 1 . . . A 66 LEU CD1 . 25324 1 751 . 1 1 65 65 LEU CD2 C 13 21.686 0.3 . 1 . . . A 66 LEU CD2 . 25324 1 752 . 1 1 65 65 LEU N N 15 128.683 0.3 . 1 . . . A 66 LEU N . 25324 1 753 . 1 1 66 66 GLY H H 1 6.639 0.020 . 1 . . . A 67 GLY H . 25324 1 754 . 1 1 66 66 GLY HA2 H 1 4.383 0.020 . 2 . . . A 67 GLY HA2 . 25324 1 755 . 1 1 66 66 GLY HA3 H 1 3.625 0.020 . 2 . . . A 67 GLY HA3 . 25324 1 756 . 1 1 66 66 GLY C C 13 173.618 0.3 . 1 . . . A 67 GLY C . 25324 1 757 . 1 1 66 66 GLY CA C 13 43.367 0.3 . 1 . . . A 67 GLY CA . 25324 1 758 . 1 1 66 66 GLY N N 15 105.361 0.3 . 1 . . . A 67 GLY N . 25324 1 759 . 1 1 67 67 ASN H H 1 9.236 0.020 . 1 . . . A 68 ASN H . 25324 1 760 . 1 1 67 67 ASN HA H 1 4.331 0.020 . 1 . . . A 68 ASN HA . 25324 1 761 . 1 1 67 67 ASN HB2 H 1 2.921 0.020 . 2 . . . A 68 ASN HB2 . 25324 1 762 . 1 1 67 67 ASN HB3 H 1 2.653 0.020 . 2 . . . A 68 ASN HB3 . 25324 1 763 . 1 1 67 67 ASN HD21 H 1 7.561 0.020 . 1 . . . A 68 ASN HD21 . 25324 1 764 . 1 1 67 67 ASN HD22 H 1 6.858 0.020 . 1 . . . A 68 ASN HD22 . 25324 1 765 . 1 1 67 67 ASN C C 13 174.316 0.3 . 1 . . . A 68 ASN C . 25324 1 766 . 1 1 67 67 ASN CA C 13 54.552 0.3 . 1 . . . A 68 ASN CA . 25324 1 767 . 1 1 67 67 ASN CB C 13 37.165 0.3 . 1 . . . A 68 ASN CB . 25324 1 768 . 1 1 67 67 ASN N N 15 121.848 0.3 . 1 . . . A 68 ASN N . 25324 1 769 . 1 1 67 67 ASN ND2 N 15 112.658 0.3 . 1 . . . A 68 ASN ND2 . 25324 1 770 . 1 1 68 68 ASN H H 1 8.651 0.020 . 1 . . . A 69 ASN H . 25324 1 771 . 1 1 68 68 ASN HA H 1 4.080 0.020 . 1 . . . A 69 ASN HA . 25324 1 772 . 1 1 68 68 ASN HB2 H 1 3.082 0.020 . 2 . . . A 69 ASN HB2 . 25324 1 773 . 1 1 68 68 ASN HB3 H 1 2.861 0.020 . 2 . . . A 69 ASN HB3 . 25324 1 774 . 1 1 68 68 ASN HD21 H 1 7.209 0.020 . 1 . . . A 69 ASN HD21 . 25324 1 775 . 1 1 68 68 ASN HD22 H 1 6.981 0.020 . 1 . . . A 69 ASN HD22 . 25324 1 776 . 1 1 68 68 ASN C C 13 171.456 0.3 . 1 . . . A 69 ASN C . 25324 1 777 . 1 1 68 68 ASN CA C 13 55.750 0.3 . 1 . . . A 69 ASN CA . 25324 1 778 . 1 1 68 68 ASN CB C 13 37.306 0.3 . 1 . . . A 69 ASN CB . 25324 1 779 . 1 1 68 68 ASN N N 15 109.509 0.3 . 1 . . . A 69 ASN N . 25324 1 780 . 1 1 68 68 ASN ND2 N 15 112.499 0.3 . 1 . . . A 69 ASN ND2 . 25324 1 781 . 1 1 69 69 SER H H 1 7.693 0.020 . 1 . . . A 70 SER H . 25324 1 782 . 1 1 69 69 SER HA H 1 5.437 0.020 . 1 . . . A 70 SER HA . 25324 1 783 . 1 1 69 69 SER HB2 H 1 3.900 0.020 . 2 . . . A 70 SER HB2 . 25324 1 784 . 1 1 69 69 SER HB3 H 1 3.817 0.020 . 2 . . . A 70 SER HB3 . 25324 1 785 . 1 1 69 69 SER C C 13 173.750 0.3 . 1 . . . A 70 SER C . 25324 1 786 . 1 1 69 69 SER CA C 13 57.139 0.3 . 1 . . . A 70 SER CA . 25324 1 787 . 1 1 69 69 SER CB C 13 63.818 0.3 . 1 . . . A 70 SER CB . 25324 1 788 . 1 1 69 69 SER N N 15 113.479 0.3 . 1 . . . A 70 SER N . 25324 1 789 . 1 1 70 70 TYR H H 1 9.326 0.020 . 1 . . . A 71 TYR H . 25324 1 790 . 1 1 70 70 TYR HA H 1 5.143 0.020 . 1 . . . A 71 TYR HA . 25324 1 791 . 1 1 70 70 TYR HB2 H 1 2.404 0.020 . 1 . . . A 71 TYR HB2 . 25324 1 792 . 1 1 70 70 TYR HB3 H 1 2.404 0.020 . 1 . . . A 71 TYR HB3 . 25324 1 793 . 1 1 70 70 TYR CA C 13 56.648 0.3 . 1 . . . A 71 TYR CA . 25324 1 794 . 1 1 70 70 TYR CB C 13 42.445 0.3 . 1 . . . A 71 TYR CB . 25324 1 795 . 1 1 70 70 TYR N N 15 123.132 0.3 . 1 . . . A 71 TYR N . 25324 1 796 . 1 1 71 71 GLU H H 1 8.624 0.020 . 1 . . . A 72 GLU H . 25324 1 797 . 1 1 71 71 GLU HA H 1 4.806 0.020 . 1 . . . A 72 GLU HA . 25324 1 798 . 1 1 71 71 GLU HB2 H 1 2.027 0.020 . 1 . . . A 72 GLU HB2 . 25324 1 799 . 1 1 71 71 GLU HB3 H 1 2.027 0.020 . 1 . . . A 72 GLU HB3 . 25324 1 800 . 1 1 71 71 GLU HG2 H 1 2.150 0.020 . 1 . . . A 72 GLU HG2 . 25324 1 801 . 1 1 71 71 GLU HG3 H 1 2.150 0.020 . 1 . . . A 72 GLU HG3 . 25324 1 802 . 1 1 71 71 GLU C C 13 175.698 0.3 . 1 . . . A 72 GLU C . 25324 1 803 . 1 1 71 71 GLU CA C 13 55.167 0.3 . 1 . . . A 72 GLU CA . 25324 1 804 . 1 1 71 71 GLU CB C 13 30.184 0.3 . 1 . . . A 72 GLU CB . 25324 1 805 . 1 1 71 71 GLU CG C 13 35.120 0.3 . 1 . . . A 72 GLU CG . 25324 1 806 . 1 1 71 71 GLU N N 15 122.396 0.3 . 1 . . . A 72 GLU N . 25324 1 807 . 1 1 72 72 VAL H H 1 8.564 0.020 . 1 . . . A 73 VAL H . 25324 1 808 . 1 1 72 72 VAL HA H 1 4.199 0.020 . 1 . . . A 73 VAL HA . 25324 1 809 . 1 1 72 72 VAL HB H 1 1.257 0.020 . 1 . . . A 73 VAL HB . 25324 1 810 . 1 1 72 72 VAL HG11 H 1 -0.204 0.020 . 2 . . . A 73 VAL HG11 . 25324 1 811 . 1 1 72 72 VAL HG12 H 1 -0.204 0.020 . 2 . . . A 73 VAL HG12 . 25324 1 812 . 1 1 72 72 VAL HG13 H 1 -0.204 0.020 . 2 . . . A 73 VAL HG13 . 25324 1 813 . 1 1 72 72 VAL HG21 H 1 -0.350 0.020 . 2 . . . A 73 VAL HG21 . 25324 1 814 . 1 1 72 72 VAL HG22 H 1 -0.350 0.020 . 2 . . . A 73 VAL HG22 . 25324 1 815 . 1 1 72 72 VAL HG23 H 1 -0.350 0.020 . 2 . . . A 73 VAL HG23 . 25324 1 816 . 1 1 72 72 VAL C C 13 175.369 0.3 . 1 . . . A 73 VAL C . 25324 1 817 . 1 1 72 72 VAL CA C 13 61.480 0.3 . 1 . . . A 73 VAL CA . 25324 1 818 . 1 1 72 72 VAL CB C 13 33.333 0.3 . 1 . . . A 73 VAL CB . 25324 1 819 . 1 1 72 72 VAL CG1 C 13 20.898 0.3 . 1 . . . A 73 VAL CG1 . 25324 1 820 . 1 1 72 72 VAL CG2 C 13 20.180 0.3 . 1 . . . A 73 VAL CG2 . 25324 1 821 . 1 1 72 72 VAL N N 15 128.513 0.3 . 1 . . . A 73 VAL N . 25324 1 822 . 1 1 73 73 GLU H H 1 9.011 0.020 . 1 . . . A 74 GLU H . 25324 1 823 . 1 1 73 73 GLU HA H 1 5.087 0.020 . 1 . . . A 74 GLU HA . 25324 1 824 . 1 1 73 73 GLU HB2 H 1 1.736 0.020 . 1 . . . A 74 GLU HB2 . 25324 1 825 . 1 1 73 73 GLU HB3 H 1 1.736 0.020 . 1 . . . A 74 GLU HB3 . 25324 1 826 . 1 1 73 73 GLU HG2 H 1 2.073 0.020 . 1 . . . A 74 GLU HG2 . 25324 1 827 . 1 1 73 73 GLU HG3 H 1 2.073 0.020 . 1 . . . A 74 GLU HG3 . 25324 1 828 . 1 1 73 73 GLU C C 13 174.415 0.3 . 1 . . . A 74 GLU C . 25324 1 829 . 1 1 73 73 GLU CA C 13 54.337 0.3 . 1 . . . A 74 GLU CA . 25324 1 830 . 1 1 73 73 GLU CB C 13 35.157 0.3 . 1 . . . A 74 GLU CB . 25324 1 831 . 1 1 73 73 GLU CG C 13 36.428 0.3 . 1 . . . A 74 GLU CG . 25324 1 832 . 1 1 73 73 GLU N N 15 124.842 0.3 . 1 . . . A 74 GLU N . 25324 1 833 . 1 1 74 74 ASN H H 1 9.424 0.020 . 1 . . . A 75 ASN H . 25324 1 834 . 1 1 74 74 ASN HA H 1 6.139 0.020 . 1 . . . A 75 ASN HA . 25324 1 835 . 1 1 74 74 ASN HB2 H 1 3.111 0.020 . 2 . . . A 75 ASN HB2 . 25324 1 836 . 1 1 74 74 ASN HB3 H 1 2.682 0.020 . 2 . . . A 75 ASN HB3 . 25324 1 837 . 1 1 74 74 ASN HD21 H 1 8.019 0.020 . 1 . . . A 75 ASN HD21 . 25324 1 838 . 1 1 74 74 ASN HD22 H 1 5.934 0.020 . 1 . . . A 75 ASN HD22 . 25324 1 839 . 1 1 74 74 ASN C C 13 172.703 0.3 . 1 . . . A 75 ASN C . 25324 1 840 . 1 1 74 74 ASN CA C 13 51.825 0.3 . 1 . . . A 75 ASN CA . 25324 1 841 . 1 1 74 74 ASN CB C 13 45.896 0.3 . 1 . . . A 75 ASN CB . 25324 1 842 . 1 1 74 74 ASN N N 15 116.136 0.3 . 1 . . . A 75 ASN N . 25324 1 843 . 1 1 74 74 ASN ND2 N 15 105.659 0.3 . 1 . . . A 75 ASN ND2 . 25324 1 844 . 1 1 75 75 GLN H H 1 7.106 0.020 . 1 . . . A 76 GLN H . 25324 1 845 . 1 1 75 75 GLN HA H 1 4.040 0.020 . 1 . . . A 76 GLN HA . 25324 1 846 . 1 1 75 75 GLN HB2 H 1 0.774 0.020 . 2 . . . A 76 GLN HB2 . 25324 1 847 . 1 1 75 75 GLN HB3 H 1 -0.947 0.020 . 2 . . . A 76 GLN HB3 . 25324 1 848 . 1 1 75 75 GLN HG2 H 1 1.180 0.020 . 2 . . . A 76 GLN HG2 . 25324 1 849 . 1 1 75 75 GLN HG3 H 1 0.995 0.020 . 2 . . . A 76 GLN HG3 . 25324 1 850 . 1 1 75 75 GLN HE21 H 1 7.415 0.020 . 1 . . . A 76 GLN HE21 . 25324 1 851 . 1 1 75 75 GLN HE22 H 1 5.979 0.020 . 1 . . . A 76 GLN HE22 . 25324 1 852 . 1 1 75 75 GLN C C 13 173.113 0.3 . 1 . . . A 76 GLN C . 25324 1 853 . 1 1 75 75 GLN CA C 13 54.223 0.3 . 1 . . . A 76 GLN CA . 25324 1 854 . 1 1 75 75 GLN CB C 13 30.348 0.3 . 1 . . . A 76 GLN CB . 25324 1 855 . 1 1 75 75 GLN CG C 13 33.051 0.3 . 1 . . . A 76 GLN CG . 25324 1 856 . 1 1 75 75 GLN N N 15 120.762 0.3 . 1 . . . A 76 GLN N . 25324 1 857 . 1 1 75 75 GLN NE2 N 15 113.634 0.3 . 1 . . . A 76 GLN NE2 . 25324 1 858 . 1 1 76 76 TRP H H 1 8.181 0.020 . 1 . . . A 77 TRP H . 25324 1 859 . 1 1 76 76 TRP HA H 1 5.152 0.020 . 1 . . . A 77 TRP HA . 25324 1 860 . 1 1 76 76 TRP HB2 H 1 3.456 0.020 . 2 . . . A 77 TRP HB2 . 25324 1 861 . 1 1 76 76 TRP HB3 H 1 3.252 0.020 . 2 . . . A 77 TRP HB3 . 25324 1 862 . 1 1 76 76 TRP HD1 H 1 7.076 0.020 . 1 . . . A 77 TRP HD1 . 25324 1 863 . 1 1 76 76 TRP HE1 H 1 10.144 0.020 . 1 . . . A 77 TRP HE1 . 25324 1 864 . 1 1 76 76 TRP HE3 H 1 7.308 0.020 . 1 . . . A 77 TRP HE3 . 25324 1 865 . 1 1 76 76 TRP HZ2 H 1 7.009 0.020 . 1 . . . A 77 TRP HZ2 . 25324 1 866 . 1 1 76 76 TRP HZ3 H 1 6.985 0.020 . 1 . . . A 77 TRP HZ3 . 25324 1 867 . 1 1 76 76 TRP HH2 H 1 6.942 0.020 . 1 . . . A 77 TRP HH2 . 25324 1 868 . 1 1 76 76 TRP C C 13 175.502 0.3 . 1 . . . A 77 TRP C . 25324 1 869 . 1 1 76 76 TRP CA C 13 55.764 0.3 . 1 . . . A 77 TRP CA . 25324 1 870 . 1 1 76 76 TRP CB C 13 29.999 0.3 . 1 . . . A 77 TRP CB . 25324 1 871 . 1 1 76 76 TRP CD1 C 13 127.163 0.3 . 1 . . . A 77 TRP CD1 . 25324 1 872 . 1 1 76 76 TRP CE3 C 13 119.490 0.3 . 1 . . . A 77 TRP CE3 . 25324 1 873 . 1 1 76 76 TRP CZ2 C 13 114.171 0.3 . 1 . . . A 77 TRP CZ2 . 25324 1 874 . 1 1 76 76 TRP CZ3 C 13 121.193 0.3 . 1 . . . A 77 TRP CZ3 . 25324 1 875 . 1 1 76 76 TRP CH2 C 13 124.200 0.3 . 1 . . . A 77 TRP CH2 . 25324 1 876 . 1 1 76 76 TRP N N 15 125.598 0.3 . 1 . . . A 77 TRP N . 25324 1 877 . 1 1 76 76 TRP NE1 N 15 130.430 0.3 . 1 . . . A 77 TRP NE1 . 25324 1 878 . 1 1 77 77 GLY H H 1 8.778 0.020 . 1 . . . A 78 GLY H . 25324 1 879 . 1 1 77 77 GLY HA2 H 1 4.174 0.020 . 2 . . . A 78 GLY HA2 . 25324 1 880 . 1 1 77 77 GLY HA3 H 1 3.832 0.020 . 2 . . . A 78 GLY HA3 . 25324 1 881 . 1 1 77 77 GLY C C 13 174.611 0.3 . 1 . . . A 78 GLY C . 25324 1 882 . 1 1 77 77 GLY CA C 13 44.902 0.3 . 1 . . . A 78 GLY CA . 25324 1 883 . 1 1 77 77 GLY N N 15 107.901 0.3 . 1 . . . A 78 GLY N . 25324 1 884 . 1 1 78 78 GLY H H 1 8.198 0.020 . 1 . . . A 79 GLY H . 25324 1 885 . 1 1 78 78 GLY HA2 H 1 4.396 0.020 . 2 . . . A 79 GLY HA2 . 25324 1 886 . 1 1 78 78 GLY HA3 H 1 3.750 0.020 . 2 . . . A 79 GLY HA3 . 25324 1 887 . 1 1 78 78 GLY C C 13 173.782 0.3 . 1 . . . A 79 GLY C . 25324 1 888 . 1 1 78 78 GLY CA C 13 43.793 0.3 . 1 . . . A 79 GLY CA . 25324 1 889 . 1 1 78 78 GLY N N 15 109.844 0.3 . 1 . . . A 79 GLY N . 25324 1 890 . 1 1 79 79 ASP H H 1 8.132 0.020 . 1 . . . A 80 ASP H . 25324 1 891 . 1 1 79 79 ASP HA H 1 4.241 0.020 . 1 . . . A 80 ASP HA . 25324 1 892 . 1 1 79 79 ASP HB2 H 1 2.685 0.020 . 1 . . . A 80 ASP HB2 . 25324 1 893 . 1 1 79 79 ASP HB3 H 1 2.685 0.020 . 1 . . . A 80 ASP HB3 . 25324 1 894 . 1 1 79 79 ASP C C 13 177.285 0.3 . 1 . . . A 80 ASP C . 25324 1 895 . 1 1 79 79 ASP CA C 13 56.183 0.3 . 1 . . . A 80 ASP CA . 25324 1 896 . 1 1 79 79 ASP CB C 13 40.523 0.3 . 1 . . . A 80 ASP CB . 25324 1 897 . 1 1 79 79 ASP N N 15 115.837 0.3 . 1 . . . A 80 ASP N . 25324 1 898 . 1 1 80 80 SER H H 1 8.179 0.020 . 1 . . . A 81 SER H . 25324 1 899 . 1 1 80 80 SER HA H 1 4.513 0.020 . 1 . . . A 81 SER HA . 25324 1 900 . 1 1 80 80 SER HB2 H 1 3.919 0.020 . 2 . . . A 81 SER HB2 . 25324 1 901 . 1 1 80 80 SER HB3 H 1 3.850 0.020 . 2 . . . A 81 SER HB3 . 25324 1 902 . 1 1 80 80 SER C C 13 173.684 0.3 . 1 . . . A 81 SER C . 25324 1 903 . 1 1 80 80 SER CA C 13 57.232 0.3 . 1 . . . A 81 SER CA . 25324 1 904 . 1 1 80 80 SER CB C 13 63.170 0.3 . 1 . . . A 81 SER CB . 25324 1 905 . 1 1 80 80 SER N N 15 112.690 0.3 . 1 . . . A 81 SER N . 25324 1 906 . 1 1 81 81 ALA H H 1 7.274 0.020 . 1 . . . A 82 ALA H . 25324 1 907 . 1 1 81 81 ALA HA H 1 4.403 0.020 . 1 . . . A 82 ALA HA . 25324 1 908 . 1 1 81 81 ALA HB1 H 1 1.242 0.020 . 1 . . . A 82 ALA HB1 . 25324 1 909 . 1 1 81 81 ALA HB2 H 1 1.242 0.020 . 1 . . . A 82 ALA HB2 . 25324 1 910 . 1 1 81 81 ALA HB3 H 1 1.242 0.020 . 1 . . . A 82 ALA HB3 . 25324 1 911 . 1 1 81 81 ALA CA C 13 50.466 0.3 . 1 . . . A 82 ALA CA . 25324 1 912 . 1 1 81 81 ALA CB C 13 18.198 0.3 . 1 . . . A 82 ALA CB . 25324 1 913 . 1 1 81 81 ALA N N 15 126.310 0.3 . 1 . . . A 82 ALA N . 25324 1 914 . 1 1 82 82 PRO HA H 1 4.373 0.020 . 1 . . . A 83 PRO HA . 25324 1 915 . 1 1 82 82 PRO HB2 H 1 2.192 0.020 . 2 . . . A 83 PRO HB2 . 25324 1 916 . 1 1 82 82 PRO HB3 H 1 1.357 0.020 . 2 . . . A 83 PRO HB3 . 25324 1 917 . 1 1 82 82 PRO HG2 H 1 1.810 0.020 . 1 . . . A 83 PRO HG2 . 25324 1 918 . 1 1 82 82 PRO HG3 H 1 1.810 0.020 . 1 . . . A 83 PRO HG3 . 25324 1 919 . 1 1 82 82 PRO HD2 H 1 3.734 0.020 . 2 . . . A 83 PRO HD2 . 25324 1 920 . 1 1 82 82 PRO HD3 H 1 3.531 0.020 . 2 . . . A 83 PRO HD3 . 25324 1 921 . 1 1 82 82 PRO C C 13 175.378 0.3 . 1 . . . A 83 PRO C . 25324 1 922 . 1 1 82 82 PRO CA C 13 62.327 0.3 . 1 . . . A 83 PRO CA . 25324 1 923 . 1 1 82 82 PRO CB C 13 32.164 0.3 . 1 . . . A 83 PRO CB . 25324 1 924 . 1 1 82 82 PRO CG C 13 27.223 0.3 . 1 . . . A 83 PRO CG . 25324 1 925 . 1 1 82 82 PRO CD C 13 50.071 0.3 . 1 . . . A 83 PRO CD . 25324 1 926 . 1 1 83 83 TRP H H 1 8.329 0.020 . 1 . . . A 84 TRP H . 25324 1 927 . 1 1 83 83 TRP HA H 1 4.271 0.020 . 1 . . . A 84 TRP HA . 25324 1 928 . 1 1 83 83 TRP HB2 H 1 2.838 0.020 . 2 . . . A 84 TRP HB2 . 25324 1 929 . 1 1 83 83 TRP HB3 H 1 2.726 0.020 . 2 . . . A 84 TRP HB3 . 25324 1 930 . 1 1 83 83 TRP HD1 H 1 7.133 0.020 . 1 . . . A 84 TRP HD1 . 25324 1 931 . 1 1 83 83 TRP HE1 H 1 9.966 0.020 . 1 . . . A 84 TRP HE1 . 25324 1 932 . 1 1 83 83 TRP HE3 H 1 6.906 0.020 . 1 . . . A 84 TRP HE3 . 25324 1 933 . 1 1 83 83 TRP HZ2 H 1 7.333 0.020 . 1 . . . A 84 TRP HZ2 . 25324 1 934 . 1 1 83 83 TRP HZ3 H 1 6.640 0.020 . 1 . . . A 84 TRP HZ3 . 25324 1 935 . 1 1 83 83 TRP HH2 H 1 6.971 0.020 . 1 . . . A 84 TRP HH2 . 25324 1 936 . 1 1 83 83 TRP C C 13 176.358 0.3 . 1 . . . A 84 TRP C . 25324 1 937 . 1 1 83 83 TRP CA C 13 56.946 0.3 . 1 . . . A 84 TRP CA . 25324 1 938 . 1 1 83 83 TRP CB C 13 29.716 0.3 . 1 . . . A 84 TRP CB . 25324 1 939 . 1 1 83 83 TRP CD1 C 13 127.150 0.3 . 1 . . . A 84 TRP CD1 . 25324 1 940 . 1 1 83 83 TRP CE3 C 13 119.003 0.3 . 1 . . . A 84 TRP CE3 . 25324 1 941 . 1 1 83 83 TRP CZ2 C 13 115.476 0.3 . 1 . . . A 84 TRP CZ2 . 25324 1 942 . 1 1 83 83 TRP CZ3 C 13 121.324 0.3 . 1 . . . A 84 TRP CZ3 . 25324 1 943 . 1 1 83 83 TRP CH2 C 13 123.089 0.3 . 1 . . . A 84 TRP CH2 . 25324 1 944 . 1 1 83 83 TRP N N 15 120.106 0.3 . 1 . . . A 84 TRP N . 25324 1 945 . 1 1 83 83 TRP NE1 N 15 130.657 0.3 . 1 . . . A 84 TRP NE1 . 25324 1 946 . 1 1 84 84 HIS H H 1 9.204 0.020 . 1 . . . A 85 HIS H . 25324 1 947 . 1 1 84 84 HIS HA H 1 4.918 0.020 . 1 . . . A 85 HIS HA . 25324 1 948 . 1 1 84 84 HIS HB2 H 1 3.301 0.020 . 2 . . . A 85 HIS HB2 . 25324 1 949 . 1 1 84 84 HIS HB3 H 1 2.712 0.020 . 2 . . . A 85 HIS HB3 . 25324 1 950 . 1 1 84 84 HIS HD2 H 1 6.182 0.020 . 1 . . . A 85 HIS HD2 . 25324 1 951 . 1 1 84 84 HIS HE1 H 1 8.401 0.020 . 1 . . . A 85 HIS HE1 . 25324 1 952 . 1 1 84 84 HIS C C 13 174.950 0.3 . 1 . . . A 85 HIS C . 25324 1 953 . 1 1 84 84 HIS CA C 13 53.469 0.3 . 1 . . . A 85 HIS CA . 25324 1 954 . 1 1 84 84 HIS CB C 13 31.673 0.3 . 1 . . . A 85 HIS CB . 25324 1 955 . 1 1 84 84 HIS CD2 C 13 121.226 0.3 . 1 . . . A 85 HIS CD2 . 25324 1 956 . 1 1 84 84 HIS CE1 C 13 135.289 0.3 . 1 . . . A 85 HIS CE1 . 25324 1 957 . 1 1 84 84 HIS N N 15 118.543 0.3 . 1 . . . A 85 HIS N . 25324 1 958 . 1 1 85 85 SER H H 1 9.168 0.020 . 1 . . . A 86 SER H . 25324 1 959 . 1 1 85 85 SER HA H 1 4.412 0.020 . 1 . . . A 86 SER HA . 25324 1 960 . 1 1 85 85 SER HB2 H 1 4.182 0.020 . 2 . . . A 86 SER HB2 . 25324 1 961 . 1 1 85 85 SER HB3 H 1 4.035 0.020 . 2 . . . A 86 SER HB3 . 25324 1 962 . 1 1 85 85 SER C C 13 175.691 0.3 . 1 . . . A 86 SER C . 25324 1 963 . 1 1 85 85 SER CA C 13 60.257 0.3 . 1 . . . A 86 SER CA . 25324 1 964 . 1 1 85 85 SER CB C 13 63.015 0.3 . 1 . . . A 86 SER CB . 25324 1 965 . 1 1 85 85 SER N N 15 117.803 0.3 . 1 . . . A 86 SER N . 25324 1 966 . 1 1 86 86 GLY H H 1 9.284 0.020 . 1 . . . A 87 GLY H . 25324 1 967 . 1 1 86 86 GLY HA2 H 1 4.886 0.020 . 2 . . . A 87 GLY HA2 . 25324 1 968 . 1 1 86 86 GLY HA3 H 1 3.348 0.020 . 2 . . . A 87 GLY HA3 . 25324 1 969 . 1 1 86 86 GLY C C 13 174.288 0.3 . 1 . . . A 87 GLY C . 25324 1 970 . 1 1 86 86 GLY CA C 13 44.701 0.3 . 1 . . . A 87 GLY CA . 25324 1 971 . 1 1 86 86 GLY N N 15 115.773 0.3 . 1 . . . A 87 GLY N . 25324 1 972 . 1 1 87 87 GLY H H 1 8.054 0.020 . 1 . . . A 88 GLY H . 25324 1 973 . 1 1 87 87 GLY HA2 H 1 4.528 0.020 . 2 . . . A 88 GLY HA2 . 25324 1 974 . 1 1 87 87 GLY HA3 H 1 3.976 0.020 . 2 . . . A 88 GLY HA3 . 25324 1 975 . 1 1 87 87 GLY C C 13 171.120 0.3 . 1 . . . A 88 GLY C . 25324 1 976 . 1 1 87 87 GLY CA C 13 44.594 0.3 . 1 . . . A 88 GLY CA . 25324 1 977 . 1 1 87 87 GLY N N 15 109.162 0.3 . 1 . . . A 88 GLY N . 25324 1 978 . 1 1 88 88 ASN H H 1 8.516 0.020 . 1 . . . A 89 ASN H . 25324 1 979 . 1 1 88 88 ASN HA H 1 6.038 0.020 . 1 . . . A 89 ASN HA . 25324 1 980 . 1 1 88 88 ASN HB2 H 1 2.754 0.020 . 2 . . . A 89 ASN HB2 . 25324 1 981 . 1 1 88 88 ASN HB3 H 1 2.710 0.020 . 2 . . . A 89 ASN HB3 . 25324 1 982 . 1 1 88 88 ASN HD21 H 1 7.313 0.020 . 1 . . . A 89 ASN HD21 . 25324 1 983 . 1 1 88 88 ASN HD22 H 1 6.791 0.020 . 1 . . . A 89 ASN HD22 . 25324 1 984 . 1 1 88 88 ASN C C 13 175.287 0.3 . 1 . . . A 89 ASN C . 25324 1 985 . 1 1 88 88 ASN CA C 13 51.865 0.3 . 1 . . . A 89 ASN CA . 25324 1 986 . 1 1 88 88 ASN CB C 13 39.605 0.3 . 1 . . . A 89 ASN CB . 25324 1 987 . 1 1 88 88 ASN N N 15 117.048 0.3 . 1 . . . A 89 ASN N . 25324 1 988 . 1 1 88 88 ASN ND2 N 15 110.317 0.3 . 1 . . . A 89 ASN ND2 . 25324 1 989 . 1 1 89 89 TRP H H 1 9.282 0.020 . 1 . . . A 90 TRP H . 25324 1 990 . 1 1 89 89 TRP HA H 1 5.253 0.020 . 1 . . . A 90 TRP HA . 25324 1 991 . 1 1 89 89 TRP HB2 H 1 3.965 0.020 . 2 . . . A 90 TRP HB2 . 25324 1 992 . 1 1 89 89 TRP HB3 H 1 2.715 0.020 . 2 . . . A 90 TRP HB3 . 25324 1 993 . 1 1 89 89 TRP HD1 H 1 7.034 0.020 . 1 . . . A 90 TRP HD1 . 25324 1 994 . 1 1 89 89 TRP HE1 H 1 10.005 0.020 . 1 . . . A 90 TRP HE1 . 25324 1 995 . 1 1 89 89 TRP HE3 H 1 7.781 0.020 . 1 . . . A 90 TRP HE3 . 25324 1 996 . 1 1 89 89 TRP HZ2 H 1 7.871 0.020 . 1 . . . A 90 TRP HZ2 . 25324 1 997 . 1 1 89 89 TRP HZ3 H 1 6.942 0.020 . 1 . . . A 90 TRP HZ3 . 25324 1 998 . 1 1 89 89 TRP HH2 H 1 7.305 0.020 . 1 . . . A 90 TRP HH2 . 25324 1 999 . 1 1 89 89 TRP C C 13 175.278 0.3 . 1 . . . A 90 TRP C . 25324 1 1000 . 1 1 89 89 TRP CA C 13 54.268 0.3 . 1 . . . A 90 TRP CA . 25324 1 1001 . 1 1 89 89 TRP CB C 13 31.958 0.3 . 1 . . . A 90 TRP CB . 25324 1 1002 . 1 1 89 89 TRP CD1 C 13 126.375 0.3 . 1 . . . A 90 TRP CD1 . 25324 1 1003 . 1 1 89 89 TRP CE3 C 13 120.851 0.3 . 1 . . . A 90 TRP CE3 . 25324 1 1004 . 1 1 89 89 TRP CZ2 C 13 114.237 0.3 . 1 . . . A 90 TRP CZ2 . 25324 1 1005 . 1 1 89 89 TRP CZ3 C 13 121.774 0.3 . 1 . . . A 90 TRP CZ3 . 25324 1 1006 . 1 1 89 89 TRP CH2 C 13 125.214 0.3 . 1 . . . A 90 TRP CH2 . 25324 1 1007 . 1 1 89 89 TRP N N 15 125.844 0.3 . 1 . . . A 90 TRP N . 25324 1 1008 . 1 1 89 89 TRP NE1 N 15 128.459 0.3 . 1 . . . A 90 TRP NE1 . 25324 1 1009 . 1 1 90 90 ILE H H 1 9.318 0.020 . 1 . . . A 91 ILE H . 25324 1 1010 . 1 1 90 90 ILE HA H 1 5.446 0.020 . 1 . . . A 91 ILE HA . 25324 1 1011 . 1 1 90 90 ILE HB H 1 1.960 0.020 . 1 . . . A 91 ILE HB . 25324 1 1012 . 1 1 90 90 ILE HG12 H 1 1.721 0.020 . 2 . . . A 91 ILE HG12 . 25324 1 1013 . 1 1 90 90 ILE HG13 H 1 1.255 0.020 . 2 . . . A 91 ILE HG13 . 25324 1 1014 . 1 1 90 90 ILE HG21 H 1 1.006 0.020 . 1 . . . A 91 ILE HG21 . 25324 1 1015 . 1 1 90 90 ILE HG22 H 1 1.006 0.020 . 1 . . . A 91 ILE HG22 . 25324 1 1016 . 1 1 90 90 ILE HG23 H 1 1.006 0.020 . 1 . . . A 91 ILE HG23 . 25324 1 1017 . 1 1 90 90 ILE HD11 H 1 0.956 0.020 . 1 . . . A 91 ILE HD11 . 25324 1 1018 . 1 1 90 90 ILE HD12 H 1 0.956 0.020 . 1 . . . A 91 ILE HD12 . 25324 1 1019 . 1 1 90 90 ILE HD13 H 1 0.956 0.020 . 1 . . . A 91 ILE HD13 . 25324 1 1020 . 1 1 90 90 ILE C C 13 175.489 0.3 . 1 . . . A 91 ILE C . 25324 1 1021 . 1 1 90 90 ILE CA C 13 60.826 0.3 . 1 . . . A 91 ILE CA . 25324 1 1022 . 1 1 90 90 ILE CB C 13 39.676 0.3 . 1 . . . A 91 ILE CB . 25324 1 1023 . 1 1 90 90 ILE CG1 C 13 26.757 0.3 . 1 . . . A 91 ILE CG1 . 25324 1 1024 . 1 1 90 90 ILE CG2 C 13 16.880 0.3 . 1 . . . A 91 ILE CG2 . 25324 1 1025 . 1 1 90 90 ILE CD1 C 13 12.629 0.3 . 1 . . . A 91 ILE CD1 . 25324 1 1026 . 1 1 90 90 ILE N N 15 123.134 0.3 . 1 . . . A 91 ILE N . 25324 1 1027 . 1 1 91 91 LEU H H 1 8.463 0.020 . 1 . . . A 92 LEU H . 25324 1 1028 . 1 1 91 91 LEU HA H 1 3.942 0.020 . 1 . . . A 92 LEU HA . 25324 1 1029 . 1 1 91 91 LEU HB2 H 1 1.716 0.020 . 2 . . . A 92 LEU HB2 . 25324 1 1030 . 1 1 91 91 LEU HB3 H 1 0.534 0.020 . 2 . . . A 92 LEU HB3 . 25324 1 1031 . 1 1 91 91 LEU HG H 1 1.592 0.020 . 1 . . . A 92 LEU HG . 25324 1 1032 . 1 1 91 91 LEU HD11 H 1 1.269 0.020 . 2 . . . A 92 LEU HD11 . 25324 1 1033 . 1 1 91 91 LEU HD12 H 1 1.269 0.020 . 2 . . . A 92 LEU HD12 . 25324 1 1034 . 1 1 91 91 LEU HD13 H 1 1.269 0.020 . 2 . . . A 92 LEU HD13 . 25324 1 1035 . 1 1 91 91 LEU HD21 H 1 0.220 0.020 . 2 . . . A 92 LEU HD21 . 25324 1 1036 . 1 1 91 91 LEU HD22 H 1 0.220 0.020 . 2 . . . A 92 LEU HD22 . 25324 1 1037 . 1 1 91 91 LEU HD23 H 1 0.220 0.020 . 2 . . . A 92 LEU HD23 . 25324 1 1038 . 1 1 91 91 LEU C C 13 173.620 0.3 . 1 . . . A 92 LEU C . 25324 1 1039 . 1 1 91 91 LEU CA C 13 52.256 0.3 . 1 . . . A 92 LEU CA . 25324 1 1040 . 1 1 91 91 LEU CB C 13 43.508 0.3 . 1 . . . A 92 LEU CB . 25324 1 1041 . 1 1 91 91 LEU CG C 13 25.826 0.3 . 1 . . . A 92 LEU CG . 25324 1 1042 . 1 1 91 91 LEU CD1 C 13 24.675 0.3 . 1 . . . A 92 LEU CD1 . 25324 1 1043 . 1 1 91 91 LEU CD2 C 13 24.054 0.3 . 1 . . . A 92 LEU CD2 . 25324 1 1044 . 1 1 91 91 LEU N N 15 123.452 0.3 . 1 . . . A 92 LEU N . 25324 1 1045 . 1 1 92 92 GLY H H 1 2.937 0.020 . 1 . . . A 93 GLY H . 25324 1 1046 . 1 1 92 92 GLY HA2 H 1 4.581 0.020 . 2 . . . A 93 GLY HA2 . 25324 1 1047 . 1 1 92 92 GLY HA3 H 1 3.145 0.020 . 2 . . . A 93 GLY HA3 . 25324 1 1048 . 1 1 92 92 GLY C C 13 172.284 0.3 . 1 . . . A 93 GLY C . 25324 1 1049 . 1 1 92 92 GLY CA C 13 43.500 0.3 . 1 . . . A 93 GLY CA . 25324 1 1050 . 1 1 92 92 GLY N N 15 103.987 0.3 . 1 . . . A 93 GLY N . 25324 1 1051 . 1 1 93 93 SER H H 1 7.919 0.020 . 1 . . . A 94 SER H . 25324 1 1052 . 1 1 93 93 SER HA H 1 4.711 0.020 . 1 . . . A 94 SER HA . 25324 1 1053 . 1 1 93 93 SER HB2 H 1 4.133 0.020 . 2 . . . A 94 SER HB2 . 25324 1 1054 . 1 1 93 93 SER HB3 H 1 3.913 0.020 . 2 . . . A 94 SER HB3 . 25324 1 1055 . 1 1 93 93 SER C C 13 174.784 0.3 . 1 . . . A 94 SER C . 25324 1 1056 . 1 1 93 93 SER CA C 13 56.555 0.3 . 1 . . . A 94 SER CA . 25324 1 1057 . 1 1 93 93 SER CB C 13 65.051 0.3 . 1 . . . A 94 SER CB . 25324 1 1058 . 1 1 93 93 SER N N 15 110.274 0.3 . 1 . . . A 94 SER N . 25324 1 1059 . 1 1 94 94 ARG H H 1 9.148 0.020 . 1 . . . A 95 ARG H . 25324 1 1060 . 1 1 94 94 ARG HA H 1 4.672 0.020 . 1 . . . A 95 ARG HA . 25324 1 1061 . 1 1 94 94 ARG HB2 H 1 1.870 0.020 . 1 . . . A 95 ARG HB2 . 25324 1 1062 . 1 1 94 94 ARG HB3 H 1 1.870 0.020 . 1 . . . A 95 ARG HB3 . 25324 1 1063 . 1 1 94 94 ARG HG2 H 1 1.311 0.020 . 2 . . . A 95 ARG HG2 . 25324 1 1064 . 1 1 94 94 ARG HG3 H 1 1.256 0.020 . 2 . . . A 95 ARG HG3 . 25324 1 1065 . 1 1 94 94 ARG HD2 H 1 2.727 0.020 . 1 . . . A 95 ARG HD2 . 25324 1 1066 . 1 1 94 94 ARG HD3 H 1 2.727 0.020 . 1 . . . A 95 ARG HD3 . 25324 1 1067 . 1 1 94 94 ARG HE H 1 6.526 0.020 . 1 . . . A 95 ARG HE . 25324 1 1068 . 1 1 94 94 ARG C C 13 176.120 0.3 . 1 . . . A 95 ARG C . 25324 1 1069 . 1 1 94 94 ARG CA C 13 55.374 0.3 . 1 . . . A 95 ARG CA . 25324 1 1070 . 1 1 94 94 ARG CB C 13 31.848 0.3 . 1 . . . A 95 ARG CB . 25324 1 1071 . 1 1 94 94 ARG CG C 13 27.149 0.3 . 1 . . . A 95 ARG CG . 25324 1 1072 . 1 1 94 94 ARG CD C 13 43.199 0.3 . 1 . . . A 95 ARG CD . 25324 1 1073 . 1 1 94 94 ARG N N 15 123.020 0.3 . 1 . . . A 95 ARG N . 25324 1 1074 . 1 1 94 94 ARG NE N 15 85.203 0.3 . 1 . . . A 95 ARG NE . 25324 1 1075 . 1 1 95 95 GLU H H 1 8.610 0.020 . 1 . . . A 96 GLU H . 25324 1 1076 . 1 1 95 95 GLU HA H 1 4.282 0.020 . 1 . . . A 96 GLU HA . 25324 1 1077 . 1 1 95 95 GLU HB2 H 1 1.915 0.020 . 1 . . . A 96 GLU HB2 . 25324 1 1078 . 1 1 95 95 GLU HB3 H 1 1.915 0.020 . 1 . . . A 96 GLU HB3 . 25324 1 1079 . 1 1 95 95 GLU HG2 H 1 2.270 0.020 . 2 . . . A 96 GLU HG2 . 25324 1 1080 . 1 1 95 95 GLU HG3 H 1 2.206 0.020 . 2 . . . A 96 GLU HG3 . 25324 1 1081 . 1 1 95 95 GLU C C 13 176.278 0.3 . 1 . . . A 96 GLU C . 25324 1 1082 . 1 1 95 95 GLU CA C 13 56.530 0.3 . 1 . . . A 96 GLU CA . 25324 1 1083 . 1 1 95 95 GLU CB C 13 30.153 0.3 . 1 . . . A 96 GLU CB . 25324 1 1084 . 1 1 95 95 GLU CG C 13 35.663 0.3 . 1 . . . A 96 GLU CG . 25324 1 1085 . 1 1 95 95 GLU N N 15 120.357 0.3 . 1 . . . A 96 GLU N . 25324 1 1086 . 1 1 96 96 ASN H H 1 8.533 0.020 . 1 . . . A 97 ASN H . 25324 1 1087 . 1 1 96 96 ASN HA H 1 4.612 0.020 . 1 . . . A 97 ASN HA . 25324 1 1088 . 1 1 96 96 ASN HB2 H 1 2.876 0.020 . 2 . . . A 97 ASN HB2 . 25324 1 1089 . 1 1 96 96 ASN HB3 H 1 2.714 0.020 . 2 . . . A 97 ASN HB3 . 25324 1 1090 . 1 1 96 96 ASN HD21 H 1 7.908 0.020 . 1 . . . A 97 ASN HD21 . 25324 1 1091 . 1 1 96 96 ASN HD22 H 1 7.208 0.020 . 1 . . . A 97 ASN HD22 . 25324 1 1092 . 1 1 96 96 ASN C C 13 173.949 0.3 . 1 . . . A 97 ASN C . 25324 1 1093 . 1 1 96 96 ASN CA C 13 53.015 0.3 . 1 . . . A 97 ASN CA . 25324 1 1094 . 1 1 96 96 ASN CB C 13 38.166 0.3 . 1 . . . A 97 ASN CB . 25324 1 1095 . 1 1 96 96 ASN N N 15 117.678 0.3 . 1 . . . A 97 ASN N . 25324 1 1096 . 1 1 96 96 ASN ND2 N 15 112.703 0.3 . 1 . . . A 97 ASN ND2 . 25324 1 1097 . 1 1 97 97 GLN H H 1 7.663 0.020 . 1 . . . A 98 GLN H . 25324 1 1098 . 1 1 97 97 GLN HA H 1 4.360 0.020 . 1 . . . A 98 GLN HA . 25324 1 1099 . 1 1 97 97 GLN HB2 H 1 1.847 0.020 . 2 . . . A 98 GLN HB2 . 25324 1 1100 . 1 1 97 97 GLN HB3 H 1 1.671 0.020 . 2 . . . A 98 GLN HB3 . 25324 1 1101 . 1 1 97 97 GLN HG2 H 1 2.398 0.020 . 2 . . . A 98 GLN HG2 . 25324 1 1102 . 1 1 97 97 GLN HG3 H 1 2.201 0.020 . 2 . . . A 98 GLN HG3 . 25324 1 1103 . 1 1 97 97 GLN HE21 H 1 8.067 0.020 . 1 . . . A 98 GLN HE21 . 25324 1 1104 . 1 1 97 97 GLN HE22 H 1 7.260 0.020 . 1 . . . A 98 GLN HE22 . 25324 1 1105 . 1 1 97 97 GLN C C 13 173.116 0.3 . 1 . . . A 98 GLN C . 25324 1 1106 . 1 1 97 97 GLN CA C 13 55.628 0.3 . 1 . . . A 98 GLN CA . 25324 1 1107 . 1 1 97 97 GLN CB C 13 30.869 0.3 . 1 . . . A 98 GLN CB . 25324 1 1108 . 1 1 97 97 GLN CG C 13 33.733 0.3 . 1 . . . A 98 GLN CG . 25324 1 1109 . 1 1 97 97 GLN N N 15 118.592 0.3 . 1 . . . A 98 GLN N . 25324 1 1110 . 1 1 97 97 GLN NE2 N 15 113.012 0.3 . 1 . . . A 98 GLN NE2 . 25324 1 1111 . 1 1 98 98 ASN H H 1 8.759 0.020 . 1 . . . A 99 ASN H . 25324 1 1112 . 1 1 98 98 ASN HA H 1 5.135 0.020 . 1 . . . A 99 ASN HA . 25324 1 1113 . 1 1 98 98 ASN HB2 H 1 3.019 0.020 . 2 . . . A 99 ASN HB2 . 25324 1 1114 . 1 1 98 98 ASN HB3 H 1 2.691 0.020 . 2 . . . A 99 ASN HB3 . 25324 1 1115 . 1 1 98 98 ASN HD21 H 1 7.767 0.020 . 1 . . . A 99 ASN HD21 . 25324 1 1116 . 1 1 98 98 ASN HD22 H 1 6.933 0.020 . 1 . . . A 99 ASN HD22 . 25324 1 1117 . 1 1 98 98 ASN C C 13 175.287 0.3 . 1 . . . A 99 ASN C . 25324 1 1118 . 1 1 98 98 ASN CA C 13 52.990 0.3 . 1 . . . A 99 ASN CA . 25324 1 1119 . 1 1 98 98 ASN CB C 13 40.491 0.3 . 1 . . . A 99 ASN CB . 25324 1 1120 . 1 1 98 98 ASN N N 15 122.855 0.3 . 1 . . . A 99 ASN N . 25324 1 1121 . 1 1 98 98 ASN ND2 N 15 111.036 0.3 . 1 . . . A 99 ASN ND2 . 25324 1 1122 . 1 1 99 99 VAL H H 1 8.717 0.020 . 1 . . . A 100 VAL H . 25324 1 1123 . 1 1 99 99 VAL HA H 1 3.748 0.020 . 1 . . . A 100 VAL HA . 25324 1 1124 . 1 1 99 99 VAL HB H 1 1.732 0.020 . 1 . . . A 100 VAL HB . 25324 1 1125 . 1 1 99 99 VAL HG11 H 1 0.726 0.020 . 2 . . . A 100 VAL HG11 . 25324 1 1126 . 1 1 99 99 VAL HG12 H 1 0.726 0.020 . 2 . . . A 100 VAL HG12 . 25324 1 1127 . 1 1 99 99 VAL HG13 H 1 0.726 0.020 . 2 . . . A 100 VAL HG13 . 25324 1 1128 . 1 1 99 99 VAL HG21 H 1 0.683 0.020 . 2 . . . A 100 VAL HG21 . 25324 1 1129 . 1 1 99 99 VAL HG22 H 1 0.683 0.020 . 2 . . . A 100 VAL HG22 . 25324 1 1130 . 1 1 99 99 VAL HG23 H 1 0.683 0.020 . 2 . . . A 100 VAL HG23 . 25324 1 1131 . 1 1 99 99 VAL C C 13 174.956 0.3 . 1 . . . A 100 VAL C . 25324 1 1132 . 1 1 99 99 VAL CA C 13 63.843 0.3 . 1 . . . A 100 VAL CA . 25324 1 1133 . 1 1 99 99 VAL CB C 13 32.443 0.3 . 1 . . . A 100 VAL CB . 25324 1 1134 . 1 1 99 99 VAL CG1 C 13 23.177 0.3 . 1 . . . A 100 VAL CG1 . 25324 1 1135 . 1 1 99 99 VAL CG2 C 13 22.069 0.3 . 1 . . . A 100 VAL CG2 . 25324 1 1136 . 1 1 99 99 VAL N N 15 121.385 0.3 . 1 . . . A 100 VAL N . 25324 1 1137 . 1 1 100 100 VAL H H 1 8.802 0.020 . 1 . . . A 101 VAL H . 25324 1 1138 . 1 1 100 100 VAL HA H 1 4.645 0.020 . 1 . . . A 101 VAL HA . 25324 1 1139 . 1 1 100 100 VAL HB H 1 2.518 0.020 . 1 . . . A 101 VAL HB . 25324 1 1140 . 1 1 100 100 VAL HG11 H 1 0.820 0.020 . 2 . . . A 101 VAL HG11 . 25324 1 1141 . 1 1 100 100 VAL HG12 H 1 0.820 0.020 . 2 . . . A 101 VAL HG12 . 25324 1 1142 . 1 1 100 100 VAL HG13 H 1 0.820 0.020 . 2 . . . A 101 VAL HG13 . 25324 1 1143 . 1 1 100 100 VAL HG21 H 1 0.651 0.020 . 2 . . . A 101 VAL HG21 . 25324 1 1144 . 1 1 100 100 VAL HG22 H 1 0.651 0.020 . 2 . . . A 101 VAL HG22 . 25324 1 1145 . 1 1 100 100 VAL HG23 H 1 0.651 0.020 . 2 . . . A 101 VAL HG23 . 25324 1 1146 . 1 1 100 100 VAL C C 13 175.577 0.3 . 1 . . . A 101 VAL C . 25324 1 1147 . 1 1 100 100 VAL CA C 13 59.963 0.3 . 1 . . . A 101 VAL CA . 25324 1 1148 . 1 1 100 100 VAL CB C 13 33.041 0.3 . 1 . . . A 101 VAL CB . 25324 1 1149 . 1 1 100 100 VAL CG1 C 13 20.464 0.3 . 1 . . . A 101 VAL CG1 . 25324 1 1150 . 1 1 100 100 VAL CG2 C 13 18.179 0.3 . 1 . . . A 101 VAL CG2 . 25324 1 1151 . 1 1 100 100 VAL N N 15 112.736 0.3 . 1 . . . A 101 VAL N . 25324 1 1152 . 1 1 101 101 ALA H H 1 7.677 0.020 . 1 . . . A 102 ALA H . 25324 1 1153 . 1 1 101 101 ALA HA H 1 4.807 0.020 . 1 . . . A 102 ALA HA . 25324 1 1154 . 1 1 101 101 ALA HB1 H 1 1.473 0.020 . 1 . . . A 102 ALA HB1 . 25324 1 1155 . 1 1 101 101 ALA HB2 H 1 1.473 0.020 . 1 . . . A 102 ALA HB2 . 25324 1 1156 . 1 1 101 101 ALA HB3 H 1 1.473 0.020 . 1 . . . A 102 ALA HB3 . 25324 1 1157 . 1 1 101 101 ALA C C 13 176.046 0.3 . 1 . . . A 102 ALA C . 25324 1 1158 . 1 1 101 101 ALA CA C 13 53.254 0.3 . 1 . . . A 102 ALA CA . 25324 1 1159 . 1 1 101 101 ALA CB C 13 21.625 0.3 . 1 . . . A 102 ALA CB . 25324 1 1160 . 1 1 101 101 ALA N N 15 122.104 0.3 . 1 . . . A 102 ALA N . 25324 1 1161 . 1 1 102 102 ILE H H 1 8.102 0.020 . 1 . . . A 103 ILE H . 25324 1 1162 . 1 1 102 102 ILE HA H 1 4.027 0.020 . 1 . . . A 103 ILE HA . 25324 1 1163 . 1 1 102 102 ILE HB H 1 1.363 0.020 . 1 . . . A 103 ILE HB . 25324 1 1164 . 1 1 102 102 ILE HG12 H 1 1.296 0.020 . 2 . . . A 103 ILE HG12 . 25324 1 1165 . 1 1 102 102 ILE HG13 H 1 0.774 0.020 . 2 . . . A 103 ILE HG13 . 25324 1 1166 . 1 1 102 102 ILE HG21 H 1 0.455 0.020 . 1 . . . A 103 ILE HG21 . 25324 1 1167 . 1 1 102 102 ILE HG22 H 1 0.455 0.020 . 1 . . . A 103 ILE HG22 . 25324 1 1168 . 1 1 102 102 ILE HG23 H 1 0.455 0.020 . 1 . . . A 103 ILE HG23 . 25324 1 1169 . 1 1 102 102 ILE HD11 H 1 0.660 0.020 . 1 . . . A 103 ILE HD11 . 25324 1 1170 . 1 1 102 102 ILE HD12 H 1 0.660 0.020 . 1 . . . A 103 ILE HD12 . 25324 1 1171 . 1 1 102 102 ILE HD13 H 1 0.660 0.020 . 1 . . . A 103 ILE HD13 . 25324 1 1172 . 1 1 102 102 ILE C C 13 173.118 0.3 . 1 . . . A 103 ILE C . 25324 1 1173 . 1 1 102 102 ILE CA C 13 62.227 0.3 . 1 . . . A 103 ILE CA . 25324 1 1174 . 1 1 102 102 ILE CB C 13 42.471 0.3 . 1 . . . A 103 ILE CB . 25324 1 1175 . 1 1 102 102 ILE CG1 C 13 27.750 0.3 . 1 . . . A 103 ILE CG1 . 25324 1 1176 . 1 1 102 102 ILE CG2 C 13 17.895 0.3 . 1 . . . A 103 ILE CG2 . 25324 1 1177 . 1 1 102 102 ILE CD1 C 13 15.364 0.3 . 1 . . . A 103 ILE CD1 . 25324 1 1178 . 1 1 102 102 ILE N N 15 118.218 0.3 . 1 . . . A 103 ILE N . 25324 1 1179 . 1 1 103 103 ASN H H 1 8.668 0.020 . 1 . . . A 104 ASN H . 25324 1 1180 . 1 1 103 103 ASN HA H 1 5.686 0.020 . 1 . . . A 104 ASN HA . 25324 1 1181 . 1 1 103 103 ASN HB2 H 1 2.781 0.020 . 2 . . . A 104 ASN HB2 . 25324 1 1182 . 1 1 103 103 ASN HB3 H 1 2.580 0.020 . 2 . . . A 104 ASN HB3 . 25324 1 1183 . 1 1 103 103 ASN HD21 H 1 7.431 0.020 . 1 . . . A 104 ASN HD21 . 25324 1 1184 . 1 1 103 103 ASN HD22 H 1 6.628 0.020 . 1 . . . A 104 ASN HD22 . 25324 1 1185 . 1 1 103 103 ASN C C 13 174.870 0.3 . 1 . . . A 104 ASN C . 25324 1 1186 . 1 1 103 103 ASN CA C 13 52.553 0.3 . 1 . . . A 104 ASN CA . 25324 1 1187 . 1 1 103 103 ASN CB C 13 38.852 0.3 . 1 . . . A 104 ASN CB . 25324 1 1188 . 1 1 103 103 ASN N N 15 125.938 0.3 . 1 . . . A 104 ASN N . 25324 1 1189 . 1 1 103 103 ASN ND2 N 15 110.024 0.3 . 1 . . . A 104 ASN ND2 . 25324 1 1190 . 1 1 104 104 VAL H H 1 8.933 0.020 . 1 . . . A 105 VAL H . 25324 1 1191 . 1 1 104 104 VAL HA H 1 5.205 0.020 . 1 . . . A 105 VAL HA . 25324 1 1192 . 1 1 104 104 VAL HB H 1 1.498 0.020 . 1 . . . A 105 VAL HB . 25324 1 1193 . 1 1 104 104 VAL HG11 H 1 0.017 0.020 . 2 . . . A 105 VAL HG11 . 25324 1 1194 . 1 1 104 104 VAL HG12 H 1 0.017 0.020 . 2 . . . A 105 VAL HG12 . 25324 1 1195 . 1 1 104 104 VAL HG13 H 1 0.017 0.020 . 2 . . . A 105 VAL HG13 . 25324 1 1196 . 1 1 104 104 VAL HG21 H 1 0.255 0.020 . 2 . . . A 105 VAL HG21 . 25324 1 1197 . 1 1 104 104 VAL HG22 H 1 0.255 0.020 . 2 . . . A 105 VAL HG22 . 25324 1 1198 . 1 1 104 104 VAL HG23 H 1 0.255 0.020 . 2 . . . A 105 VAL HG23 . 25324 1 1199 . 1 1 104 104 VAL C C 13 174.788 0.3 . 1 . . . A 105 VAL C . 25324 1 1200 . 1 1 104 104 VAL CA C 13 57.979 0.3 . 1 . . . A 105 VAL CA . 25324 1 1201 . 1 1 104 104 VAL CB C 13 36.040 0.3 . 1 . . . A 105 VAL CB . 25324 1 1202 . 1 1 104 104 VAL CG1 C 13 21.095 0.3 . 1 . . . A 105 VAL CG1 . 25324 1 1203 . 1 1 104 104 VAL CG2 C 13 19.280 0.3 . 1 . . . A 105 VAL CG2 . 25324 1 1204 . 1 1 104 104 VAL N N 15 114.631 0.3 . 1 . . . A 105 VAL N . 25324 1 1205 . 1 1 105 105 GLU H H 1 8.814 0.020 . 1 . . . A 106 GLU H . 25324 1 1206 . 1 1 105 105 GLU HA H 1 5.080 0.020 . 1 . . . A 106 GLU HA . 25324 1 1207 . 1 1 105 105 GLU HB2 H 1 2.195 0.020 . 1 . . . A 106 GLU HB2 . 25324 1 1208 . 1 1 105 105 GLU HB3 H 1 2.195 0.020 . 1 . . . A 106 GLU HB3 . 25324 1 1209 . 1 1 105 105 GLU HG2 H 1 2.364 0.020 . 1 . . . A 106 GLU HG2 . 25324 1 1210 . 1 1 105 105 GLU HG3 H 1 2.364 0.020 . 1 . . . A 106 GLU HG3 . 25324 1 1211 . 1 1 105 105 GLU C C 13 174.777 0.3 . 1 . . . A 106 GLU C . 25324 1 1212 . 1 1 105 105 GLU CA C 13 54.967 0.3 . 1 . . . A 106 GLU CA . 25324 1 1213 . 1 1 105 105 GLU CB C 13 33.643 0.3 . 1 . . . A 106 GLU CB . 25324 1 1214 . 1 1 105 105 GLU CG C 13 34.719 0.3 . 1 . . . A 106 GLU CG . 25324 1 1215 . 1 1 105 105 GLU N N 15 118.347 0.3 . 1 . . . A 106 GLU N . 25324 1 1216 . 1 1 106 106 SER H H 1 8.576 0.020 . 1 . . . A 107 SER H . 25324 1 1217 . 1 1 106 106 SER HA H 1 5.266 0.020 . 1 . . . A 107 SER HA . 25324 1 1218 . 1 1 106 106 SER HB2 H 1 4.105 0.020 . 2 . . . A 107 SER HB2 . 25324 1 1219 . 1 1 106 106 SER HB3 H 1 3.663 0.020 . 2 . . . A 107 SER HB3 . 25324 1 1220 . 1 1 106 106 SER C C 13 175.787 0.3 . 1 . . . A 107 SER C . 25324 1 1221 . 1 1 106 106 SER CA C 13 55.888 0.3 . 1 . . . A 107 SER CA . 25324 1 1222 . 1 1 106 106 SER CB C 13 65.921 0.3 . 1 . . . A 107 SER CB . 25324 1 1223 . 1 1 106 106 SER N N 15 115.335 0.3 . 1 . . . A 107 SER N . 25324 1 1224 . 1 1 107 107 GLY H H 1 9.532 0.020 . 1 . . . A 108 GLY H . 25324 1 1225 . 1 1 107 107 GLY HA2 H 1 4.715 0.020 . 2 . . . A 108 GLY HA2 . 25324 1 1226 . 1 1 107 107 GLY HA3 H 1 3.716 0.020 . 2 . . . A 108 GLY HA3 . 25324 1 1227 . 1 1 107 107 GLY C C 13 173.959 0.3 . 1 . . . A 108 GLY C . 25324 1 1228 . 1 1 107 107 GLY CA C 13 44.677 0.3 . 1 . . . A 108 GLY CA . 25324 1 1229 . 1 1 107 107 GLY N N 15 117.567 0.3 . 1 . . . A 108 GLY N . 25324 1 1230 . 1 1 108 108 ASP H H 1 8.605 0.020 . 1 . . . A 109 ASP H . 25324 1 1231 . 1 1 108 108 ASP HA H 1 4.801 0.020 . 1 . . . A 109 ASP HA . 25324 1 1232 . 1 1 108 108 ASP HB2 H 1 3.003 0.020 . 2 . . . A 109 ASP HB2 . 25324 1 1233 . 1 1 108 108 ASP HB3 H 1 2.391 0.020 . 2 . . . A 109 ASP HB3 . 25324 1 1234 . 1 1 108 108 ASP C C 13 176.203 0.3 . 1 . . . A 109 ASP C . 25324 1 1235 . 1 1 108 108 ASP CA C 13 52.134 0.3 . 1 . . . A 109 ASP CA . 25324 1 1236 . 1 1 108 108 ASP CB C 13 39.342 0.3 . 1 . . . A 109 ASP CB . 25324 1 1237 . 1 1 108 108 ASP N N 15 122.108 0.3 . 1 . . . A 109 ASP N . 25324 1 1238 . 1 1 109 109 ASP H H 1 9.087 0.020 . 1 . . . A 110 ASP H . 25324 1 1239 . 1 1 109 109 ASP HA H 1 4.222 0.020 . 1 . . . A 110 ASP HA . 25324 1 1240 . 1 1 109 109 ASP HB2 H 1 2.976 0.020 . 2 . . . A 110 ASP HB2 . 25324 1 1241 . 1 1 109 109 ASP HB3 H 1 2.785 0.020 . 2 . . . A 110 ASP HB3 . 25324 1 1242 . 1 1 109 109 ASP C C 13 175.951 0.3 . 1 . . . A 110 ASP C . 25324 1 1243 . 1 1 109 109 ASP CA C 13 55.198 0.3 . 1 . . . A 110 ASP CA . 25324 1 1244 . 1 1 109 109 ASP CB C 13 38.630 0.3 . 1 . . . A 110 ASP CB . 25324 1 1245 . 1 1 109 109 ASP N N 15 116.197 0.3 . 1 . . . A 110 ASP N . 25324 1 1246 . 1 1 110 110 GLY H H 1 8.930 0.020 . 1 . . . A 111 GLY H . 25324 1 1247 . 1 1 110 110 GLY HA2 H 1 4.141 0.020 . 2 . . . A 111 GLY HA2 . 25324 1 1248 . 1 1 110 110 GLY HA3 H 1 3.567 0.020 . 2 . . . A 111 GLY HA3 . 25324 1 1249 . 1 1 110 110 GLY C C 13 173.924 0.3 . 1 . . . A 111 GLY C . 25324 1 1250 . 1 1 110 110 GLY CA C 13 45.163 0.3 . 1 . . . A 111 GLY CA . 25324 1 1251 . 1 1 110 110 GLY N N 15 103.841 0.3 . 1 . . . A 111 GLY N . 25324 1 1252 . 1 1 111 111 GLN H H 1 7.351 0.020 . 1 . . . A 112 GLN H . 25324 1 1253 . 1 1 111 111 GLN HA H 1 4.070 0.020 . 1 . . . A 112 GLN HA . 25324 1 1254 . 1 1 111 111 GLN HB2 H 1 2.115 0.020 . 2 . . . A 112 GLN HB2 . 25324 1 1255 . 1 1 111 111 GLN HB3 H 1 2.003 0.020 . 2 . . . A 112 GLN HB3 . 25324 1 1256 . 1 1 111 111 GLN HG2 H 1 2.469 0.020 . 2 . . . A 112 GLN HG2 . 25324 1 1257 . 1 1 111 111 GLN HG3 H 1 2.347 0.020 . 2 . . . A 112 GLN HG3 . 25324 1 1258 . 1 1 111 111 GLN HE21 H 1 7.453 0.020 . 1 . . . A 112 GLN HE21 . 25324 1 1259 . 1 1 111 111 GLN HE22 H 1 6.812 0.020 . 1 . . . A 112 GLN HE22 . 25324 1 1260 . 1 1 111 111 GLN C C 13 176.431 0.3 . 1 . . . A 112 GLN C . 25324 1 1261 . 1 1 111 111 GLN CA C 13 58.273 0.3 . 1 . . . A 112 GLN CA . 25324 1 1262 . 1 1 111 111 GLN CB C 13 27.693 0.3 . 1 . . . A 112 GLN CB . 25324 1 1263 . 1 1 111 111 GLN CG C 13 33.785 0.3 . 1 . . . A 112 GLN CG . 25324 1 1264 . 1 1 111 111 GLN N N 15 121.626 0.3 . 1 . . . A 112 GLN N . 25324 1 1265 . 1 1 111 111 GLN NE2 N 15 112.032 0.3 . 1 . . . A 112 GLN NE2 . 25324 1 1266 . 1 1 112 112 THR H H 1 10.053 0.020 . 1 . . . A 113 THR H . 25324 1 1267 . 1 1 112 112 THR HA H 1 5.331 0.020 . 1 . . . A 113 THR HA . 25324 1 1268 . 1 1 112 112 THR HB H 1 4.000 0.020 . 1 . . . A 113 THR HB . 25324 1 1269 . 1 1 112 112 THR HG21 H 1 1.184 0.020 . 1 . . . A 113 THR HG21 . 25324 1 1270 . 1 1 112 112 THR HG22 H 1 1.184 0.020 . 1 . . . A 113 THR HG22 . 25324 1 1271 . 1 1 112 112 THR HG23 H 1 1.184 0.020 . 1 . . . A 113 THR HG23 . 25324 1 1272 . 1 1 112 112 THR C C 13 174.452 0.3 . 1 . . . A 113 THR C . 25324 1 1273 . 1 1 112 112 THR CA C 13 59.739 0.3 . 1 . . . A 113 THR CA . 25324 1 1274 . 1 1 112 112 THR CB C 13 71.773 0.3 . 1 . . . A 113 THR CB . 25324 1 1275 . 1 1 112 112 THR CG2 C 13 22.221 0.3 . 1 . . . A 113 THR CG2 . 25324 1 1276 . 1 1 112 112 THR N N 15 112.322 0.3 . 1 . . . A 113 THR N . 25324 1 1277 . 1 1 113 113 LEU H H 1 8.978 0.020 . 1 . . . A 114 LEU H . 25324 1 1278 . 1 1 113 113 LEU HA H 1 4.581 0.020 . 1 . . . A 114 LEU HA . 25324 1 1279 . 1 1 113 113 LEU HB2 H 1 1.325 0.020 . 2 . . . A 114 LEU HB2 . 25324 1 1280 . 1 1 113 113 LEU HB3 H 1 0.845 0.020 . 2 . . . A 114 LEU HB3 . 25324 1 1281 . 1 1 113 113 LEU HG H 1 1.342 0.020 . 1 . . . A 114 LEU HG . 25324 1 1282 . 1 1 113 113 LEU HD11 H 1 0.092 0.020 . 2 . . . A 114 LEU HD11 . 25324 1 1283 . 1 1 113 113 LEU HD12 H 1 0.092 0.020 . 2 . . . A 114 LEU HD12 . 25324 1 1284 . 1 1 113 113 LEU HD13 H 1 0.092 0.020 . 2 . . . A 114 LEU HD13 . 25324 1 1285 . 1 1 113 113 LEU HD21 H 1 0.413 0.020 . 2 . . . A 114 LEU HD21 . 25324 1 1286 . 1 1 113 113 LEU HD22 H 1 0.413 0.020 . 2 . . . A 114 LEU HD22 . 25324 1 1287 . 1 1 113 113 LEU HD23 H 1 0.413 0.020 . 2 . . . A 114 LEU HD23 . 25324 1 1288 . 1 1 113 113 LEU C C 13 175.113 0.3 . 1 . . . A 114 LEU C . 25324 1 1289 . 1 1 113 113 LEU CA C 13 52.905 0.3 . 1 . . . A 114 LEU CA . 25324 1 1290 . 1 1 113 113 LEU CB C 13 47.033 0.3 . 1 . . . A 114 LEU CB . 25324 1 1291 . 1 1 113 113 LEU CG C 13 25.982 0.3 . 1 . . . A 114 LEU CG . 25324 1 1292 . 1 1 113 113 LEU CD1 C 13 24.901 0.3 . 1 . . . A 114 LEU CD1 . 25324 1 1293 . 1 1 113 113 LEU CD2 C 13 22.742 0.3 . 1 . . . A 114 LEU CD2 . 25324 1 1294 . 1 1 113 113 LEU N N 15 122.083 0.3 . 1 . . . A 114 LEU N . 25324 1 1295 . 1 1 114 114 ASN H H 1 8.837 0.020 . 1 . . . A 115 ASN H . 25324 1 1296 . 1 1 114 114 ASN HA H 1 5.770 0.020 . 1 . . . A 115 ASN HA . 25324 1 1297 . 1 1 114 114 ASN HB2 H 1 2.890 0.020 . 2 . . . A 115 ASN HB2 . 25324 1 1298 . 1 1 114 114 ASN HB3 H 1 2.762 0.020 . 2 . . . A 115 ASN HB3 . 25324 1 1299 . 1 1 114 114 ASN HD21 H 1 7.510 0.020 . 1 . . . A 115 ASN HD21 . 25324 1 1300 . 1 1 114 114 ASN HD22 H 1 6.792 0.020 . 1 . . . A 115 ASN HD22 . 25324 1 1301 . 1 1 114 114 ASN C C 13 174.788 0.3 . 1 . . . A 115 ASN C . 25324 1 1302 . 1 1 114 114 ASN CA C 13 52.342 0.3 . 1 . . . A 115 ASN CA . 25324 1 1303 . 1 1 114 114 ASN CB C 13 43.414 0.3 . 1 . . . A 115 ASN CB . 25324 1 1304 . 1 1 114 114 ASN N N 15 118.846 0.3 . 1 . . . A 115 ASN N . 25324 1 1305 . 1 1 114 114 ASN ND2 N 15 113.413 0.3 . 1 . . . A 115 ASN ND2 . 25324 1 1306 . 1 1 115 115 GLY H H 1 8.625 0.020 . 1 . . . A 116 GLY H . 25324 1 1307 . 1 1 115 115 GLY HA2 H 1 5.223 0.020 . 2 . . . A 116 GLY HA2 . 25324 1 1308 . 1 1 115 115 GLY HA3 H 1 4.104 0.020 . 2 . . . A 116 GLY HA3 . 25324 1 1309 . 1 1 115 115 GLY C C 13 172.452 0.3 . 1 . . . A 116 GLY C . 25324 1 1310 . 1 1 115 115 GLY CA C 13 46.471 0.3 . 1 . . . A 116 GLY CA . 25324 1 1311 . 1 1 115 115 GLY N N 15 109.661 0.3 . 1 . . . A 116 GLY N . 25324 1 1312 . 1 1 116 116 THR H H 1 8.911 0.020 . 1 . . . A 117 THR H . 25324 1 1313 . 1 1 116 116 THR HA H 1 5.556 0.020 . 1 . . . A 117 THR HA . 25324 1 1314 . 1 1 116 116 THR HB H 1 4.242 0.020 . 1 . . . A 117 THR HB . 25324 1 1315 . 1 1 116 116 THR HG21 H 1 1.194 0.020 . 1 . . . A 117 THR HG21 . 25324 1 1316 . 1 1 116 116 THR HG22 H 1 1.194 0.020 . 1 . . . A 117 THR HG22 . 25324 1 1317 . 1 1 116 116 THR HG23 H 1 1.194 0.020 . 1 . . . A 117 THR HG23 . 25324 1 1318 . 1 1 116 116 THR C C 13 171.619 0.3 . 1 . . . A 117 THR C . 25324 1 1319 . 1 1 116 116 THR CA C 13 59.373 0.3 . 1 . . . A 117 THR CA . 25324 1 1320 . 1 1 116 116 THR CB C 13 72.777 0.3 . 1 . . . A 117 THR CB . 25324 1 1321 . 1 1 116 116 THR CG2 C 13 20.325 0.3 . 1 . . . A 117 THR CG2 . 25324 1 1322 . 1 1 116 116 THR N N 15 120.009 0.3 . 1 . . . A 117 THR N . 25324 1 1323 . 1 1 117 117 MET H H 1 9.159 0.020 . 1 . . . A 118 MET H . 25324 1 1324 . 1 1 117 117 MET HA H 1 4.889 0.020 . 1 . . . A 118 MET HA . 25324 1 1325 . 1 1 117 117 MET HB2 H 1 1.788 0.020 . 1 . . . A 118 MET HB2 . 25324 1 1326 . 1 1 117 117 MET HB3 H 1 1.788 0.020 . 1 . . . A 118 MET HB3 . 25324 1 1327 . 1 1 117 117 MET HG2 H 1 2.356 0.020 . 2 . . . A 118 MET HG2 . 25324 1 1328 . 1 1 117 117 MET HG3 H 1 2.150 0.020 . 2 . . . A 118 MET HG3 . 25324 1 1329 . 1 1 117 117 MET HE1 H 1 1.370 0.020 . 1 . . . A 118 MET HE1 . 25324 1 1330 . 1 1 117 117 MET HE2 H 1 1.370 0.020 . 1 . . . A 118 MET HE2 . 25324 1 1331 . 1 1 117 117 MET HE3 H 1 1.370 0.020 . 1 . . . A 118 MET HE3 . 25324 1 1332 . 1 1 117 117 MET C C 13 172.707 0.3 . 1 . . . A 118 MET C . 25324 1 1333 . 1 1 117 117 MET CA C 13 54.714 0.3 . 1 . . . A 118 MET CA . 25324 1 1334 . 1 1 117 117 MET CB C 13 33.663 0.3 . 1 . . . A 118 MET CB . 25324 1 1335 . 1 1 117 117 MET CG C 13 30.017 0.3 . 1 . . . A 118 MET CG . 25324 1 1336 . 1 1 117 117 MET CE C 13 17.045 0.3 . 1 . . . A 118 MET CE . 25324 1 1337 . 1 1 117 117 MET N N 15 115.550 0.3 . 1 . . . A 118 MET N . 25324 1 1338 . 1 1 118 118 THR H H 1 8.685 0.020 . 1 . . . A 119 THR H . 25324 1 1339 . 1 1 118 118 THR HA H 1 4.682 0.020 . 1 . . . A 119 THR HA . 25324 1 1340 . 1 1 118 118 THR HB H 1 3.651 0.020 . 1 . . . A 119 THR HB . 25324 1 1341 . 1 1 118 118 THR HG21 H 1 1.024 0.020 . 1 . . . A 119 THR HG21 . 25324 1 1342 . 1 1 118 118 THR HG22 H 1 1.024 0.020 . 1 . . . A 119 THR HG22 . 25324 1 1343 . 1 1 118 118 THR HG23 H 1 1.024 0.020 . 1 . . . A 119 THR HG23 . 25324 1 1344 . 1 1 118 118 THR C C 13 173.952 0.3 . 1 . . . A 119 THR C . 25324 1 1345 . 1 1 118 118 THR CA C 13 61.395 0.3 . 1 . . . A 119 THR CA . 25324 1 1346 . 1 1 118 118 THR CB C 13 71.746 0.3 . 1 . . . A 119 THR CB . 25324 1 1347 . 1 1 118 118 THR CG2 C 13 22.562 0.3 . 1 . . . A 119 THR CG2 . 25324 1 1348 . 1 1 118 118 THR N N 15 113.716 0.3 . 1 . . . A 119 THR N . 25324 1 1349 . 1 1 119 119 TYR H H 1 10.107 0.020 . 1 . . . A 120 TYR H . 25324 1 1350 . 1 1 119 119 TYR HA H 1 4.800 0.020 . 1 . . . A 120 TYR HA . 25324 1 1351 . 1 1 119 119 TYR HB2 H 1 2.762 0.020 . 2 . . . A 120 TYR HB2 . 25324 1 1352 . 1 1 119 119 TYR HB3 H 1 2.537 0.020 . 2 . . . A 120 TYR HB3 . 25324 1 1353 . 1 1 119 119 TYR HD1 H 1 6.909 0.020 . 1 . . . A 120 TYR HD1 . 25324 1 1354 . 1 1 119 119 TYR HD2 H 1 6.909 0.020 . 1 . . . A 120 TYR HD2 . 25324 1 1355 . 1 1 119 119 TYR HE1 H 1 7.156 0.020 . 1 . . . A 120 TYR HE1 . 25324 1 1356 . 1 1 119 119 TYR HE2 H 1 7.156 0.020 . 1 . . . A 120 TYR HE2 . 25324 1 1357 . 1 1 119 119 TYR C C 13 175.214 0.3 . 1 . . . A 120 TYR C . 25324 1 1358 . 1 1 119 119 TYR CA C 13 58.877 0.3 . 1 . . . A 120 TYR CA . 25324 1 1359 . 1 1 119 119 TYR CB C 13 40.502 0.3 . 1 . . . A 120 TYR CB . 25324 1 1360 . 1 1 119 119 TYR CD1 C 13 132.848 0.3 . 1 . . . A 120 TYR CD1 . 25324 1 1361 . 1 1 119 119 TYR CE1 C 13 118.645 0.3 . 1 . . . A 120 TYR CE1 . 25324 1 1362 . 1 1 119 119 TYR N N 15 129.153 0.3 . 1 . . . A 120 TYR N . 25324 1 1363 . 1 1 120 120 ALA H H 1 8.704 0.020 . 1 . . . A 121 ALA H . 25324 1 1364 . 1 1 120 120 ALA HA H 1 4.004 0.020 . 1 . . . A 121 ALA HA . 25324 1 1365 . 1 1 120 120 ALA HB1 H 1 1.416 0.020 . 1 . . . A 121 ALA HB1 . 25324 1 1366 . 1 1 120 120 ALA HB2 H 1 1.416 0.020 . 1 . . . A 121 ALA HB2 . 25324 1 1367 . 1 1 120 120 ALA HB3 H 1 1.416 0.020 . 1 . . . A 121 ALA HB3 . 25324 1 1368 . 1 1 120 120 ALA C C 13 178.456 0.3 . 1 . . . A 121 ALA C . 25324 1 1369 . 1 1 120 120 ALA CA C 13 53.956 0.3 . 1 . . . A 121 ALA CA . 25324 1 1370 . 1 1 120 120 ALA CB C 13 18.710 0.3 . 1 . . . A 121 ALA CB . 25324 1 1371 . 1 1 120 120 ALA N N 15 119.947 0.3 . 1 . . . A 121 ALA N . 25324 1 1372 . 1 1 121 121 GLY H H 1 8.792 0.020 . 1 . . . A 122 GLY H . 25324 1 1373 . 1 1 121 121 GLY HA2 H 1 4.202 0.020 . 2 . . . A 122 GLY HA2 . 25324 1 1374 . 1 1 121 121 GLY HA3 H 1 3.715 0.020 . 2 . . . A 122 GLY HA3 . 25324 1 1375 . 1 1 121 121 GLY C C 13 173.949 0.3 . 1 . . . A 122 GLY C . 25324 1 1376 . 1 1 121 121 GLY CA C 13 45.002 0.3 . 1 . . . A 122 GLY CA . 25324 1 1377 . 1 1 121 121 GLY N N 15 111.186 0.3 . 1 . . . A 122 GLY N . 25324 1 1378 . 1 1 122 122 GLU H H 1 8.072 0.020 . 1 . . . A 123 GLU H . 25324 1 1379 . 1 1 122 122 GLU HA H 1 4.705 0.020 . 1 . . . A 123 GLU HA . 25324 1 1380 . 1 1 122 122 GLU HB2 H 1 2.396 0.020 . 1 . . . A 123 GLU HB2 . 25324 1 1381 . 1 1 122 122 GLU HB3 H 1 2.396 0.020 . 1 . . . A 123 GLU HB3 . 25324 1 1382 . 1 1 122 122 GLU HG2 H 1 2.173 0.020 . 2 . . . A 123 GLU HG2 . 25324 1 1383 . 1 1 122 122 GLU HG3 H 1 1.982 0.020 . 2 . . . A 123 GLU HG3 . 25324 1 1384 . 1 1 122 122 GLU C C 13 175.912 0.3 . 1 . . . A 123 GLU C . 25324 1 1385 . 1 1 122 122 GLU CA C 13 54.414 0.3 . 1 . . . A 123 GLU CA . 25324 1 1386 . 1 1 122 122 GLU CB C 13 32.784 0.3 . 1 . . . A 123 GLU CB . 25324 1 1387 . 1 1 122 122 GLU CG C 13 36.327 0.3 . 1 . . . A 123 GLU CG . 25324 1 1388 . 1 1 122 122 GLU N N 15 120.099 0.3 . 1 . . . A 123 GLU N . 25324 1 1389 . 1 1 123 123 GLY H H 1 7.939 0.020 . 1 . . . A 124 GLY H . 25324 1 1390 . 1 1 123 123 GLY HA2 H 1 4.555 0.020 . 2 . . . A 124 GLY HA2 . 25324 1 1391 . 1 1 123 123 GLY HA3 H 1 3.789 0.020 . 2 . . . A 124 GLY HA3 . 25324 1 1392 . 1 1 123 123 GLY CA C 13 43.802 0.3 . 1 . . . A 124 GLY CA . 25324 1 1393 . 1 1 123 123 GLY N N 15 105.303 0.3 . 1 . . . A 124 GLY N . 25324 1 1394 . 1 1 124 124 PRO HA H 1 4.935 0.020 . 1 . . . A 125 PRO HA . 25324 1 1395 . 1 1 124 124 PRO HB2 H 1 2.088 0.020 . 2 . . . A 125 PRO HB2 . 25324 1 1396 . 1 1 124 124 PRO HB3 H 1 1.752 0.020 . 2 . . . A 125 PRO HB3 . 25324 1 1397 . 1 1 124 124 PRO HG2 H 1 2.045 0.020 . 2 . . . A 125 PRO HG2 . 25324 1 1398 . 1 1 124 124 PRO HG3 H 1 1.955 0.020 . 2 . . . A 125 PRO HG3 . 25324 1 1399 . 1 1 124 124 PRO HD2 H 1 3.622 0.020 . 1 . . . A 125 PRO HD2 . 25324 1 1400 . 1 1 124 124 PRO HD3 H 1 3.622 0.020 . 1 . . . A 125 PRO HD3 . 25324 1 1401 . 1 1 124 124 PRO C C 13 177.788 0.3 . 1 . . . A 125 PRO C . 25324 1 1402 . 1 1 124 124 PRO CA C 13 63.131 0.3 . 1 . . . A 125 PRO CA . 25324 1 1403 . 1 1 124 124 PRO CB C 13 31.859 0.3 . 1 . . . A 125 PRO CB . 25324 1 1404 . 1 1 124 124 PRO CG C 13 27.323 0.3 . 1 . . . A 125 PRO CG . 25324 1 1405 . 1 1 124 124 PRO CD C 13 49.045 0.3 . 1 . . . A 125 PRO CD . 25324 1 1406 . 1 1 125 125 ILE H H 1 9.599 0.020 . 1 . . . A 126 ILE H . 25324 1 1407 . 1 1 125 125 ILE HA H 1 4.899 0.020 . 1 . . . A 126 ILE HA . 25324 1 1408 . 1 1 125 125 ILE HB H 1 2.095 0.020 . 1 . . . A 126 ILE HB . 25324 1 1409 . 1 1 125 125 ILE HG12 H 1 1.600 0.020 . 2 . . . A 126 ILE HG12 . 25324 1 1410 . 1 1 125 125 ILE HG13 H 1 1.287 0.020 . 2 . . . A 126 ILE HG13 . 25324 1 1411 . 1 1 125 125 ILE HG21 H 1 1.138 0.020 . 1 . . . A 126 ILE HG21 . 25324 1 1412 . 1 1 125 125 ILE HG22 H 1 1.138 0.020 . 1 . . . A 126 ILE HG22 . 25324 1 1413 . 1 1 125 125 ILE HG23 H 1 1.138 0.020 . 1 . . . A 126 ILE HG23 . 25324 1 1414 . 1 1 125 125 ILE HD11 H 1 1.019 0.020 . 1 . . . A 126 ILE HD11 . 25324 1 1415 . 1 1 125 125 ILE HD12 H 1 1.019 0.020 . 1 . . . A 126 ILE HD12 . 25324 1 1416 . 1 1 125 125 ILE HD13 H 1 1.019 0.020 . 1 . . . A 126 ILE HD13 . 25324 1 1417 . 1 1 125 125 ILE C C 13 175.625 0.3 . 1 . . . A 126 ILE C . 25324 1 1418 . 1 1 125 125 ILE CA C 13 59.453 0.3 . 1 . . . A 126 ILE CA . 25324 1 1419 . 1 1 125 125 ILE CB C 13 42.548 0.3 . 1 . . . A 126 ILE CB . 25324 1 1420 . 1 1 125 125 ILE CG1 C 13 24.339 0.3 . 1 . . . A 126 ILE CG1 . 25324 1 1421 . 1 1 125 125 ILE CG2 C 13 17.719 0.3 . 1 . . . A 126 ILE CG2 . 25324 1 1422 . 1 1 125 125 ILE CD1 C 13 13.867 0.3 . 1 . . . A 126 ILE CD1 . 25324 1 1423 . 1 1 125 125 ILE N N 15 117.387 0.3 . 1 . . . A 126 ILE N . 25324 1 1424 . 1 1 126 126 GLY H H 1 8.840 0.020 . 1 . . . A 127 GLY H . 25324 1 1425 . 1 1 126 126 GLY HA2 H 1 4.471 0.020 . 2 . . . A 127 GLY HA2 . 25324 1 1426 . 1 1 126 126 GLY HA3 H 1 3.792 0.020 . 2 . . . A 127 GLY HA3 . 25324 1 1427 . 1 1 126 126 GLY C C 13 173.627 0.3 . 1 . . . A 127 GLY C . 25324 1 1428 . 1 1 126 126 GLY CA C 13 46.283 0.3 . 1 . . . A 127 GLY CA . 25324 1 1429 . 1 1 126 126 GLY N N 15 106.753 0.3 . 1 . . . A 127 GLY N . 25324 1 1430 . 1 1 127 127 PHE H H 1 8.924 0.020 . 1 . . . A 128 PHE H . 25324 1 1431 . 1 1 127 127 PHE HA H 1 4.944 0.020 . 1 . . . A 128 PHE HA . 25324 1 1432 . 1 1 127 127 PHE HB2 H 1 2.542 0.020 . 2 . . . A 128 PHE HB2 . 25324 1 1433 . 1 1 127 127 PHE HB3 H 1 2.210 0.020 . 2 . . . A 128 PHE HB3 . 25324 1 1434 . 1 1 127 127 PHE HD1 H 1 6.622 0.020 . 1 . . . A 128 PHE HD1 . 25324 1 1435 . 1 1 127 127 PHE HD2 H 1 6.622 0.020 . 1 . . . A 128 PHE HD2 . 25324 1 1436 . 1 1 127 127 PHE HE1 H 1 5.928 0.020 . 1 . . . A 128 PHE HE1 . 25324 1 1437 . 1 1 127 127 PHE HE2 H 1 5.928 0.020 . 1 . . . A 128 PHE HE2 . 25324 1 1438 . 1 1 127 127 PHE HZ H 1 5.951 0.020 . 1 . . . A 128 PHE HZ . 25324 1 1439 . 1 1 127 127 PHE C C 13 173.087 0.3 . 1 . . . A 128 PHE C . 25324 1 1440 . 1 1 127 127 PHE CA C 13 57.009 0.3 . 1 . . . A 128 PHE CA . 25324 1 1441 . 1 1 127 127 PHE CB C 13 43.160 0.3 . 1 . . . A 128 PHE CB . 25324 1 1442 . 1 1 127 127 PHE CD1 C 13 131.356 0.3 . 1 . . . A 128 PHE CD1 . 25324 1 1443 . 1 1 127 127 PHE CE1 C 13 131.084 0.3 . 1 . . . A 128 PHE CE1 . 25324 1 1444 . 1 1 127 127 PHE CZ C 13 128.055 0.3 . 1 . . . A 128 PHE CZ . 25324 1 1445 . 1 1 127 127 PHE N N 15 124.826 0.3 . 1 . . . A 128 PHE N . 25324 1 1446 . 1 1 128 128 LYS H H 1 8.201 0.020 . 1 . . . A 129 LYS H . 25324 1 1447 . 1 1 128 128 LYS HA H 1 4.883 0.020 . 1 . . . A 129 LYS HA . 25324 1 1448 . 1 1 128 128 LYS HB2 H 1 0.980 0.020 . 2 . . . A 129 LYS HB2 . 25324 1 1449 . 1 1 128 128 LYS HB3 H 1 0.892 0.020 . 2 . . . A 129 LYS HB3 . 25324 1 1450 . 1 1 128 128 LYS HG2 H 1 0.936 0.020 . 2 . . . A 129 LYS HG2 . 25324 1 1451 . 1 1 128 128 LYS HG3 H 1 0.812 0.020 . 2 . . . A 129 LYS HG3 . 25324 1 1452 . 1 1 128 128 LYS HD2 H 1 0.782 0.020 . 1 . . . A 129 LYS HD2 . 25324 1 1453 . 1 1 128 128 LYS HD3 H 1 0.782 0.020 . 1 . . . A 129 LYS HD3 . 25324 1 1454 . 1 1 128 128 LYS HE2 H 1 1.982 0.020 . 2 . . . A 129 LYS HE2 . 25324 1 1455 . 1 1 128 128 LYS HE3 H 1 1.879 0.020 . 2 . . . A 129 LYS HE3 . 25324 1 1456 . 1 1 128 128 LYS C C 13 173.863 0.3 . 1 . . . A 129 LYS C . 25324 1 1457 . 1 1 128 128 LYS CA C 13 55.735 0.3 . 1 . . . A 129 LYS CA . 25324 1 1458 . 1 1 128 128 LYS CB C 13 34.721 0.3 . 1 . . . A 129 LYS CB . 25324 1 1459 . 1 1 128 128 LYS CG C 13 23.591 0.3 . 1 . . . A 129 LYS CG . 25324 1 1460 . 1 1 128 128 LYS CD C 13 28.400 0.3 . 1 . . . A 129 LYS CD . 25324 1 1461 . 1 1 128 128 LYS CE C 13 40.472 0.3 . 1 . . . A 129 LYS CE . 25324 1 1462 . 1 1 128 128 LYS N N 15 131.518 0.3 . 1 . . . A 129 LYS N . 25324 1 1463 . 1 1 129 129 GLY H H 1 9.325 0.020 . 1 . . . A 130 GLY H . 25324 1 1464 . 1 1 129 129 GLY HA2 H 1 5.069 0.020 . 2 . . . A 130 GLY HA2 . 25324 1 1465 . 1 1 129 129 GLY HA3 H 1 2.817 0.020 . 2 . . . A 130 GLY HA3 . 25324 1 1466 . 1 1 129 129 GLY C C 13 171.951 0.3 . 1 . . . A 130 GLY C . 25324 1 1467 . 1 1 129 129 GLY CA C 13 43.787 0.3 . 1 . . . A 130 GLY CA . 25324 1 1468 . 1 1 129 129 GLY N N 15 114.030 0.3 . 1 . . . A 130 GLY N . 25324 1 1469 . 1 1 130 130 THR H H 1 8.916 0.020 . 1 . . . A 131 THR H . 25324 1 1470 . 1 1 130 130 THR HA H 1 4.939 0.020 . 1 . . . A 131 THR HA . 25324 1 1471 . 1 1 130 130 THR HB H 1 3.943 0.020 . 1 . . . A 131 THR HB . 25324 1 1472 . 1 1 130 130 THR HG21 H 1 1.204 0.020 . 1 . . . A 131 THR HG21 . 25324 1 1473 . 1 1 130 130 THR HG22 H 1 1.204 0.020 . 1 . . . A 131 THR HG22 . 25324 1 1474 . 1 1 130 130 THR HG23 H 1 1.204 0.020 . 1 . . . A 131 THR HG23 . 25324 1 1475 . 1 1 130 130 THR C C 13 173.118 0.3 . 1 . . . A 131 THR C . 25324 1 1476 . 1 1 130 130 THR CA C 13 61.266 0.3 . 1 . . . A 131 THR CA . 25324 1 1477 . 1 1 130 130 THR CB C 13 70.392 0.3 . 1 . . . A 131 THR CB . 25324 1 1478 . 1 1 130 130 THR CG2 C 13 21.081 0.3 . 1 . . . A 131 THR CG2 . 25324 1 1479 . 1 1 130 130 THR N N 15 120.583 0.3 . 1 . . . A 131 THR N . 25324 1 1480 . 1 1 131 131 LEU H H 1 8.527 0.020 . 1 . . . A 132 LEU H . 25324 1 1481 . 1 1 131 131 LEU HA H 1 3.500 0.020 . 1 . . . A 132 LEU HA . 25324 1 1482 . 1 1 131 131 LEU HB2 H 1 1.593 0.020 . 2 . . . A 132 LEU HB2 . 25324 1 1483 . 1 1 131 131 LEU HB3 H 1 1.439 0.020 . 2 . . . A 132 LEU HB3 . 25324 1 1484 . 1 1 131 131 LEU HG H 1 1.482 0.020 . 1 . . . A 132 LEU HG . 25324 1 1485 . 1 1 131 131 LEU HD11 H 1 0.533 0.020 . 2 . . . A 132 LEU HD11 . 25324 1 1486 . 1 1 131 131 LEU HD12 H 1 0.533 0.020 . 2 . . . A 132 LEU HD12 . 25324 1 1487 . 1 1 131 131 LEU HD13 H 1 0.533 0.020 . 2 . . . A 132 LEU HD13 . 25324 1 1488 . 1 1 131 131 LEU HD21 H 1 0.526 0.020 . 2 . . . A 132 LEU HD21 . 25324 1 1489 . 1 1 131 131 LEU HD22 H 1 0.526 0.020 . 2 . . . A 132 LEU HD22 . 25324 1 1490 . 1 1 131 131 LEU HD23 H 1 0.526 0.020 . 2 . . . A 132 LEU HD23 . 25324 1 1491 . 1 1 131 131 LEU C C 13 176.574 0.3 . 1 . . . A 132 LEU C . 25324 1 1492 . 1 1 131 131 LEU CA C 13 56.187 0.3 . 1 . . . A 132 LEU CA . 25324 1 1493 . 1 1 131 131 LEU CB C 13 42.447 0.3 . 1 . . . A 132 LEU CB . 25324 1 1494 . 1 1 131 131 LEU CG C 13 26.005 0.3 . 1 . . . A 132 LEU CG . 25324 1 1495 . 1 1 131 131 LEU CD1 C 13 24.891 0.3 . 1 . . . A 132 LEU CD1 . 25324 1 1496 . 1 1 131 131 LEU CD2 C 13 24.432 0.3 . 1 . . . A 132 LEU CD2 . 25324 1 1497 . 1 1 131 131 LEU N N 15 130.774 0.3 . 1 . . . A 132 LEU N . 25324 1 1498 . 1 1 132 132 THR H H 1 8.050 0.020 . 1 . . . A 133 THR H . 25324 1 1499 . 1 1 132 132 THR HA H 1 4.140 0.020 . 1 . . . A 133 THR HA . 25324 1 1500 . 1 1 132 132 THR HB H 1 3.943 0.020 . 1 . . . A 133 THR HB . 25324 1 1501 . 1 1 132 132 THR HG21 H 1 1.052 0.020 . 1 . . . A 133 THR HG21 . 25324 1 1502 . 1 1 132 132 THR HG22 H 1 1.052 0.020 . 1 . . . A 133 THR HG22 . 25324 1 1503 . 1 1 132 132 THR HG23 H 1 1.052 0.020 . 1 . . . A 133 THR HG23 . 25324 1 1504 . 1 1 132 132 THR CA C 13 62.331 0.3 . 1 . . . A 133 THR CA . 25324 1 1505 . 1 1 132 132 THR CB C 13 70.389 0.3 . 1 . . . A 133 THR CB . 25324 1 1506 . 1 1 132 132 THR CG2 C 13 21.216 0.3 . 1 . . . A 133 THR CG2 . 25324 1 1507 . 1 1 132 132 THR N N 15 124.582 0.3 . 1 . . . A 133 THR N . 25324 1 stop_ save_