data_34994 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34994 _Entry.Title ; Solution NMR structure of SNX9 SH3 in complex with EspF ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2025-05-08 _Entry.Accession_date 2025-05-08 _Entry.Last_release_date 2025-08-20 _Entry.Original_release_date 2025-08-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 H. Tossavainen H. . . . 34994 2 P. Permi P. . . . 34994 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'CELL INVASION' . 34994 complex . 34994 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34994 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 487 34994 '15N chemical shifts' 125 34994 '1H chemical shifts' 761 34994 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 . . 2025-10-31 . original BMRB . 34994 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 9R4W 'BMRB Entry Tracking System' 34994 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34994 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 41075884 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Intrinsically disordered EPEC EspF exploits motif mimicry in high-affinity binding to N-WASP GBD and SNX9 SH3 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Int. J. Biol. Macromol.' _Citation.Journal_name_full 'International journal of biological macromolecules' _Citation.Journal_volume 330 _Citation.Journal_issue 'Pt 3' _Citation.Journal_ASTM . _Citation.Journal_ISSN 1879-0003 _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 148227 _Citation.Page_last 148227 _Citation.Year 2025 _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 H. Tossavainen H. . . . 34994 1 2 M. Karjalainen M. . . . 34994 1 3 L. Antenucci L. . . . 34994 1 4 M. Hellman M. . . . 34994 1 5 P. Permi P. . . . 34994 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34994 _Assembly.ID 1 _Assembly.Name 'LEE-encoded effector EspF, Sorting nexin-9' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A B yes . . . . . . 34994 1 2 unit_2 2 $entity_2 B A yes . . . . . . 34994 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34994 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GTVNFKPTRPAPPPPTSGQA SGASRPLPPIAQALKDHLAA YELSKASE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 48 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4929.542 _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 1 114 GLY . 34994 1 2 115 THR . 34994 1 3 116 VAL . 34994 1 4 117 ASN . 34994 1 5 118 PHE . 34994 1 6 119 LYS . 34994 1 7 120 PRO . 34994 1 8 121 THR . 34994 1 9 122 ARG . 34994 1 10 123 PRO . 34994 1 11 124 ALA . 34994 1 12 125 PRO . 34994 1 13 126 PRO . 34994 1 14 127 PRO . 34994 1 15 128 PRO . 34994 1 16 129 THR . 34994 1 17 130 SER . 34994 1 18 131 GLY . 34994 1 19 132 GLN . 34994 1 20 133 ALA . 34994 1 21 134 SER . 34994 1 22 135 GLY . 34994 1 23 136 ALA . 34994 1 24 137 SER . 34994 1 25 138 ARG . 34994 1 26 139 PRO . 34994 1 27 140 LEU . 34994 1 28 141 PRO . 34994 1 29 142 PRO . 34994 1 30 143 ILE . 34994 1 31 144 ALA . 34994 1 32 145 GLN . 34994 1 33 146 ALA . 34994 1 34 147 LEU . 34994 1 35 148 LYS . 34994 1 36 149 ASP . 34994 1 37 150 HIS . 34994 1 38 151 LEU . 34994 1 39 152 ALA . 34994 1 40 153 ALA . 34994 1 41 154 TYR . 34994 1 42 155 GLU . 34994 1 43 156 LEU . 34994 1 44 157 SER . 34994 1 45 158 LYS . 34994 1 46 159 ALA . 34994 1 47 160 SER . 34994 1 48 161 GLU . 34994 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 34994 1 . THR 2 2 34994 1 . VAL 3 3 34994 1 . ASN 4 4 34994 1 . PHE 5 5 34994 1 . LYS 6 6 34994 1 . PRO 7 7 34994 1 . THR 8 8 34994 1 . ARG 9 9 34994 1 . PRO 10 10 34994 1 . ALA 11 11 34994 1 . PRO 12 12 34994 1 . PRO 13 13 34994 1 . PRO 14 14 34994 1 . PRO 15 15 34994 1 . THR 16 16 34994 1 . SER 17 17 34994 1 . GLY 18 18 34994 1 . GLN 19 19 34994 1 . ALA 20 20 34994 1 . SER 21 21 34994 1 . GLY 22 22 34994 1 . ALA 23 23 34994 1 . SER 24 24 34994 1 . ARG 25 25 34994 1 . PRO 26 26 34994 1 . LEU 27 27 34994 1 . PRO 28 28 34994 1 . PRO 29 29 34994 1 . ILE 30 30 34994 1 . ALA 31 31 34994 1 . GLN 32 32 34994 1 . ALA 33 33 34994 1 . LEU 34 34 34994 1 . LYS 35 35 34994 1 . ASP 36 36 34994 1 . HIS 37 37 34994 1 . LEU 38 38 34994 1 . ALA 39 39 34994 1 . ALA 40 40 34994 1 . TYR 41 41 34994 1 . GLU 42 42 34994 1 . LEU 43 43 34994 1 . SER 44 44 34994 1 . LYS 45 45 34994 1 . ALA 46 46 34994 1 . SER 47 47 34994 1 . GLU 48 48 34994 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34994 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMATKARVMYDFAAEPGN NELTVNEGEIITITNPDVGG GWLEGRNIKGERGLVPTDYV EILPSDG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 67 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 7179.922 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Protein SDP1' common 34994 2 'SH3 and PX domain-containing protein 1' common 34994 2 'SH3 and PX domain-containing protein 3A' common 34994 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -2 GLY . 34994 2 2 -1 SER . 34994 2 3 0 HIS . 34994 2 4 1 MET . 34994 2 5 2 ALA . 34994 2 6 3 THR . 34994 2 7 4 LYS . 34994 2 8 5 ALA . 34994 2 9 6 ARG . 34994 2 10 7 VAL . 34994 2 11 8 MET . 34994 2 12 9 TYR . 34994 2 13 10 ASP . 34994 2 14 11 PHE . 34994 2 15 12 ALA . 34994 2 16 13 ALA . 34994 2 17 14 GLU . 34994 2 18 15 PRO . 34994 2 19 16 GLY . 34994 2 20 17 ASN . 34994 2 21 18 ASN . 34994 2 22 19 GLU . 34994 2 23 20 LEU . 34994 2 24 21 THR . 34994 2 25 22 VAL . 34994 2 26 23 ASN . 34994 2 27 24 GLU . 34994 2 28 25 GLY . 34994 2 29 26 GLU . 34994 2 30 27 ILE . 34994 2 31 28 ILE . 34994 2 32 29 THR . 34994 2 33 30 ILE . 34994 2 34 31 THR . 34994 2 35 32 ASN . 34994 2 36 33 PRO . 34994 2 37 34 ASP . 34994 2 38 35 VAL . 34994 2 39 36 GLY . 34994 2 40 37 GLY . 34994 2 41 38 GLY . 34994 2 42 39 TRP . 34994 2 43 40 LEU . 34994 2 44 41 GLU . 34994 2 45 42 GLY . 34994 2 46 43 ARG . 34994 2 47 44 ASN . 34994 2 48 45 ILE . 34994 2 49 46 LYS . 34994 2 50 47 GLY . 34994 2 51 48 GLU . 34994 2 52 49 ARG . 34994 2 53 50 GLY . 34994 2 54 51 LEU . 34994 2 55 52 VAL . 34994 2 56 53 PRO . 34994 2 57 54 THR . 34994 2 58 55 ASP . 34994 2 59 56 TYR . 34994 2 60 57 VAL . 34994 2 61 58 GLU . 34994 2 62 59 ILE . 34994 2 63 60 LEU . 34994 2 64 61 PRO . 34994 2 65 62 SER . 34994 2 66 63 ASP . 34994 2 67 64 GLY . 34994 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 34994 2 . SER 2 2 34994 2 . HIS 3 3 34994 2 . MET 4 4 34994 2 . ALA 5 5 34994 2 . THR 6 6 34994 2 . LYS 7 7 34994 2 . ALA 8 8 34994 2 . ARG 9 9 34994 2 . VAL 10 10 34994 2 . MET 11 11 34994 2 . TYR 12 12 34994 2 . ASP 13 13 34994 2 . PHE 14 14 34994 2 . ALA 15 15 34994 2 . ALA 16 16 34994 2 . GLU 17 17 34994 2 . PRO 18 18 34994 2 . GLY 19 19 34994 2 . ASN 20 20 34994 2 . ASN 21 21 34994 2 . GLU 22 22 34994 2 . LEU 23 23 34994 2 . THR 24 24 34994 2 . VAL 25 25 34994 2 . ASN 26 26 34994 2 . GLU 27 27 34994 2 . GLY 28 28 34994 2 . GLU 29 29 34994 2 . ILE 30 30 34994 2 . ILE 31 31 34994 2 . THR 32 32 34994 2 . ILE 33 33 34994 2 . THR 34 34 34994 2 . ASN 35 35 34994 2 . PRO 36 36 34994 2 . ASP 37 37 34994 2 . VAL 38 38 34994 2 . GLY 39 39 34994 2 . GLY 40 40 34994 2 . GLY 41 41 34994 2 . TRP 42 42 34994 2 . LEU 43 43 34994 2 . GLU 44 44 34994 2 . GLY 45 45 34994 2 . ARG 46 46 34994 2 . ASN 47 47 34994 2 . ILE 48 48 34994 2 . LYS 49 49 34994 2 . GLY 50 50 34994 2 . GLU 51 51 34994 2 . ARG 52 52 34994 2 . GLY 53 53 34994 2 . LEU 54 54 34994 2 . VAL 55 55 34994 2 . PRO 56 56 34994 2 . THR 57 57 34994 2 . ASP 58 58 34994 2 . TYR 59 59 34994 2 . VAL 60 60 34994 2 . GLU 61 61 34994 2 . ILE 62 62 34994 2 . LEU 63 63 34994 2 . PRO 64 64 34994 2 . SER 65 65 34994 2 . ASP 66 66 34994 2 . GLY 67 67 34994 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34994 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . 'espF, NCTC8621_00139' . 34994 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'SNX9, SH3PX1, SH3PXD3A' . 34994 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 34994 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34994 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34994 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34994 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.3 mM [U-13C; U-15N] SNX9 SH3, 1.5 mM EspF, 20 mM sodium phosphate, 50 mM sodium chloride, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'SNX9 SH3' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.3 . . mM . . . . 34994 1 2 EspF 'natural abundance' . . 2 $entity_2 . . 1.5 . . mM . . . . 34994 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34994 1 4 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 34994 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34994 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.9 mM SNX9 SH3, 1.5 mM [U-13C; U-15N] EspF, 20 mM sodium phosphate, 50 mM sodium chloride, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'SNX9 SH3' 'natural abundance' . . 1 $entity_1 . . 1.9 . . mM . . . . 34994 2 2 EspF '[U-13C; U-15N]' . . 2 $entity_2 . . 1.5 . . mM . . . . 34994 2 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 34994 2 4 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 34994 2 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 34994 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 34994 1 pH 6.5 . pH 34994 1 pressure 1 . atm 34994 1 temperature 298 . K 34994 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34994 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34994 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 34994 1 processing . 34994 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34994 _Software.ID 2 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 34994 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 34994 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34994 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34994 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34994 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34994 _Software.ID 4 _Software.Type . _Software.Name Amber _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 34994 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34994 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34994 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34994 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III HD' . 800 . . . 34994 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 34994 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 5 '3D HN(COCA)CB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 6 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 7 '3D iHNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 8 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 9 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 11 '3D HCCH-COSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 12 '3D HCCmHm-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 13 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 14 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 15 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 16 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 17 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 18 '2D 1H-15N HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 19 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 20 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 21 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 22 '3D HN(COCA)CB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 23 '3D HNCO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 24 '3D iHNCO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 25 '3D H(CCO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 26 '3D C(CO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 27 '3D HBHA(CO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 28 '3D HCCH-COSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 29 '3D HCCmHm-TOCSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 30 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 31 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 32 '3D 1H-15N NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 33 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 34 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34994 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34994 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 34994 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34994 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 34994 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34994 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 34994 1 2 '2D 1H-13C HSQC aliphatic' . . . 34994 1 3 '2D 1H-13C HSQC aromatic' . . . 34994 1 4 '3D HNCACB' . . . 34994 1 5 '3D HN(COCA)CB' . . . 34994 1 6 '3D HNCO' . . . 34994 1 7 '3D iHNCO' . . . 34994 1 8 '3D H(CCO)NH' . . . 34994 1 9 '3D C(CO)NH' . . . 34994 1 10 '3D HBHA(CO)NH' . . . 34994 1 11 '3D HCCH-COSY' . . . 34994 1 12 '3D HCCmHm-TOCSY' . . . 34994 1 13 '2D (HB)CB(CGCD)HD' . . . 34994 1 14 '2D (HB)CB(CGCDCE)HE' . . . 34994 1 15 '3D 1H-15N NOESY' . . . 34994 1 16 '3D 1H-13C NOESY aliphatic' . . . 34994 1 17 '3D 1H-13C NOESY aromatic' . . . 34994 1 18 '2D 1H-15N HSQC' . . . 34994 1 19 '2D 1H-13C HSQC aliphatic' . . . 34994 1 20 '2D 1H-13C HSQC aromatic' . . . 34994 1 21 '3D HNCACB' . . . 34994 1 22 '3D HN(COCA)CB' . . . 34994 1 23 '3D HNCO' . . . 34994 1 24 '3D iHNCO' . . . 34994 1 25 '3D H(CCO)NH' . . . 34994 1 26 '3D C(CO)NH' . . . 34994 1 27 '3D HBHA(CO)NH' . . . 34994 1 28 '3D HCCH-COSY' . . . 34994 1 29 '3D HCCmHm-TOCSY' . . . 34994 1 30 '2D (HB)CB(CGCD)HD' . . . 34994 1 31 '2D (HB)CB(CGCDCE)HE' . . . 34994 1 32 '3D 1H-15N NOESY' . . . 34994 1 33 '3D 1H-13C NOESY aliphatic' . . . 34994 1 34 '3D 1H-13C NOESY aromatic' . . . 34994 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY HA2 H 1 3.866 0.02 . 1 . . . . B 114 GLY HA2 . 34994 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.866 0.02 . 1 . . . . B 114 GLY HA3 . 34994 1 3 . 1 . 1 1 1 GLY CA C 13 43.582 0.2 . 1 . . . . B 114 GLY CA . 34994 1 4 . 1 . 1 2 2 THR HA H 1 4.34 0.02 . 1 . . . . B 115 THR HA . 34994 1 5 . 1 . 1 2 2 THR HB H 1 4.1 0.02 . 1 . . . . B 115 THR HB . 34994 1 6 . 1 . 1 2 2 THR HG21 H 1 1.13 0.02 . 1 . . . . B 115 THR HG21 . 34994 1 7 . 1 . 1 2 2 THR HG22 H 1 1.13 0.02 . 1 . . . . B 115 THR HG22 . 34994 1 8 . 1 . 1 2 2 THR HG23 H 1 1.13 0.02 . 1 . . . . B 115 THR HG23 . 34994 1 9 . 1 . 1 2 2 THR C C 13 174.38 0.2 . 1 . . . . B 115 THR C . 34994 1 10 . 1 . 1 2 2 THR CA C 13 62.05 0.2 . 1 . . . . B 115 THR CA . 34994 1 11 . 1 . 1 2 2 THR CB C 13 69.95 0.2 . 1 . . . . B 115 THR CB . 34994 1 12 . 1 . 1 2 2 THR CG2 C 13 21.66 0.2 . 1 . . . . B 115 THR CG2 . 34994 1 13 . 1 . 1 2 2 THR N N 15 114.9 0.2 . 1 . . . . B 115 THR N . 34994 1 14 . 1 . 1 3 3 VAL H H 1 8.26 0.02 . 1 . . . . B 116 VAL H . 34994 1 15 . 1 . 1 3 3 VAL HA H 1 4.06 0.02 . 1 . . . . B 116 VAL HA . 34994 1 16 . 1 . 1 3 3 VAL HB H 1 1.94 0.02 . 1 . . . . B 116 VAL HB . 34994 1 17 . 1 . 1 3 3 VAL HG11 H 1 0.85 0.02 . 2 . . . . B 116 VAL HG11 . 34994 1 18 . 1 . 1 3 3 VAL HG12 H 1 0.85 0.02 . 2 . . . . B 116 VAL HG12 . 34994 1 19 . 1 . 1 3 3 VAL HG13 H 1 0.85 0.02 . 2 . . . . B 116 VAL HG13 . 34994 1 20 . 1 . 1 3 3 VAL HG21 H 1 0.8 0.02 . 2 . . . . B 116 VAL HG21 . 34994 1 21 . 1 . 1 3 3 VAL HG22 H 1 0.8 0.02 . 2 . . . . B 116 VAL HG22 . 34994 1 22 . 1 . 1 3 3 VAL HG23 H 1 0.8 0.02 . 2 . . . . B 116 VAL HG23 . 34994 1 23 . 1 . 1 3 3 VAL C C 13 175.38 0.2 . 1 . . . . B 116 VAL C . 34994 1 24 . 1 . 1 3 3 VAL CA C 13 62.12 0.2 . 1 . . . . B 116 VAL CA . 34994 1 25 . 1 . 1 3 3 VAL CB C 13 32.83 0.2 . 1 . . . . B 116 VAL CB . 34994 1 26 . 1 . 1 3 3 VAL CG1 C 13 20.5 0.2 . 2 . . . . B 116 VAL CG1 . 34994 1 27 . 1 . 1 3 3 VAL CG2 C 13 21.15 0.2 . 2 . . . . B 116 VAL CG2 . 34994 1 28 . 1 . 1 3 3 VAL N N 15 122.99 0.2 . 1 . . . . B 116 VAL N . 34994 1 29 . 1 . 1 4 4 ASN H H 1 8.39 0.02 . 1 . . . . B 117 ASN H . 34994 1 30 . 1 . 1 4 4 ASN HA H 1 4.64 0.02 . 1 . . . . B 117 ASN HA . 34994 1 31 . 1 . 1 4 4 ASN HB2 H 1 2.62 0.02 . 2 . . . . B 117 ASN HB2 . 34994 1 32 . 1 . 1 4 4 ASN HB3 H 1 2.52 0.02 . 2 . . . . B 117 ASN HB3 . 34994 1 33 . 1 . 1 4 4 ASN HD21 H 1 6.88 0.02 . 1 . . . . B 117 ASN HD21 . 34994 1 34 . 1 . 1 4 4 ASN HD22 H 1 7.66 0.02 . 1 . . . . B 117 ASN HD22 . 34994 1 35 . 1 . 1 4 4 ASN C C 13 174.56 0.2 . 1 . . . . B 117 ASN C . 34994 1 36 . 1 . 1 4 4 ASN CA C 13 53.14 0.2 . 1 . . . . B 117 ASN CA . 34994 1 37 . 1 . 1 4 4 ASN CB C 13 39.73 0.2 . 1 . . . . B 117 ASN CB . 34994 1 38 . 1 . 1 4 4 ASN N N 15 122.6 0.2 . 1 . . . . B 117 ASN N . 34994 1 39 . 1 . 1 4 4 ASN ND2 N 15 113.45 0.2 . 1 . . . . B 117 ASN ND2 . 34994 1 40 . 1 . 1 5 5 PHE H H 1 8.34 0.02 . 1 . . . . B 118 PHE H . 34994 1 41 . 1 . 1 5 5 PHE HA H 1 4.59 0.02 . 1 . . . . B 118 PHE HA . 34994 1 42 . 1 . 1 5 5 PHE HB2 H 1 2.97 0.02 . 2 . . . . B 118 PHE HB2 . 34994 1 43 . 1 . 1 5 5 PHE HB3 H 1 2.84 0.02 . 2 . . . . B 118 PHE HB3 . 34994 1 44 . 1 . 1 5 5 PHE HD1 H 1 7.13 0.02 . 1 . . . . B 118 PHE HD1 . 34994 1 45 . 1 . 1 5 5 PHE HD2 H 1 7.13 0.02 . 1 . . . . B 118 PHE HD2 . 34994 1 46 . 1 . 1 5 5 PHE HE1 H 1 7.17 0.02 . 1 . . . . B 118 PHE HE1 . 34994 1 47 . 1 . 1 5 5 PHE HE2 H 1 7.17 0.02 . 1 . . . . B 118 PHE HE2 . 34994 1 48 . 1 . 1 5 5 PHE HZ H 1 7.17 0.02 . 1 . . . . B 118 PHE HZ . 34994 1 49 . 1 . 1 5 5 PHE C C 13 174.56 0.2 . 1 . . . . B 118 PHE C . 34994 1 50 . 1 . 1 5 5 PHE CA C 13 57.18 0.2 . 1 . . . . B 118 PHE CA . 34994 1 51 . 1 . 1 5 5 PHE CB C 13 39.69 0.2 . 1 . . . . B 118 PHE CB . 34994 1 52 . 1 . 1 5 5 PHE CD1 C 13 131.47 0.2 . 1 . . . . B 118 PHE CD1 . 34994 1 53 . 1 . 1 5 5 PHE CD2 C 13 131.47 0.2 . 1 . . . . B 118 PHE CD2 . 34994 1 54 . 1 . 1 5 5 PHE CE1 C 13 131.23 0.2 . 1 . . . . B 118 PHE CE1 . 34994 1 55 . 1 . 1 5 5 PHE CE2 C 13 131.23 0.2 . 1 . . . . B 118 PHE CE2 . 34994 1 56 . 1 . 1 5 5 PHE CZ C 13 133.49 0.2 . 1 . . . . B 118 PHE CZ . 34994 1 57 . 1 . 1 5 5 PHE N N 15 121.17 0.2 . 1 . . . . B 118 PHE N . 34994 1 58 . 1 . 1 6 6 LYS H H 1 8.15 0.02 . 1 . . . . B 119 LYS H . 34994 1 59 . 1 . 1 6 6 LYS HA H 1 4.65 0.02 . 1 . . . . B 119 LYS HA . 34994 1 60 . 1 . 1 6 6 LYS HB2 H 1 1.71 0.02 . 2 . . . . B 119 LYS HB2 . 34994 1 61 . 1 . 1 6 6 LYS HB3 H 1 1.6 0.02 . 2 . . . . B 119 LYS HB3 . 34994 1 62 . 1 . 1 6 6 LYS HG2 H 1 1.39 0.02 . 2 . . . . B 119 LYS HG2 . 34994 1 63 . 1 . 1 6 6 LYS HG3 H 1 1.35 0.02 . 2 . . . . B 119 LYS HG3 . 34994 1 64 . 1 . 1 6 6 LYS HD2 H 1 1.66 0.02 . 1 . . . . B 119 LYS HD2 . 34994 1 65 . 1 . 1 6 6 LYS HD3 H 1 1.66 0.02 . 1 . . . . B 119 LYS HD3 . 34994 1 66 . 1 . 1 6 6 LYS HE2 H 1 2.97 0.02 . 1 . . . . B 119 LYS HE2 . 34994 1 67 . 1 . 1 6 6 LYS HE3 H 1 2.97 0.02 . 1 . . . . B 119 LYS HE3 . 34994 1 68 . 1 . 1 6 6 LYS C C 13 174.01 0.2 . 1 . . . . B 119 LYS C . 34994 1 69 . 1 . 1 6 6 LYS CA C 13 52.91 0.2 . 1 . . . . B 119 LYS CA . 34994 1 70 . 1 . 1 6 6 LYS CB C 13 33.44 0.2 . 1 . . . . B 119 LYS CB . 34994 1 71 . 1 . 1 6 6 LYS CG C 13 24.41 0.2 . 1 . . . . B 119 LYS CG . 34994 1 72 . 1 . 1 6 6 LYS CD C 13 29.17 0.2 . 1 . . . . B 119 LYS CD . 34994 1 73 . 1 . 1 6 6 LYS N N 15 122.46 0.2 . 1 . . . . B 119 LYS N . 34994 1 74 . 1 . 1 7 7 PRO HA H 1 4.07 0.02 . 1 . . . . B 120 PRO HA . 34994 1 75 . 1 . 1 7 7 PRO HB2 H 1 1.73 0.02 . 2 . . . . B 120 PRO HB2 . 34994 1 76 . 1 . 1 7 7 PRO HB3 H 1 1.55 0.02 . 2 . . . . B 120 PRO HB3 . 34994 1 77 . 1 . 1 7 7 PRO HG2 H 1 2.03 0.02 . 2 . . . . B 120 PRO HG2 . 34994 1 78 . 1 . 1 7 7 PRO HG3 H 1 1.7 0.02 . 2 . . . . B 120 PRO HG3 . 34994 1 79 . 1 . 1 7 7 PRO HD2 H 1 3.56 0.02 . 1 . . . . B 120 PRO HD2 . 34994 1 80 . 1 . 1 7 7 PRO HD3 H 1 3.56 0.02 . 1 . . . . B 120 PRO HD3 . 34994 1 81 . 1 . 1 7 7 PRO C C 13 177.54 0.2 . 1 . . . . B 120 PRO C . 34994 1 82 . 1 . 1 7 7 PRO CA C 13 62.53 0.2 . 1 . . . . B 120 PRO CA . 34994 1 83 . 1 . 1 7 7 PRO CB C 13 32.5 0.2 . 1 . . . . B 120 PRO CB . 34994 1 84 . 1 . 1 7 7 PRO CG C 13 27.8 0.2 . 1 . . . . B 120 PRO CG . 34994 1 85 . 1 . 1 7 7 PRO CD C 13 50.67 0.2 . 1 . . . . B 120 PRO CD . 34994 1 86 . 1 . 1 7 7 PRO N N 15 136.36 0.2 . 1 . . . . B 120 PRO N . 34994 1 87 . 1 . 1 8 8 THR H H 1 8.54 0.02 . 1 . . . . B 121 THR H . 34994 1 88 . 1 . 1 8 8 THR HA H 1 4.24 0.02 . 1 . . . . B 121 THR HA . 34994 1 89 . 1 . 1 8 8 THR HB H 1 4.26 0.02 . 1 . . . . B 121 THR HB . 34994 1 90 . 1 . 1 8 8 THR HG21 H 1 1.16 0.02 . 1 . . . . B 121 THR HG21 . 34994 1 91 . 1 . 1 8 8 THR HG22 H 1 1.16 0.02 . 1 . . . . B 121 THR HG22 . 34994 1 92 . 1 . 1 8 8 THR HG23 H 1 1.16 0.02 . 1 . . . . B 121 THR HG23 . 34994 1 93 . 1 . 1 8 8 THR C C 13 173.7 0.2 . 1 . . . . B 121 THR C . 34994 1 94 . 1 . 1 8 8 THR CA C 13 61.99 0.2 . 1 . . . . B 121 THR CA . 34994 1 95 . 1 . 1 8 8 THR CB C 13 69.77 0.2 . 1 . . . . B 121 THR CB . 34994 1 96 . 1 . 1 8 8 THR CG2 C 13 21.77 0.2 . 1 . . . . B 121 THR CG2 . 34994 1 97 . 1 . 1 8 8 THR N N 15 113.15 0.2 . 1 . . . . B 121 THR N . 34994 1 98 . 1 . 1 9 9 ARG H H 1 7.63 0.02 . 1 . . . . B 122 ARG H . 34994 1 99 . 1 . 1 9 9 ARG HA H 1 5.02 0.02 . 1 . . . . B 122 ARG HA . 34994 1 100 . 1 . 1 9 9 ARG HB2 H 1 1.95 0.02 . 2 . . . . B 122 ARG HB2 . 34994 1 101 . 1 . 1 9 9 ARG HB3 H 1 1.92 0.02 . 2 . . . . B 122 ARG HB3 . 34994 1 102 . 1 . 1 9 9 ARG HG2 H 1 1.77 0.02 . 2 . . . . B 122 ARG HG2 . 34994 1 103 . 1 . 1 9 9 ARG HG3 H 1 1.71 0.02 . 2 . . . . B 122 ARG HG3 . 34994 1 104 . 1 . 1 9 9 ARG HD2 H 1 3.34 0.02 . 2 . . . . B 122 ARG HD2 . 34994 1 105 . 1 . 1 9 9 ARG HD3 H 1 3.05 0.02 . 2 . . . . B 122 ARG HD3 . 34994 1 106 . 1 . 1 9 9 ARG HE H 1 9.61 0.02 . 1 . . . . B 122 ARG HE . 34994 1 107 . 1 . 1 9 9 ARG HH12 H 1 6.91 0.02 . 1 . . . . B 122 ARG HH12 . 34994 1 108 . 1 . 1 9 9 ARG HH21 H 1 6.91 0.02 . 1 . . . . B 122 ARG HH21 . 34994 1 109 . 1 . 1 9 9 ARG C C 13 172.68 0.2 . 1 . . . . B 122 ARG C . 34994 1 110 . 1 . 1 9 9 ARG CA C 13 53.15 0.2 . 1 . . . . B 122 ARG CA . 34994 1 111 . 1 . 1 9 9 ARG CB C 13 29.95 0.2 . 1 . . . . B 122 ARG CB . 34994 1 112 . 1 . 1 9 9 ARG CG C 13 25.42 0.2 . 1 . . . . B 122 ARG CG . 34994 1 113 . 1 . 1 9 9 ARG CD C 13 44.37 0.2 . 1 . . . . B 122 ARG CD . 34994 1 114 . 1 . 1 9 9 ARG N N 15 118.58 0.2 . 1 . . . . B 122 ARG N . 34994 1 115 . 1 . 1 9 9 ARG NE N 15 88.05 0.2 . 1 . . . . B 122 ARG NE . 34994 1 116 . 1 . 1 9 9 ARG NH1 N 15 70.7 0.2 . 1 . . . . B 122 ARG NH1 . 34994 1 117 . 1 . 1 9 9 ARG NH2 N 15 70.7 0.2 . 1 . . . . B 122 ARG NH2 . 34994 1 118 . 1 . 1 10 10 PRO HA H 1 4.8 0.02 . 1 . . . . B 123 PRO HA . 34994 1 119 . 1 . 1 10 10 PRO HB2 H 1 2.36 0.02 . 2 . . . . B 123 PRO HB2 . 34994 1 120 . 1 . 1 10 10 PRO HB3 H 1 1.83 0.02 . 2 . . . . B 123 PRO HB3 . 34994 1 121 . 1 . 1 10 10 PRO HG2 H 1 2.07 0.02 . 2 . . . . B 123 PRO HG2 . 34994 1 122 . 1 . 1 10 10 PRO HG3 H 1 1.99 0.02 . 2 . . . . B 123 PRO HG3 . 34994 1 123 . 1 . 1 10 10 PRO HD2 H 1 3.83 0.02 . 2 . . . . B 123 PRO HD2 . 34994 1 124 . 1 . 1 10 10 PRO HD3 H 1 3.71 0.02 . 2 . . . . B 123 PRO HD3 . 34994 1 125 . 1 . 1 10 10 PRO C C 13 176.37 0.2 . 1 . . . . B 123 PRO C . 34994 1 126 . 1 . 1 10 10 PRO CA C 13 62.11 0.2 . 1 . . . . B 123 PRO CA . 34994 1 127 . 1 . 1 10 10 PRO CB C 13 31.91 0.2 . 1 . . . . B 123 PRO CB . 34994 1 128 . 1 . 1 10 10 PRO CG C 13 27.55 0.2 . 1 . . . . B 123 PRO CG . 34994 1 129 . 1 . 1 10 10 PRO CD C 13 50.57 0.2 . 1 . . . . B 123 PRO CD . 34994 1 130 . 1 . 1 10 10 PRO N N 15 136.35 0.2 . 1 . . . . B 123 PRO N . 34994 1 131 . 1 . 1 11 11 ALA H H 1 8.18 0.02 . 1 . . . . B 124 ALA H . 34994 1 132 . 1 . 1 11 11 ALA HA H 1 3.68 0.02 . 1 . . . . B 124 ALA HA . 34994 1 133 . 1 . 1 11 11 ALA HB1 H 1 0.08 0.02 . 1 . . . . B 124 ALA HB1 . 34994 1 134 . 1 . 1 11 11 ALA HB2 H 1 0.08 0.02 . 1 . . . . B 124 ALA HB2 . 34994 1 135 . 1 . 1 11 11 ALA HB3 H 1 0.08 0.02 . 1 . . . . B 124 ALA HB3 . 34994 1 136 . 1 . 1 11 11 ALA C C 13 175.37 0.2 . 1 . . . . B 124 ALA C . 34994 1 137 . 1 . 1 11 11 ALA CA C 13 50.75 0.2 . 1 . . . . B 124 ALA CA . 34994 1 138 . 1 . 1 11 11 ALA CB C 13 15.84 0.2 . 1 . . . . B 124 ALA CB . 34994 1 139 . 1 . 1 11 11 ALA N N 15 126.73 0.2 . 1 . . . . B 124 ALA N . 34994 1 140 . 1 . 1 12 12 PRO HA H 1 4.71 0.02 . 1 . . . . B 125 PRO HA . 34994 1 141 . 1 . 1 12 12 PRO HB2 H 1 2.32 0.02 . 2 . . . . B 125 PRO HB2 . 34994 1 142 . 1 . 1 12 12 PRO HB3 H 1 2.07 0.02 . 2 . . . . B 125 PRO HB3 . 34994 1 143 . 1 . 1 12 12 PRO HG2 H 1 2.21 0.02 . 2 . . . . B 125 PRO HG2 . 34994 1 144 . 1 . 1 12 12 PRO HG3 H 1 1.92 0.02 . 2 . . . . B 125 PRO HG3 . 34994 1 145 . 1 . 1 12 12 PRO HD2 H 1 3.56 0.02 . 2 . . . . B 125 PRO HD2 . 34994 1 146 . 1 . 1 12 12 PRO HD3 H 1 2.83 0.02 . 2 . . . . B 125 PRO HD3 . 34994 1 147 . 1 . 1 12 12 PRO C C 13 173.78 0.2 . 1 . . . . B 125 PRO C . 34994 1 148 . 1 . 1 12 12 PRO CA C 13 60.56 0.2 . 1 . . . . B 125 PRO CA . 34994 1 149 . 1 . 1 12 12 PRO CB C 13 31.1 0.2 . 1 . . . . B 125 PRO CB . 34994 1 150 . 1 . 1 12 12 PRO CG C 13 26.89 0.2 . 1 . . . . B 125 PRO CG . 34994 1 151 . 1 . 1 12 12 PRO CD C 13 50.52 0.2 . 1 . . . . B 125 PRO CD . 34994 1 152 . 1 . 1 12 12 PRO N N 15 136.01 0.2 . 1 . . . . B 125 PRO N . 34994 1 153 . 1 . 1 13 13 PRO HA H 1 4.8 0.02 . 1 . . . . B 126 PRO HA . 34994 1 154 . 1 . 1 13 13 PRO HB2 H 1 2.32 0.02 . 2 . . . . B 126 PRO HB2 . 34994 1 155 . 1 . 1 13 13 PRO HB3 H 1 1.91 0.02 . 2 . . . . B 126 PRO HB3 . 34994 1 156 . 1 . 1 13 13 PRO HG2 H 1 2.05 0.02 . 2 . . . . B 126 PRO HG2 . 34994 1 157 . 1 . 1 13 13 PRO HG3 H 1 1.96 0.02 . 2 . . . . B 126 PRO HG3 . 34994 1 158 . 1 . 1 13 13 PRO HD2 H 1 3.76 0.02 . 2 . . . . B 126 PRO HD2 . 34994 1 159 . 1 . 1 13 13 PRO HD3 H 1 3.64 0.02 . 2 . . . . B 126 PRO HD3 . 34994 1 160 . 1 . 1 13 13 PRO C C 13 176.17 0.2 . 1 . . . . B 126 PRO C . 34994 1 161 . 1 . 1 13 13 PRO CA C 13 61.23 0.2 . 1 . . . . B 126 PRO CA . 34994 1 162 . 1 . 1 13 13 PRO CB C 13 30.42 0.2 . 1 . . . . B 126 PRO CB . 34994 1 163 . 1 . 1 13 13 PRO CG C 13 27 0.2 . 1 . . . . B 126 PRO CG . 34994 1 164 . 1 . 1 13 13 PRO CD C 13 49.94 0.2 . 1 . . . . B 126 PRO CD . 34994 1 165 . 1 . 1 13 13 PRO N N 15 132.52 0.2 . 1 . . . . B 126 PRO N . 34994 1 166 . 1 . 1 14 14 PRO HA H 1 3.85 0.02 . 1 . . . . B 127 PRO HA . 34994 1 167 . 1 . 1 14 14 PRO HB2 H 1 1.34 0.02 . 2 . . . . B 127 PRO HB2 . 34994 1 168 . 1 . 1 14 14 PRO HB3 H 1 1.28 0.02 . 2 . . . . B 127 PRO HB3 . 34994 1 169 . 1 . 1 14 14 PRO HG2 H 1 1.7 0.02 . 2 . . . . B 127 PRO HG2 . 34994 1 170 . 1 . 1 14 14 PRO HG3 H 1 1.94 0.02 . 2 . . . . B 127 PRO HG3 . 34994 1 171 . 1 . 1 14 14 PRO HD2 H 1 3.93 0.02 . 2 . . . . B 127 PRO HD2 . 34994 1 172 . 1 . 1 14 14 PRO HD3 H 1 3.56 0.02 . 2 . . . . B 127 PRO HD3 . 34994 1 173 . 1 . 1 14 14 PRO C C 13 173.52 0.2 . 1 . . . . B 127 PRO C . 34994 1 174 . 1 . 1 14 14 PRO CA C 13 61.49 0.2 . 1 . . . . B 127 PRO CA . 34994 1 175 . 1 . 1 14 14 PRO CB C 13 30.27 0.2 . 1 . . . . B 127 PRO CB . 34994 1 176 . 1 . 1 14 14 PRO CG C 13 27.4 0.2 . 1 . . . . B 127 PRO CG . 34994 1 177 . 1 . 1 14 14 PRO CD C 13 50.51 0.2 . 1 . . . . B 127 PRO CD . 34994 1 178 . 1 . 1 14 14 PRO N N 15 138.52 0.2 . 1 . . . . B 127 PRO N . 34994 1 179 . 1 . 1 15 15 PRO HA H 1 4.41 0.02 . 1 . . . . B 128 PRO HA . 34994 1 180 . 1 . 1 15 15 PRO HB2 H 1 2.14 0.02 . 2 . . . . B 128 PRO HB2 . 34994 1 181 . 1 . 1 15 15 PRO HB3 H 1 1.85 0.02 . 2 . . . . B 128 PRO HB3 . 34994 1 182 . 1 . 1 15 15 PRO HG2 H 1 1.56 0.02 . 2 . . . . B 128 PRO HG2 . 34994 1 183 . 1 . 1 15 15 PRO HG3 H 1 1.94 0.02 . 2 . . . . B 128 PRO HG3 . 34994 1 184 . 1 . 1 15 15 PRO HD2 H 1 2.92 0.02 . 2 . . . . B 128 PRO HD2 . 34994 1 185 . 1 . 1 15 15 PRO HD3 H 1 1.89 0.02 . 2 . . . . B 128 PRO HD3 . 34994 1 186 . 1 . 1 15 15 PRO C C 13 176.49 0.2 . 1 . . . . B 128 PRO C . 34994 1 187 . 1 . 1 15 15 PRO CA C 13 62.82 0.2 . 1 . . . . B 128 PRO CA . 34994 1 188 . 1 . 1 15 15 PRO CB C 13 31.38 0.2 . 1 . . . . B 128 PRO CB . 34994 1 189 . 1 . 1 15 15 PRO CG C 13 27.4 0.2 . 1 . . . . B 128 PRO CG . 34994 1 190 . 1 . 1 15 15 PRO CD C 13 49.12 0.2 . 1 . . . . B 128 PRO CD . 34994 1 191 . 1 . 1 15 15 PRO N N 15 134.9 0.2 . 1 . . . . B 128 PRO N . 34994 1 192 . 1 . 1 16 16 THR H H 1 7.87 0.02 . 1 . . . . B 129 THR H . 34994 1 193 . 1 . 1 16 16 THR HA H 1 4.24 0.02 . 1 . . . . B 129 THR HA . 34994 1 194 . 1 . 1 16 16 THR HB H 1 4.22 0.02 . 1 . . . . B 129 THR HB . 34994 1 195 . 1 . 1 16 16 THR HG21 H 1 1.13 0.02 . 1 . . . . B 129 THR HG21 . 34994 1 196 . 1 . 1 16 16 THR HG22 H 1 1.13 0.02 . 1 . . . . B 129 THR HG22 . 34994 1 197 . 1 . 1 16 16 THR HG23 H 1 1.13 0.02 . 1 . . . . B 129 THR HG23 . 34994 1 198 . 1 . 1 16 16 THR C C 13 174.85 0.2 . 1 . . . . B 129 THR C . 34994 1 199 . 1 . 1 16 16 THR CA C 13 61.52 0.2 . 1 . . . . B 129 THR CA . 34994 1 200 . 1 . 1 16 16 THR CB C 13 69.76 0.2 . 1 . . . . B 129 THR CB . 34994 1 201 . 1 . 1 16 16 THR CG2 C 13 21.66 0.2 . 1 . . . . B 129 THR CG2 . 34994 1 202 . 1 . 1 16 16 THR N N 15 112.77 0.2 . 1 . . . . B 129 THR N . 34994 1 203 . 1 . 1 17 17 SER H H 1 8.22 0.02 . 1 . . . . B 130 SER H . 34994 1 204 . 1 . 1 17 17 SER HA H 1 4.46 0.02 . 1 . . . . B 130 SER HA . 34994 1 205 . 1 . 1 17 17 SER HB2 H 1 3.89 0.02 . 1 . . . . B 130 SER HB2 . 34994 1 206 . 1 . 1 17 17 SER HB3 H 1 3.89 0.02 . 1 . . . . B 130 SER HB3 . 34994 1 207 . 1 . 1 17 17 SER C C 13 175.19 0.2 . 1 . . . . B 130 SER C . 34994 1 208 . 1 . 1 17 17 SER CA C 13 58.54 0.2 . 1 . . . . B 130 SER CA . 34994 1 209 . 1 . 1 17 17 SER CB C 13 63.88 0.2 . 1 . . . . B 130 SER CB . 34994 1 210 . 1 . 1 17 17 SER N N 15 117.48 0.2 . 1 . . . . B 130 SER N . 34994 1 211 . 1 . 1 18 18 GLY H H 1 8.45 0.02 . 1 . . . . B 131 GLY H . 34994 1 212 . 1 . 1 18 18 GLY HA2 H 1 3.97 0.02 . 1 . . . . B 131 GLY HA2 . 34994 1 213 . 1 . 1 18 18 GLY HA3 H 1 3.97 0.02 . 1 . . . . B 131 GLY HA3 . 34994 1 214 . 1 . 1 18 18 GLY C C 13 174.26 0.2 . 1 . . . . B 131 GLY C . 34994 1 215 . 1 . 1 18 18 GLY CA C 13 45.45 0.2 . 1 . . . . B 131 GLY CA . 34994 1 216 . 1 . 1 18 18 GLY N N 15 110.79 0.2 . 1 . . . . B 131 GLY N . 34994 1 217 . 1 . 1 19 19 GLN H H 1 8.23 0.02 . 1 . . . . B 132 GLN H . 34994 1 218 . 1 . 1 19 19 GLN HA H 1 4.33 0.02 . 1 . . . . B 132 GLN HA . 34994 1 219 . 1 . 1 19 19 GLN HB2 H 1 2.11 0.02 . 2 . . . . B 132 GLN HB2 . 34994 1 220 . 1 . 1 19 19 GLN HB3 H 1 1.97 0.02 . 2 . . . . B 132 GLN HB3 . 34994 1 221 . 1 . 1 19 19 GLN HG2 H 1 2.35 0.02 . 1 . . . . B 132 GLN HG2 . 34994 1 222 . 1 . 1 19 19 GLN HG3 H 1 2.35 0.02 . 1 . . . . B 132 GLN HG3 . 34994 1 223 . 1 . 1 19 19 GLN HE21 H 1 7.53 0.02 . 1 . . . . B 132 GLN HE21 . 34994 1 224 . 1 . 1 19 19 GLN HE22 H 1 6.85 0.02 . 1 . . . . B 132 GLN HE22 . 34994 1 225 . 1 . 1 19 19 GLN C C 13 176.02 0.2 . 1 . . . . B 132 GLN C . 34994 1 226 . 1 . 1 19 19 GLN CA C 13 55.9 0.2 . 1 . . . . B 132 GLN CA . 34994 1 227 . 1 . 1 19 19 GLN CB C 13 29.56 0.2 . 1 . . . . B 132 GLN CB . 34994 1 228 . 1 . 1 19 19 GLN CG C 13 33.84 0.2 . 1 . . . . B 132 GLN CG . 34994 1 229 . 1 . 1 19 19 GLN N N 15 119.9 0.2 . 1 . . . . B 132 GLN N . 34994 1 230 . 1 . 1 19 19 GLN NE2 N 15 112.41 0.2 . 1 . . . . B 132 GLN NE2 . 34994 1 231 . 1 . 1 20 20 ALA H H 1 8.43 0.02 . 1 . . . . B 133 ALA H . 34994 1 232 . 1 . 1 20 20 ALA HA H 1 4.35 0.02 . 1 . . . . B 133 ALA HA . 34994 1 233 . 1 . 1 20 20 ALA HB1 H 1 1.41 0.02 . 1 . . . . B 133 ALA HB1 . 34994 1 234 . 1 . 1 20 20 ALA HB2 H 1 1.41 0.02 . 1 . . . . B 133 ALA HB2 . 34994 1 235 . 1 . 1 20 20 ALA HB3 H 1 1.41 0.02 . 1 . . . . B 133 ALA HB3 . 34994 1 236 . 1 . 1 20 20 ALA C C 13 177.92 0.2 . 1 . . . . B 133 ALA C . 34994 1 237 . 1 . 1 20 20 ALA CA C 13 52.69 0.2 . 1 . . . . B 133 ALA CA . 34994 1 238 . 1 . 1 20 20 ALA CB C 13 19.14 0.2 . 1 . . . . B 133 ALA CB . 34994 1 239 . 1 . 1 20 20 ALA N N 15 125.43 0.2 . 1 . . . . B 133 ALA N . 34994 1 240 . 1 . 1 21 21 SER H H 1 8.33 0.02 . 1 . . . . B 134 SER H . 34994 1 241 . 1 . 1 21 21 SER HA H 1 4.43 0.02 . 1 . . . . B 134 SER HA . 34994 1 242 . 1 . 1 21 21 SER HB2 H 1 3.92 0.02 . 2 . . . . B 134 SER HB2 . 34994 1 243 . 1 . 1 21 21 SER HB3 H 1 3.87 0.02 . 2 . . . . B 134 SER HB3 . 34994 1 244 . 1 . 1 21 21 SER C C 13 175.32 0.2 . 1 . . . . B 134 SER C . 34994 1 245 . 1 . 1 21 21 SER CA C 13 58.63 0.2 . 1 . . . . B 134 SER CA . 34994 1 246 . 1 . 1 21 21 SER CB C 13 63.87 0.2 . 1 . . . . B 134 SER CB . 34994 1 247 . 1 . 1 21 21 SER N N 15 115.17 0.2 . 1 . . . . B 134 SER N . 34994 1 248 . 1 . 1 22 22 GLY H H 1 8.42 0.02 . 1 . . . . B 135 GLY H . 34994 1 249 . 1 . 1 22 22 GLY HA2 H 1 3.97 0.02 . 1 . . . . B 135 GLY HA2 . 34994 1 250 . 1 . 1 22 22 GLY HA3 H 1 3.97 0.02 . 1 . . . . B 135 GLY HA3 . 34994 1 251 . 1 . 1 22 22 GLY C C 13 174.01 0.2 . 1 . . . . B 135 GLY C . 34994 1 252 . 1 . 1 22 22 GLY CA C 13 45.45 0.2 . 1 . . . . B 135 GLY CA . 34994 1 253 . 1 . 1 22 22 GLY N N 15 110.98 0.2 . 1 . . . . B 135 GLY N . 34994 1 254 . 1 . 1 23 23 ALA H H 1 8.11 0.02 . 1 . . . . B 136 ALA H . 34994 1 255 . 1 . 1 23 23 ALA HA H 1 4.35 0.02 . 1 . . . . B 136 ALA HA . 34994 1 256 . 1 . 1 23 23 ALA HB1 H 1 1.38 0.02 . 1 . . . . B 136 ALA HB1 . 34994 1 257 . 1 . 1 23 23 ALA HB2 H 1 1.38 0.02 . 1 . . . . B 136 ALA HB2 . 34994 1 258 . 1 . 1 23 23 ALA HB3 H 1 1.38 0.02 . 1 . . . . B 136 ALA HB3 . 34994 1 259 . 1 . 1 23 23 ALA C C 13 177.81 0.2 . 1 . . . . B 136 ALA C . 34994 1 260 . 1 . 1 23 23 ALA CA C 13 52.53 0.2 . 1 . . . . B 136 ALA CA . 34994 1 261 . 1 . 1 23 23 ALA CB C 13 19.38 0.2 . 1 . . . . B 136 ALA CB . 34994 1 262 . 1 . 1 23 23 ALA N N 15 123.58 0.2 . 1 . . . . B 136 ALA N . 34994 1 263 . 1 . 1 24 24 SER H H 1 8.27 0.02 . 1 . . . . B 137 SER H . 34994 1 264 . 1 . 1 24 24 SER HA H 1 4.43 0.02 . 1 . . . . B 137 SER HA . 34994 1 265 . 1 . 1 24 24 SER HB2 H 1 3.85 0.02 . 1 . . . . B 137 SER HB2 . 34994 1 266 . 1 . 1 24 24 SER HB3 H 1 3.85 0.02 . 1 . . . . B 137 SER HB3 . 34994 1 267 . 1 . 1 24 24 SER C C 13 174.13 0.2 . 1 . . . . B 137 SER C . 34994 1 268 . 1 . 1 24 24 SER CA C 13 58.31 0.2 . 1 . . . . B 137 SER CA . 34994 1 269 . 1 . 1 24 24 SER CB C 13 63.8 0.2 . 1 . . . . B 137 SER CB . 34994 1 270 . 1 . 1 24 24 SER N N 15 115.16 0.2 . 1 . . . . B 137 SER N . 34994 1 271 . 1 . 1 25 25 ARG H H 1 8.24 0.02 . 1 . . . . B 138 ARG H . 34994 1 272 . 1 . 1 25 25 ARG HA H 1 4.64 0.02 . 1 . . . . B 138 ARG HA . 34994 1 273 . 1 . 1 25 25 ARG HB2 H 1 1.84 0.02 . 2 . . . . B 138 ARG HB2 . 34994 1 274 . 1 . 1 25 25 ARG HB3 H 1 1.73 0.02 . 2 . . . . B 138 ARG HB3 . 34994 1 275 . 1 . 1 25 25 ARG HG2 H 1 1.66 0.02 . 1 . . . . B 138 ARG HG2 . 34994 1 276 . 1 . 1 25 25 ARG HG3 H 1 1.66 0.02 . 1 . . . . B 138 ARG HG3 . 34994 1 277 . 1 . 1 25 25 ARG HD2 H 1 3.2 0.02 . 1 . . . . B 138 ARG HD2 . 34994 1 278 . 1 . 1 25 25 ARG HD3 H 1 3.2 0.02 . 1 . . . . B 138 ARG HD3 . 34994 1 279 . 1 . 1 25 25 ARG C C 13 173.99 0.2 . 1 . . . . B 138 ARG C . 34994 1 280 . 1 . 1 25 25 ARG CA C 13 53.9 0.2 . 1 . . . . B 138 ARG CA . 34994 1 281 . 1 . 1 25 25 ARG CB C 13 30.34 0.2 . 1 . . . . B 138 ARG CB . 34994 1 282 . 1 . 1 25 25 ARG CG C 13 26.78 0.2 . 1 . . . . B 138 ARG CG . 34994 1 283 . 1 . 1 25 25 ARG CD C 13 43.45 0.2 . 1 . . . . B 138 ARG CD . 34994 1 284 . 1 . 1 25 25 ARG N N 15 123.83 0.2 . 1 . . . . B 138 ARG N . 34994 1 285 . 1 . 1 26 26 PRO HA H 1 4.42 0.02 . 1 . . . . B 139 PRO HA . 34994 1 286 . 1 . 1 26 26 PRO HB2 H 1 2.25 0.02 . 2 . . . . B 139 PRO HB2 . 34994 1 287 . 1 . 1 26 26 PRO HB3 H 1 1.87 0.02 . 2 . . . . B 139 PRO HB3 . 34994 1 288 . 1 . 1 26 26 PRO HG2 H 1 1.99 0.02 . 1 . . . . B 139 PRO HG2 . 34994 1 289 . 1 . 1 26 26 PRO HG3 H 1 1.99 0.02 . 1 . . . . B 139 PRO HG3 . 34994 1 290 . 1 . 1 26 26 PRO HD2 H 1 3.79 0.02 . 2 . . . . B 139 PRO HD2 . 34994 1 291 . 1 . 1 26 26 PRO HD3 H 1 3.6 0.02 . 2 . . . . B 139 PRO HD3 . 34994 1 292 . 1 . 1 26 26 PRO C C 13 176.6 0.2 . 1 . . . . B 139 PRO C . 34994 1 293 . 1 . 1 26 26 PRO CA C 13 62.89 0.2 . 1 . . . . B 139 PRO CA . 34994 1 294 . 1 . 1 26 26 PRO CB C 13 32.03 0.2 . 1 . . . . B 139 PRO CB . 34994 1 295 . 1 . 1 26 26 PRO CG C 13 27.37 0.2 . 1 . . . . B 139 PRO CG . 34994 1 296 . 1 . 1 26 26 PRO CD C 13 50.61 0.2 . 1 . . . . B 139 PRO CD . 34994 1 297 . 1 . 1 26 26 PRO N N 15 136.99 0.2 . 1 . . . . B 139 PRO N . 34994 1 298 . 1 . 1 27 27 LEU H H 1 8.35 0.02 . 1 . . . . B 140 LEU H . 34994 1 299 . 1 . 1 27 27 LEU HA H 1 4.58 0.02 . 1 . . . . B 140 LEU HA . 34994 1 300 . 1 . 1 27 27 LEU HB2 H 1 1.53 0.02 . 2 . . . . B 140 LEU HB2 . 34994 1 301 . 1 . 1 27 27 LEU HB3 H 1 1.57 0.02 . 2 . . . . B 140 LEU HB3 . 34994 1 302 . 1 . 1 27 27 LEU HG H 1 1.72 0.02 . 1 . . . . B 140 LEU HG . 34994 1 303 . 1 . 1 27 27 LEU HD11 H 1 0.94 0.02 . 2 . . . . B 140 LEU HD11 . 34994 1 304 . 1 . 1 27 27 LEU HD12 H 1 0.94 0.02 . 2 . . . . B 140 LEU HD12 . 34994 1 305 . 1 . 1 27 27 LEU HD13 H 1 0.94 0.02 . 2 . . . . B 140 LEU HD13 . 34994 1 306 . 1 . 1 27 27 LEU HD21 H 1 0.91 0.02 . 2 . . . . B 140 LEU HD21 . 34994 1 307 . 1 . 1 27 27 LEU HD22 H 1 0.91 0.02 . 2 . . . . B 140 LEU HD22 . 34994 1 308 . 1 . 1 27 27 LEU HD23 H 1 0.91 0.02 . 2 . . . . B 140 LEU HD23 . 34994 1 309 . 1 . 1 27 27 LEU C C 13 174.99 0.2 . 1 . . . . B 140 LEU C . 34994 1 310 . 1 . 1 27 27 LEU CA C 13 52.99 0.2 . 1 . . . . B 140 LEU CA . 34994 1 311 . 1 . 1 27 27 LEU CB C 13 41.68 0.2 . 1 . . . . B 140 LEU CB . 34994 1 312 . 1 . 1 27 27 LEU CG C 13 27.08 0.2 . 1 . . . . B 140 LEU CG . 34994 1 313 . 1 . 1 27 27 LEU CD1 C 13 25.24 0.2 . 2 . . . . B 140 LEU CD1 . 34994 1 314 . 1 . 1 27 27 LEU CD2 C 13 23.37 0.2 . 2 . . . . B 140 LEU CD2 . 34994 1 315 . 1 . 1 27 27 LEU N N 15 124.07 0.2 . 1 . . . . B 140 LEU N . 34994 1 316 . 1 . 1 28 28 PRO HA H 1 4.68 0.02 . 1 . . . . B 141 PRO HA . 34994 1 317 . 1 . 1 28 28 PRO HB2 H 1 2.35 0.02 . 2 . . . . B 141 PRO HB2 . 34994 1 318 . 1 . 1 28 28 PRO HB3 H 1 1.88 0.02 . 2 . . . . B 141 PRO HB3 . 34994 1 319 . 1 . 1 28 28 PRO HG2 H 1 2.04 0.02 . 1 . . . . B 141 PRO HG2 . 34994 1 320 . 1 . 1 28 28 PRO HG3 H 1 2.04 0.02 . 1 . . . . B 141 PRO HG3 . 34994 1 321 . 1 . 1 28 28 PRO HD2 H 1 3.86 0.02 . 2 . . . . B 141 PRO HD2 . 34994 1 322 . 1 . 1 28 28 PRO HD3 H 1 3.61 0.02 . 2 . . . . B 141 PRO HD3 . 34994 1 323 . 1 . 1 28 28 PRO C C 13 174.72 0.2 . 1 . . . . B 141 PRO C . 34994 1 324 . 1 . 1 28 28 PRO CA C 13 61.51 0.2 . 1 . . . . B 141 PRO CA . 34994 1 325 . 1 . 1 28 28 PRO CB C 13 30.81 0.2 . 1 . . . . B 141 PRO CB . 34994 1 326 . 1 . 1 28 28 PRO CG C 13 27.38 0.2 . 1 . . . . B 141 PRO CG . 34994 1 327 . 1 . 1 28 28 PRO CD C 13 50.47 0.2 . 1 . . . . B 141 PRO CD . 34994 1 328 . 1 . 1 28 28 PRO N N 15 137.31 0.2 . 1 . . . . B 141 PRO N . 34994 1 329 . 1 . 1 29 29 PRO HA H 1 4.43 0.02 . 1 . . . . B 142 PRO HA . 34994 1 330 . 1 . 1 29 29 PRO HB2 H 1 2.28 0.02 . 2 . . . . B 142 PRO HB2 . 34994 1 331 . 1 . 1 29 29 PRO HB3 H 1 1.9 0.02 . 2 . . . . B 142 PRO HB3 . 34994 1 332 . 1 . 1 29 29 PRO HG2 H 1 2.03 0.02 . 1 . . . . B 142 PRO HG2 . 34994 1 333 . 1 . 1 29 29 PRO HG3 H 1 2.03 0.02 . 1 . . . . B 142 PRO HG3 . 34994 1 334 . 1 . 1 29 29 PRO HD2 H 1 3.8 0.02 . 2 . . . . B 142 PRO HD2 . 34994 1 335 . 1 . 1 29 29 PRO HD3 H 1 3.64 0.02 . 2 . . . . B 142 PRO HD3 . 34994 1 336 . 1 . 1 29 29 PRO C C 13 177.21 0.2 . 1 . . . . B 142 PRO C . 34994 1 337 . 1 . 1 29 29 PRO CA C 13 63.1 0.2 . 1 . . . . B 142 PRO CA . 34994 1 338 . 1 . 1 29 29 PRO CB C 13 31.96 0.2 . 1 . . . . B 142 PRO CB . 34994 1 339 . 1 . 1 29 29 PRO CG C 13 27.37 0.2 . 1 . . . . B 142 PRO CG . 34994 1 340 . 1 . 1 29 29 PRO CD C 13 50.39 0.2 . 1 . . . . B 142 PRO CD . 34994 1 341 . 1 . 1 29 29 PRO N N 15 135.02 0.2 . 1 . . . . B 142 PRO N . 34994 1 342 . 1 . 1 30 30 ILE H H 1 8.16 0.02 . 1 . . . . B 143 ILE H . 34994 1 343 . 1 . 1 30 30 ILE HA H 1 4.09 0.02 . 1 . . . . B 143 ILE HA . 34994 1 344 . 1 . 1 30 30 ILE HB H 1 1.83 0.02 . 1 . . . . B 143 ILE HB . 34994 1 345 . 1 . 1 30 30 ILE HG12 H 1 1.48 0.02 . 2 . . . . B 143 ILE HG12 . 34994 1 346 . 1 . 1 30 30 ILE HG13 H 1 1.19 0.02 . 2 . . . . B 143 ILE HG13 . 34994 1 347 . 1 . 1 30 30 ILE HG21 H 1 0.91 0.02 . 1 . . . . B 143 ILE HG21 . 34994 1 348 . 1 . 1 30 30 ILE HG22 H 1 0.91 0.02 . 1 . . . . B 143 ILE HG22 . 34994 1 349 . 1 . 1 30 30 ILE HG23 H 1 0.91 0.02 . 1 . . . . B 143 ILE HG23 . 34994 1 350 . 1 . 1 30 30 ILE HD11 H 1 0.86 0.02 . 1 . . . . B 143 ILE HD11 . 34994 1 351 . 1 . 1 30 30 ILE HD12 H 1 0.86 0.02 . 1 . . . . B 143 ILE HD12 . 34994 1 352 . 1 . 1 30 30 ILE HD13 H 1 0.86 0.02 . 1 . . . . B 143 ILE HD13 . 34994 1 353 . 1 . 1 30 30 ILE C C 13 176.2 0.2 . 1 . . . . B 143 ILE C . 34994 1 354 . 1 . 1 30 30 ILE CA C 13 61.48 0.2 . 1 . . . . B 143 ILE CA . 34994 1 355 . 1 . 1 30 30 ILE CB C 13 38.82 0.2 . 1 . . . . B 143 ILE CB . 34994 1 356 . 1 . 1 30 30 ILE CG1 C 13 27.33 0.2 . 1 . . . . B 143 ILE CG1 . 34994 1 357 . 1 . 1 30 30 ILE CG2 C 13 17.51 0.2 . 1 . . . . B 143 ILE CG2 . 34994 1 358 . 1 . 1 30 30 ILE CD1 C 13 13.09 0.2 . 1 . . . . B 143 ILE CD1 . 34994 1 359 . 1 . 1 30 30 ILE N N 15 120.55 0.2 . 1 . . . . B 143 ILE N . 34994 1 360 . 1 . 1 31 31 ALA H H 1 8.26 0.02 . 1 . . . . B 144 ALA H . 34994 1 361 . 1 . 1 31 31 ALA HA H 1 4.27 0.02 . 1 . . . . B 144 ALA HA . 34994 1 362 . 1 . 1 31 31 ALA HB1 H 1 1.38 0.02 . 1 . . . . B 144 ALA HB1 . 34994 1 363 . 1 . 1 31 31 ALA HB2 H 1 1.38 0.02 . 1 . . . . B 144 ALA HB2 . 34994 1 364 . 1 . 1 31 31 ALA HB3 H 1 1.38 0.02 . 1 . . . . B 144 ALA HB3 . 34994 1 365 . 1 . 1 31 31 ALA C C 13 178.12 0.2 . 1 . . . . B 144 ALA C . 34994 1 366 . 1 . 1 31 31 ALA CA C 13 52.87 0.2 . 1 . . . . B 144 ALA CA . 34994 1 367 . 1 . 1 31 31 ALA CB C 13 19.14 0.2 . 1 . . . . B 144 ALA CB . 34994 1 368 . 1 . 1 31 31 ALA N N 15 127.08 0.2 . 1 . . . . B 144 ALA N . 34994 1 369 . 1 . 1 32 32 GLN H H 1 8.28 0.02 . 1 . . . . B 145 GLN H . 34994 1 370 . 1 . 1 32 32 GLN HA H 1 4.17 0.02 . 1 . . . . B 145 GLN HA . 34994 1 371 . 1 . 1 32 32 GLN HB2 H 1 2.06 0.02 . 2 . . . . B 145 GLN HB2 . 34994 1 372 . 1 . 1 32 32 GLN HB3 H 1 2 0.02 . 2 . . . . B 145 GLN HB3 . 34994 1 373 . 1 . 1 32 32 GLN HG2 H 1 2.36 0.02 . 1 . . . . B 145 GLN HG2 . 34994 1 374 . 1 . 1 32 32 GLN HG3 H 1 2.36 0.02 . 1 . . . . B 145 GLN HG3 . 34994 1 375 . 1 . 1 32 32 GLN HE21 H 1 6.87 0.02 . 1 . . . . B 145 GLN HE21 . 34994 1 376 . 1 . 1 32 32 GLN HE22 H 1 7.63 0.02 . 1 . . . . B 145 GLN HE22 . 34994 1 377 . 1 . 1 32 32 GLN C C 13 176 0.2 . 1 . . . . B 145 GLN C . 34994 1 378 . 1 . 1 32 32 GLN CA C 13 56.49 0.2 . 1 . . . . B 145 GLN CA . 34994 1 379 . 1 . 1 32 32 GLN CB C 13 29.41 0.2 . 1 . . . . B 145 GLN CB . 34994 1 380 . 1 . 1 32 32 GLN CG C 13 33.77 0.2 . 1 . . . . B 145 GLN CG . 34994 1 381 . 1 . 1 32 32 GLN N N 15 119.88 0.2 . 1 . . . . B 145 GLN N . 34994 1 382 . 1 . 1 32 32 GLN NE2 N 15 113.06 0.2 . 1 . . . . B 145 GLN NE2 . 34994 1 383 . 1 . 1 33 33 ALA H H 1 8.27 0.02 . 1 . . . . B 146 ALA H . 34994 1 384 . 1 . 1 33 33 ALA HA H 1 4.27 0.02 . 1 . . . . B 146 ALA HA . 34994 1 385 . 1 . 1 33 33 ALA HB1 H 1 1.39 0.02 . 1 . . . . B 146 ALA HB1 . 34994 1 386 . 1 . 1 33 33 ALA HB2 H 1 1.39 0.02 . 1 . . . . B 146 ALA HB2 . 34994 1 387 . 1 . 1 33 33 ALA HB3 H 1 1.39 0.02 . 1 . . . . B 146 ALA HB3 . 34994 1 388 . 1 . 1 33 33 ALA C C 13 178.22 0.2 . 1 . . . . B 146 ALA C . 34994 1 389 . 1 . 1 33 33 ALA CA C 13 53 0.2 . 1 . . . . B 146 ALA CA . 34994 1 390 . 1 . 1 33 33 ALA CB C 13 18.95 0.2 . 1 . . . . B 146 ALA CB . 34994 1 391 . 1 . 1 33 33 ALA N N 15 123.97 0.2 . 1 . . . . B 146 ALA N . 34994 1 392 . 1 . 1 34 34 LEU H H 1 8.05 0.02 . 1 . . . . B 147 LEU H . 34994 1 393 . 1 . 1 34 34 LEU HA H 1 4.29 0.02 . 1 . . . . B 147 LEU HA . 34994 1 394 . 1 . 1 34 34 LEU HB2 H 1 1.64 0.02 . 2 . . . . B 147 LEU HB2 . 34994 1 395 . 1 . 1 34 34 LEU HB3 H 1 1.59 0.02 . 2 . . . . B 147 LEU HB3 . 34994 1 396 . 1 . 1 34 34 LEU HG H 1 1.63 0.02 . 1 . . . . B 147 LEU HG . 34994 1 397 . 1 . 1 34 34 LEU HD11 H 1 0.91 0.02 . 2 . . . . B 147 LEU HD11 . 34994 1 398 . 1 . 1 34 34 LEU HD12 H 1 0.91 0.02 . 2 . . . . B 147 LEU HD12 . 34994 1 399 . 1 . 1 34 34 LEU HD13 H 1 0.91 0.02 . 2 . . . . B 147 LEU HD13 . 34994 1 400 . 1 . 1 34 34 LEU HD21 H 1 0.86 0.02 . 2 . . . . B 147 LEU HD21 . 34994 1 401 . 1 . 1 34 34 LEU HD22 H 1 0.86 0.02 . 2 . . . . B 147 LEU HD22 . 34994 1 402 . 1 . 1 34 34 LEU HD23 H 1 0.86 0.02 . 2 . . . . B 147 LEU HD23 . 34994 1 403 . 1 . 1 34 34 LEU C C 13 177.8 0.2 . 1 . . . . B 147 LEU C . 34994 1 404 . 1 . 1 34 34 LEU CA C 13 55.66 0.2 . 1 . . . . B 147 LEU CA . 34994 1 405 . 1 . 1 34 34 LEU CB C 13 42.14 0.2 . 1 . . . . B 147 LEU CB . 34994 1 406 . 1 . 1 34 34 LEU CG C 13 27.01 0.2 . 1 . . . . B 147 LEU CG . 34994 1 407 . 1 . 1 34 34 LEU CD1 C 13 24.92 0.2 . 2 . . . . B 147 LEU CD1 . 34994 1 408 . 1 . 1 34 34 LEU CD2 C 13 23.6 0.2 . 2 . . . . B 147 LEU CD2 . 34994 1 409 . 1 . 1 34 34 LEU N N 15 120.75 0.2 . 1 . . . . B 147 LEU N . 34994 1 410 . 1 . 1 35 35 LYS H H 1 8.11 0.02 . 1 . . . . B 148 LYS H . 34994 1 411 . 1 . 1 35 35 LYS HA H 1 4.19 0.02 . 1 . . . . B 148 LYS HA . 34994 1 412 . 1 . 1 35 35 LYS HB2 H 1 1.81 0.02 . 2 . . . . B 148 LYS HB2 . 34994 1 413 . 1 . 1 35 35 LYS HB3 H 1 1.77 0.02 . 2 . . . . B 148 LYS HB3 . 34994 1 414 . 1 . 1 35 35 LYS HG2 H 1 1.43 0.02 . 2 . . . . B 148 LYS HG2 . 34994 1 415 . 1 . 1 35 35 LYS HG3 H 1 1.37 0.02 . 2 . . . . B 148 LYS HG3 . 34994 1 416 . 1 . 1 35 35 LYS HD2 H 1 1.64 0.02 . 1 . . . . B 148 LYS HD2 . 34994 1 417 . 1 . 1 35 35 LYS HD3 H 1 1.64 0.02 . 1 . . . . B 148 LYS HD3 . 34994 1 418 . 1 . 1 35 35 LYS C C 13 176.99 0.2 . 1 . . . . B 148 LYS C . 34994 1 419 . 1 . 1 35 35 LYS CA C 13 57.27 0.2 . 1 . . . . B 148 LYS CA . 34994 1 420 . 1 . 1 35 35 LYS CB C 13 32.86 0.2 . 1 . . . . B 148 LYS CB . 34994 1 421 . 1 . 1 35 35 LYS CG C 13 24.64 0.2 . 1 . . . . B 148 LYS CG . 34994 1 422 . 1 . 1 35 35 LYS CD C 13 29.08 0.2 . 1 . . . . B 148 LYS CD . 34994 1 423 . 1 . 1 35 35 LYS N N 15 121.07 0.2 . 1 . . . . B 148 LYS N . 34994 1 424 . 1 . 1 36 36 ASP H H 1 8.26 0.02 . 1 . . . . B 149 ASP H . 34994 1 425 . 1 . 1 36 36 ASP HA H 1 4.52 0.02 . 1 . . . . B 149 ASP HA . 34994 1 426 . 1 . 1 36 36 ASP HB2 H 1 2.66 0.02 . 2 . . . . B 149 ASP HB2 . 34994 1 427 . 1 . 1 36 36 ASP HB3 H 1 2.62 0.02 . 2 . . . . B 149 ASP HB3 . 34994 1 428 . 1 . 1 36 36 ASP C C 13 176.68 0.2 . 1 . . . . B 149 ASP C . 34994 1 429 . 1 . 1 36 36 ASP CA C 13 55.08 0.2 . 1 . . . . B 149 ASP CA . 34994 1 430 . 1 . 1 36 36 ASP CB C 13 40.94 0.2 . 1 . . . . B 149 ASP CB . 34994 1 431 . 1 . 1 36 36 ASP N N 15 120.29 0.2 . 1 . . . . B 149 ASP N . 34994 1 432 . 1 . 1 37 37 HIS H H 1 8.22 0.02 . 1 . . . . B 150 HIS H . 34994 1 433 . 1 . 1 37 37 HIS HA H 1 4.54 0.02 . 1 . . . . B 150 HIS HA . 34994 1 434 . 1 . 1 37 37 HIS HB2 H 1 3.2 0.02 . 2 . . . . B 150 HIS HB2 . 34994 1 435 . 1 . 1 37 37 HIS HB3 H 1 3.15 0.02 . 2 . . . . B 150 HIS HB3 . 34994 1 436 . 1 . 1 37 37 HIS HD2 H 1 7.06 0.02 . 1 . . . . B 150 HIS HD2 . 34994 1 437 . 1 . 1 37 37 HIS HE1 H 1 8 0.02 . 1 . . . . B 150 HIS HE1 . 34994 1 438 . 1 . 1 37 37 HIS C C 13 175.67 0.2 . 1 . . . . B 150 HIS C . 34994 1 439 . 1 . 1 37 37 HIS CA C 13 57.08 0.2 . 1 . . . . B 150 HIS CA . 34994 1 440 . 1 . 1 37 37 HIS CB C 13 30.07 0.2 . 1 . . . . B 150 HIS CB . 34994 1 441 . 1 . 1 37 37 HIS CD2 C 13 120.06 0.2 . 1 . . . . B 150 HIS CD2 . 34994 1 442 . 1 . 1 37 37 HIS CE1 C 13 138.01 0.2 . 1 . . . . B 150 HIS CE1 . 34994 1 443 . 1 . 1 37 37 HIS N N 15 119.7 0.2 . 1 . . . . B 150 HIS N . 34994 1 444 . 1 . 1 38 38 LEU H H 1 8.1 0.02 . 1 . . . . B 151 LEU H . 34994 1 445 . 1 . 1 38 38 LEU HA H 1 4.24 0.02 . 1 . . . . B 151 LEU HA . 34994 1 446 . 1 . 1 38 38 LEU HB2 H 1 1.66 0.02 . 2 . . . . B 151 LEU HB2 . 34994 1 447 . 1 . 1 38 38 LEU HB3 H 1 1.55 0.02 . 2 . . . . B 151 LEU HB3 . 34994 1 448 . 1 . 1 38 38 LEU HG H 1 1.52 0.02 . 1 . . . . B 151 LEU HG . 34994 1 449 . 1 . 1 38 38 LEU HD11 H 1 0.89 0.02 . 2 . . . . B 151 LEU HD11 . 34994 1 450 . 1 . 1 38 38 LEU HD12 H 1 0.89 0.02 . 2 . . . . B 151 LEU HD12 . 34994 1 451 . 1 . 1 38 38 LEU HD13 H 1 0.89 0.02 . 2 . . . . B 151 LEU HD13 . 34994 1 452 . 1 . 1 38 38 LEU HD21 H 1 0.84 0.02 . 2 . . . . B 151 LEU HD21 . 34994 1 453 . 1 . 1 38 38 LEU HD22 H 1 0.84 0.02 . 2 . . . . B 151 LEU HD22 . 34994 1 454 . 1 . 1 38 38 LEU HD23 H 1 0.84 0.02 . 2 . . . . B 151 LEU HD23 . 34994 1 455 . 1 . 1 38 38 LEU C C 13 177.62 0.2 . 1 . . . . B 151 LEU C . 34994 1 456 . 1 . 1 38 38 LEU CA C 13 55.77 0.2 . 1 . . . . B 151 LEU CA . 34994 1 457 . 1 . 1 38 38 LEU CB C 13 42.09 0.2 . 1 . . . . B 151 LEU CB . 34994 1 458 . 1 . 1 38 38 LEU CG C 13 26.87 0.2 . 1 . . . . B 151 LEU CG . 34994 1 459 . 1 . 1 38 38 LEU CD1 C 13 25.03 0.2 . 2 . . . . B 151 LEU CD1 . 34994 1 460 . 1 . 1 38 38 LEU CD2 C 13 23.32 0.2 . 2 . . . . B 151 LEU CD2 . 34994 1 461 . 1 . 1 38 38 LEU N N 15 121.99 0.2 . 1 . . . . B 151 LEU N . 34994 1 462 . 1 . 1 39 39 ALA H H 1 8.11 0.02 . 1 . . . . B 152 ALA H . 34994 1 463 . 1 . 1 39 39 ALA HA H 1 4.22 0.02 . 1 . . . . B 152 ALA HA . 34994 1 464 . 1 . 1 39 39 ALA HB1 H 1 1.37 0.02 . 1 . . . . B 152 ALA HB1 . 34994 1 465 . 1 . 1 39 39 ALA HB2 H 1 1.37 0.02 . 1 . . . . B 152 ALA HB2 . 34994 1 466 . 1 . 1 39 39 ALA HB3 H 1 1.37 0.02 . 1 . . . . B 152 ALA HB3 . 34994 1 467 . 1 . 1 39 39 ALA C C 13 178.09 0.2 . 1 . . . . B 152 ALA C . 34994 1 468 . 1 . 1 39 39 ALA CA C 13 53.08 0.2 . 1 . . . . B 152 ALA CA . 34994 1 469 . 1 . 1 39 39 ALA CB C 13 18.91 0.2 . 1 . . . . B 152 ALA CB . 34994 1 470 . 1 . 1 39 39 ALA N N 15 123.69 0.2 . 1 . . . . B 152 ALA N . 34994 1 471 . 1 . 1 40 40 ALA H H 1 8.02 0.02 . 1 . . . . B 153 ALA H . 34994 1 472 . 1 . 1 40 40 ALA HA H 1 4.19 0.02 . 1 . . . . B 153 ALA HA . 34994 1 473 . 1 . 1 40 40 ALA HB1 H 1 1.33 0.02 . 1 . . . . B 153 ALA HB1 . 34994 1 474 . 1 . 1 40 40 ALA HB2 H 1 1.33 0.02 . 1 . . . . B 153 ALA HB2 . 34994 1 475 . 1 . 1 40 40 ALA HB3 H 1 1.33 0.02 . 1 . . . . B 153 ALA HB3 . 34994 1 476 . 1 . 1 40 40 ALA C C 13 178.19 0.2 . 1 . . . . B 153 ALA C . 34994 1 477 . 1 . 1 40 40 ALA CA C 13 53.19 0.2 . 1 . . . . B 153 ALA CA . 34994 1 478 . 1 . 1 40 40 ALA CB C 13 18.9 0.2 . 1 . . . . B 153 ALA CB . 34994 1 479 . 1 . 1 40 40 ALA N N 15 121.77 0.2 . 1 . . . . B 153 ALA N . 34994 1 480 . 1 . 1 41 41 TYR H H 1 7.93 0.02 . 1 . . . . B 154 TYR H . 34994 1 481 . 1 . 1 41 41 TYR HA H 1 4.47 0.02 . 1 . . . . B 154 TYR HA . 34994 1 482 . 1 . 1 41 41 TYR HB2 H 1 3.06 0.02 . 2 . . . . B 154 TYR HB2 . 34994 1 483 . 1 . 1 41 41 TYR HB3 H 1 2.99 0.02 . 2 . . . . B 154 TYR HB3 . 34994 1 484 . 1 . 1 41 41 TYR HD1 H 1 7.1 0.02 . 1 . . . . B 154 TYR HD1 . 34994 1 485 . 1 . 1 41 41 TYR HD2 H 1 7.1 0.02 . 1 . . . . B 154 TYR HD2 . 34994 1 486 . 1 . 1 41 41 TYR HE1 H 1 6.81 0.02 . 1 . . . . B 154 TYR HE1 . 34994 1 487 . 1 . 1 41 41 TYR HE2 H 1 6.81 0.02 . 1 . . . . B 154 TYR HE2 . 34994 1 488 . 1 . 1 41 41 TYR C C 13 176.29 0.2 . 1 . . . . B 154 TYR C . 34994 1 489 . 1 . 1 41 41 TYR CA C 13 58.51 0.2 . 1 . . . . B 154 TYR CA . 34994 1 490 . 1 . 1 41 41 TYR CB C 13 38.53 0.2 . 1 . . . . B 154 TYR CB . 34994 1 491 . 1 . 1 41 41 TYR CD1 C 13 133.24 0.2 . 1 . . . . B 154 TYR CD1 . 34994 1 492 . 1 . 1 41 41 TYR CD2 C 13 133.24 0.2 . 1 . . . . B 154 TYR CD2 . 34994 1 493 . 1 . 1 41 41 TYR CE1 C 13 118.15 0.2 . 1 . . . . B 154 TYR CE1 . 34994 1 494 . 1 . 1 41 41 TYR CE2 C 13 118.15 0.2 . 1 . . . . B 154 TYR CE2 . 34994 1 495 . 1 . 1 41 41 TYR N N 15 118.58 0.2 . 1 . . . . B 154 TYR N . 34994 1 496 . 1 . 1 42 42 GLU H H 1 8.15 0.02 . 1 . . . . B 155 GLU H . 34994 1 497 . 1 . 1 42 42 GLU HA H 1 4.17 0.02 . 1 . . . . B 155 GLU HA . 34994 1 498 . 1 . 1 42 42 GLU HB2 H 1 2.01 0.02 . 2 . . . . B 155 GLU HB2 . 34994 1 499 . 1 . 1 42 42 GLU HB3 H 1 1.95 0.02 . 2 . . . . B 155 GLU HB3 . 34994 1 500 . 1 . 1 42 42 GLU HG2 H 1 2.23 0.02 . 2 . . . . B 155 GLU HG2 . 34994 1 501 . 1 . 1 42 42 GLU HG3 H 1 2.22 0.02 . 2 . . . . B 155 GLU HG3 . 34994 1 502 . 1 . 1 42 42 GLU C C 13 176.79 0.2 . 1 . . . . B 155 GLU C . 34994 1 503 . 1 . 1 42 42 GLU CA C 13 57.05 0.2 . 1 . . . . B 155 GLU CA . 34994 1 504 . 1 . 1 42 42 GLU CB C 13 30.27 0.2 . 1 . . . . B 155 GLU CB . 34994 1 505 . 1 . 1 42 42 GLU CG C 13 36.29 0.2 . 1 . . . . B 155 GLU CG . 34994 1 506 . 1 . 1 42 42 GLU N N 15 121.47 0.2 . 1 . . . . B 155 GLU N . 34994 1 507 . 1 . 1 43 43 LEU H H 1 8.04 0.02 . 1 . . . . B 156 LEU H . 34994 1 508 . 1 . 1 43 43 LEU HA H 1 4.29 0.02 . 1 . . . . B 156 LEU HA . 34994 1 509 . 1 . 1 43 43 LEU HB2 H 1 1.66 0.02 . 2 . . . . B 156 LEU HB2 . 34994 1 510 . 1 . 1 43 43 LEU HB3 H 1 1.6 0.02 . 2 . . . . B 156 LEU HB3 . 34994 1 511 . 1 . 1 43 43 LEU HG H 1 1.65 0.02 . 1 . . . . B 156 LEU HG . 34994 1 512 . 1 . 1 43 43 LEU HD11 H 1 0.92 0.02 . 2 . . . . B 156 LEU HD11 . 34994 1 513 . 1 . 1 43 43 LEU HD12 H 1 0.92 0.02 . 2 . . . . B 156 LEU HD12 . 34994 1 514 . 1 . 1 43 43 LEU HD13 H 1 0.92 0.02 . 2 . . . . B 156 LEU HD13 . 34994 1 515 . 1 . 1 43 43 LEU HD21 H 1 0.87 0.02 . 2 . . . . B 156 LEU HD21 . 34994 1 516 . 1 . 1 43 43 LEU HD22 H 1 0.87 0.02 . 2 . . . . B 156 LEU HD22 . 34994 1 517 . 1 . 1 43 43 LEU HD23 H 1 0.87 0.02 . 2 . . . . B 156 LEU HD23 . 34994 1 518 . 1 . 1 43 43 LEU C C 13 177.74 0.2 . 1 . . . . B 156 LEU C . 34994 1 519 . 1 . 1 43 43 LEU CA C 13 55.69 0.2 . 1 . . . . B 156 LEU CA . 34994 1 520 . 1 . 1 43 43 LEU CB C 13 42.28 0.2 . 1 . . . . B 156 LEU CB . 34994 1 521 . 1 . 1 43 43 LEU CG C 13 27.01 0.2 . 1 . . . . B 156 LEU CG . 34994 1 522 . 1 . 1 43 43 LEU CD1 C 13 24.92 0.2 . 2 . . . . B 156 LEU CD1 . 34994 1 523 . 1 . 1 43 43 LEU CD2 C 13 23.61 0.2 . 2 . . . . B 156 LEU CD2 . 34994 1 524 . 1 . 1 43 43 LEU N N 15 122.19 0.2 . 1 . . . . B 156 LEU N . 34994 1 525 . 1 . 1 44 44 SER H H 1 8.14 0.02 . 1 . . . . B 157 SER H . 34994 1 526 . 1 . 1 44 44 SER HA H 1 4.39 0.02 . 1 . . . . B 157 SER HA . 34994 1 527 . 1 . 1 44 44 SER HB2 H 1 3.87 0.02 . 1 . . . . B 157 SER HB2 . 34994 1 528 . 1 . 1 44 44 SER HB3 H 1 3.87 0.02 . 1 . . . . B 157 SER HB3 . 34994 1 529 . 1 . 1 44 44 SER C C 13 174.59 0.2 . 1 . . . . B 157 SER C . 34994 1 530 . 1 . 1 44 44 SER CA C 13 58.73 0.2 . 1 . . . . B 157 SER CA . 34994 1 531 . 1 . 1 44 44 SER CB C 13 63.7 0.2 . 1 . . . . B 157 SER CB . 34994 1 532 . 1 . 1 44 44 SER N N 15 116 0.2 . 1 . . . . B 157 SER N . 34994 1 533 . 1 . 1 45 45 LYS H H 1 8.1 0.02 . 1 . . . . B 158 LYS H . 34994 1 534 . 1 . 1 45 45 LYS HA H 1 4.3 0.02 . 1 . . . . B 158 LYS HA . 34994 1 535 . 1 . 1 45 45 LYS HB2 H 1 1.83 0.02 . 2 . . . . B 158 LYS HB2 . 34994 1 536 . 1 . 1 45 45 LYS HB3 H 1 1.72 0.02 . 2 . . . . B 158 LYS HB3 . 34994 1 537 . 1 . 1 45 45 LYS HG2 H 1 1.39 0.02 . 1 . . . . B 158 LYS HG2 . 34994 1 538 . 1 . 1 45 45 LYS HG3 H 1 1.39 0.02 . 1 . . . . B 158 LYS HG3 . 34994 1 539 . 1 . 1 45 45 LYS HD2 H 1 1.66 0.02 . 1 . . . . B 158 LYS HD2 . 34994 1 540 . 1 . 1 45 45 LYS HD3 H 1 1.66 0.02 . 1 . . . . B 158 LYS HD3 . 34994 1 541 . 1 . 1 45 45 LYS C C 13 176.3 0.2 . 1 . . . . B 158 LYS C . 34994 1 542 . 1 . 1 45 45 LYS CA C 13 56.26 0.2 . 1 . . . . B 158 LYS CA . 34994 1 543 . 1 . 1 45 45 LYS CB C 13 33 0.2 . 1 . . . . B 158 LYS CB . 34994 1 544 . 1 . 1 45 45 LYS CG C 13 24.58 0.2 . 1 . . . . B 158 LYS CG . 34994 1 545 . 1 . 1 45 45 LYS CD C 13 29.2 0.2 . 1 . . . . B 158 LYS CD . 34994 1 546 . 1 . 1 45 45 LYS N N 15 123.01 0.2 . 1 . . . . B 158 LYS N . 34994 1 547 . 1 . 1 46 46 ALA H H 1 8.23 0.02 . 1 . . . . B 159 ALA H . 34994 1 548 . 1 . 1 46 46 ALA HA H 1 4.35 0.02 . 1 . . . . B 159 ALA HA . 34994 1 549 . 1 . 1 46 46 ALA HB1 H 1 1.41 0.02 . 1 . . . . B 159 ALA HB1 . 34994 1 550 . 1 . 1 46 46 ALA HB2 H 1 1.41 0.02 . 1 . . . . B 159 ALA HB2 . 34994 1 551 . 1 . 1 46 46 ALA HB3 H 1 1.41 0.02 . 1 . . . . B 159 ALA HB3 . 34994 1 552 . 1 . 1 46 46 ALA C C 13 177.65 0.2 . 1 . . . . B 159 ALA C . 34994 1 553 . 1 . 1 46 46 ALA CA C 13 52.64 0.2 . 1 . . . . B 159 ALA CA . 34994 1 554 . 1 . 1 46 46 ALA CB C 13 19.35 0.2 . 1 . . . . B 159 ALA CB . 34994 1 555 . 1 . 1 46 46 ALA N N 15 125.15 0.2 . 1 . . . . B 159 ALA N . 34994 1 556 . 1 . 1 47 47 SER H H 1 8.23 0.02 . 1 . . . . B 160 SER H . 34994 1 557 . 1 . 1 47 47 SER HA H 1 4.44 0.02 . 1 . . . . B 160 SER HA . 34994 1 558 . 1 . 1 47 47 SER HB2 H 1 3.88 0.02 . 1 . . . . B 160 SER HB2 . 34994 1 559 . 1 . 1 47 47 SER HB3 H 1 3.88 0.02 . 1 . . . . B 160 SER HB3 . 34994 1 560 . 1 . 1 47 47 SER C C 13 173.59 0.2 . 1 . . . . B 160 SER C . 34994 1 561 . 1 . 1 47 47 SER CA C 13 58.35 0.2 . 1 . . . . B 160 SER CA . 34994 1 562 . 1 . 1 47 47 SER CB C 13 64.03 0.2 . 1 . . . . B 160 SER CB . 34994 1 563 . 1 . 1 47 47 SER N N 15 115.36 0.2 . 1 . . . . B 160 SER N . 34994 1 564 . 1 . 1 48 48 GLU H H 1 7.96 0.02 . 1 . . . . B 161 GLU H . 34994 1 565 . 1 . 1 48 48 GLU HA H 1 4.14 0.02 . 1 . . . . B 161 GLU HA . 34994 1 566 . 1 . 1 48 48 GLU HB2 H 1 2.06 0.02 . 2 . . . . B 161 GLU HB2 . 34994 1 567 . 1 . 1 48 48 GLU HB3 H 1 1.89 0.02 . 2 . . . . B 161 GLU HB3 . 34994 1 568 . 1 . 1 48 48 GLU HG2 H 1 2.19 0.02 . 1 . . . . B 161 GLU HG2 . 34994 1 569 . 1 . 1 48 48 GLU HG3 H 1 2.19 0.02 . 1 . . . . B 161 GLU HG3 . 34994 1 570 . 1 . 1 48 48 GLU C C 13 181.07 0.2 . 1 . . . . B 161 GLU C . 34994 1 571 . 1 . 1 48 48 GLU CA C 13 58.11 0.2 . 1 . . . . B 161 GLU CA . 34994 1 572 . 1 . 1 48 48 GLU CB C 13 31.16 0.2 . 1 . . . . B 161 GLU CB . 34994 1 573 . 1 . 1 48 48 GLU CG C 13 36.67 0.2 . 1 . . . . B 161 GLU CG . 34994 1 574 . 1 . 1 48 48 GLU N N 15 127.46 0.2 . 1 . . . . B 161 GLU N . 34994 1 575 . 2 . 2 1 1 GLY C C 13 170.78 0.2 . 1 . . . . A -2 GLY C . 34994 1 576 . 2 . 2 2 2 SER N N 15 115.74 0.2 . 1 . . . . A -1 SER N . 34994 1 577 . 2 . 2 3 3 HIS HA H 1 4.67 0.02 . 1 . . . . A 0 HIS HA . 34994 1 578 . 2 . 2 3 3 HIS HB2 H 1 3.17 0.02 . 2 . . . . A 0 HIS HB2 . 34994 1 579 . 2 . 2 3 3 HIS HB3 H 1 3.1 0.02 . 2 . . . . A 0 HIS HB3 . 34994 1 580 . 2 . 2 3 3 HIS HD2 H 1 7.08 0.02 . 1 . . . . A 0 HIS HD2 . 34994 1 581 . 2 . 2 3 3 HIS C C 13 175.02 0.2 . 1 . . . . A 0 HIS C . 34994 1 582 . 2 . 2 3 3 HIS CA C 13 56.24 0.2 . 1 . . . . A 0 HIS CA . 34994 1 583 . 2 . 2 3 3 HIS CB C 13 30.39 0.2 . 1 . . . . A 0 HIS CB . 34994 1 584 . 2 . 2 3 3 HIS CD2 C 13 120.03 0.2 . 1 . . . . A 0 HIS CD2 . 34994 1 585 . 2 . 2 4 4 MET H H 1 8.34 0.02 . 1 . . . . A 1 MET H . 34994 1 586 . 2 . 2 4 4 MET HA H 1 4.46 0.02 . 1 . . . . A 1 MET HA . 34994 1 587 . 2 . 2 4 4 MET HB2 H 1 2.05 0.02 . 2 . . . . A 1 MET HB2 . 34994 1 588 . 2 . 2 4 4 MET HB3 H 1 1.95 0.02 . 2 . . . . A 1 MET HB3 . 34994 1 589 . 2 . 2 4 4 MET HG2 H 1 2.53 0.02 . 2 . . . . A 1 MET HG2 . 34994 1 590 . 2 . 2 4 4 MET HG3 H 1 2.5 0.02 . 2 . . . . A 1 MET HG3 . 34994 1 591 . 2 . 2 4 4 MET HE1 H 1 2.09 0.02 . 1 . . . . A 1 MET HE1 . 34994 1 592 . 2 . 2 4 4 MET HE2 H 1 2.09 0.02 . 1 . . . . A 1 MET HE2 . 34994 1 593 . 2 . 2 4 4 MET HE3 H 1 2.09 0.02 . 1 . . . . A 1 MET HE3 . 34994 1 594 . 2 . 2 4 4 MET C C 13 175.39 0.2 . 1 . . . . A 1 MET C . 34994 1 595 . 2 . 2 4 4 MET CA C 13 55.3 0.2 . 1 . . . . A 1 MET CA . 34994 1 596 . 2 . 2 4 4 MET CB C 13 33.15 0.2 . 1 . . . . A 1 MET CB . 34994 1 597 . 2 . 2 4 4 MET CG C 13 31.89 0.2 . 1 . . . . A 1 MET CG . 34994 1 598 . 2 . 2 4 4 MET CE C 13 17 0.2 . 1 . . . . A 1 MET CE . 34994 1 599 . 2 . 2 4 4 MET N N 15 122.13 0.2 . 1 . . . . A 1 MET N . 34994 1 600 . 2 . 2 5 5 ALA H H 1 8.35 0.02 . 1 . . . . A 2 ALA H . 34994 1 601 . 2 . 2 5 5 ALA HA H 1 4.4 0.02 . 1 . . . . A 2 ALA HA . 34994 1 602 . 2 . 2 5 5 ALA HB1 H 1 1.35 0.02 . 1 . . . . A 2 ALA HB1 . 34994 1 603 . 2 . 2 5 5 ALA HB2 H 1 1.35 0.02 . 1 . . . . A 2 ALA HB2 . 34994 1 604 . 2 . 2 5 5 ALA HB3 H 1 1.35 0.02 . 1 . . . . A 2 ALA HB3 . 34994 1 605 . 2 . 2 5 5 ALA C C 13 177.11 0.2 . 1 . . . . A 2 ALA C . 34994 1 606 . 2 . 2 5 5 ALA CA C 13 52.28 0.2 . 1 . . . . A 2 ALA CA . 34994 1 607 . 2 . 2 5 5 ALA CB C 13 19.71 0.2 . 1 . . . . A 2 ALA CB . 34994 1 608 . 2 . 2 5 5 ALA N N 15 125.89 0.2 . 1 . . . . A 2 ALA N . 34994 1 609 . 2 . 2 6 6 THR H H 1 8.55 0.02 . 1 . . . . A 3 THR H . 34994 1 610 . 2 . 2 6 6 THR HA H 1 4.38 0.02 . 1 . . . . A 3 THR HA . 34994 1 611 . 2 . 2 6 6 THR HB H 1 4.14 0.02 . 1 . . . . A 3 THR HB . 34994 1 612 . 2 . 2 6 6 THR HG21 H 1 1.28 0.02 . 1 . . . . A 3 THR HG21 . 34994 1 613 . 2 . 2 6 6 THR HG22 H 1 1.28 0.02 . 1 . . . . A 3 THR HG22 . 34994 1 614 . 2 . 2 6 6 THR HG23 H 1 1.28 0.02 . 1 . . . . A 3 THR HG23 . 34994 1 615 . 2 . 2 6 6 THR C C 13 173.41 0.2 . 1 . . . . A 3 THR C . 34994 1 616 . 2 . 2 6 6 THR CA C 13 62.69 0.2 . 1 . . . . A 3 THR CA . 34994 1 617 . 2 . 2 6 6 THR CB C 13 70.26 0.2 . 1 . . . . A 3 THR CB . 34994 1 618 . 2 . 2 6 6 THR CG2 C 13 22.5 0.2 . 1 . . . . A 3 THR CG2 . 34994 1 619 . 2 . 2 6 6 THR N N 15 117.59 0.2 . 1 . . . . A 3 THR N . 34994 1 620 . 2 . 2 7 7 LYS H H 1 8.86 0.02 . 1 . . . . A 4 LYS H . 34994 1 621 . 2 . 2 7 7 LYS HA H 1 5.23 0.02 . 1 . . . . A 4 LYS HA . 34994 1 622 . 2 . 2 7 7 LYS HB2 H 1 1.77 0.02 . 2 . . . . A 4 LYS HB2 . 34994 1 623 . 2 . 2 7 7 LYS HB3 H 1 1.67 0.02 . 2 . . . . A 4 LYS HB3 . 34994 1 624 . 2 . 2 7 7 LYS HG2 H 1 1.46 0.02 . 2 . . . . A 4 LYS HG2 . 34994 1 625 . 2 . 2 7 7 LYS HG3 H 1 1.39 0.02 . 2 . . . . A 4 LYS HG3 . 34994 1 626 . 2 . 2 7 7 LYS HD2 H 1 1.6 0.02 . 2 . . . . A 4 LYS HD2 . 34994 1 627 . 2 . 2 7 7 LYS HD3 H 1 1.55 0.02 . 2 . . . . A 4 LYS HD3 . 34994 1 628 . 2 . 2 7 7 LYS HE2 H 1 2.88 0.02 . 1 . . . . A 4 LYS HE2 . 34994 1 629 . 2 . 2 7 7 LYS HE3 H 1 2.88 0.02 . 1 . . . . A 4 LYS HE3 . 34994 1 630 . 2 . 2 7 7 LYS C C 13 174.86 0.2 . 1 . . . . A 4 LYS C . 34994 1 631 . 2 . 2 7 7 LYS CA C 13 54.69 0.2 . 1 . . . . A 4 LYS CA . 34994 1 632 . 2 . 2 7 7 LYS CB C 13 35.81 0.2 . 1 . . . . A 4 LYS CB . 34994 1 633 . 2 . 2 7 7 LYS CG C 13 25.13 0.2 . 1 . . . . A 4 LYS CG . 34994 1 634 . 2 . 2 7 7 LYS CD C 13 29.19 0.2 . 1 . . . . A 4 LYS CD . 34994 1 635 . 2 . 2 7 7 LYS CE C 13 42.16 0.2 . 1 . . . . A 4 LYS CE . 34994 1 636 . 2 . 2 7 7 LYS N N 15 125.75 0.2 . 1 . . . . A 4 LYS N . 34994 1 637 . 2 . 2 8 8 ALA H H 1 8.96 0.02 . 1 . . . . A 5 ALA H . 34994 1 638 . 2 . 2 8 8 ALA HA H 1 5.14 0.02 . 1 . . . . A 5 ALA HA . 34994 1 639 . 2 . 2 8 8 ALA HB1 H 1 1.04 0.02 . 1 . . . . A 5 ALA HB1 . 34994 1 640 . 2 . 2 8 8 ALA HB2 H 1 1.04 0.02 . 1 . . . . A 5 ALA HB2 . 34994 1 641 . 2 . 2 8 8 ALA HB3 H 1 1.04 0.02 . 1 . . . . A 5 ALA HB3 . 34994 1 642 . 2 . 2 8 8 ALA C C 13 174.25 0.2 . 1 . . . . A 5 ALA C . 34994 1 643 . 2 . 2 8 8 ALA CA C 13 50.49 0.2 . 1 . . . . A 5 ALA CA . 34994 1 644 . 2 . 2 8 8 ALA CB C 13 23.61 0.2 . 1 . . . . A 5 ALA CB . 34994 1 645 . 2 . 2 8 8 ALA N N 15 120.72 0.2 . 1 . . . . A 5 ALA N . 34994 1 646 . 2 . 2 9 9 ARG H H 1 8.96 0.02 . 1 . . . . A 6 ARG H . 34994 1 647 . 2 . 2 9 9 ARG HA H 1 5.03 0.02 . 1 . . . . A 6 ARG HA . 34994 1 648 . 2 . 2 9 9 ARG HB2 H 1 1.83 0.02 . 2 . . . . A 6 ARG HB2 . 34994 1 649 . 2 . 2 9 9 ARG HB3 H 1 1.53 0.02 . 2 . . . . A 6 ARG HB3 . 34994 1 650 . 2 . 2 9 9 ARG HG2 H 1 1.38 0.02 . 2 . . . . A 6 ARG HG2 . 34994 1 651 . 2 . 2 9 9 ARG HG3 H 1 1.36 0.02 . 2 . . . . A 6 ARG HG3 . 34994 1 652 . 2 . 2 9 9 ARG HD2 H 1 3.21 0.02 . 2 . . . . A 6 ARG HD2 . 34994 1 653 . 2 . 2 9 9 ARG HD3 H 1 3.13 0.02 . 2 . . . . A 6 ARG HD3 . 34994 1 654 . 2 . 2 9 9 ARG HE H 1 7.35 0.02 . 1 . . . . A 6 ARG HE . 34994 1 655 . 2 . 2 9 9 ARG C C 13 175.78 0.2 . 1 . . . . A 6 ARG C . 34994 1 656 . 2 . 2 9 9 ARG CA C 13 54.03 0.2 . 1 . . . . A 6 ARG CA . 34994 1 657 . 2 . 2 9 9 ARG CB C 13 33.2 0.2 . 1 . . . . A 6 ARG CB . 34994 1 658 . 2 . 2 9 9 ARG CG C 13 27.48 0.2 . 1 . . . . A 6 ARG CG . 34994 1 659 . 2 . 2 9 9 ARG CD C 13 43.36 0.2 . 1 . . . . A 6 ARG CD . 34994 1 660 . 2 . 2 9 9 ARG N N 15 121.32 0.2 . 1 . . . . A 6 ARG N . 34994 1 661 . 2 . 2 9 9 ARG NE N 15 83.78 0.2 . 1 . . . . A 6 ARG NE . 34994 1 662 . 2 . 2 10 10 VAL H H 1 9.3 0.02 . 1 . . . . A 7 VAL H . 34994 1 663 . 2 . 2 10 10 VAL HA H 1 3.96 0.02 . 1 . . . . A 7 VAL HA . 34994 1 664 . 2 . 2 10 10 VAL HB H 1 2.34 0.02 . 1 . . . . A 7 VAL HB . 34994 1 665 . 2 . 2 10 10 VAL HG11 H 1 0.91 0.02 . 2 . . . . A 7 VAL HG11 . 34994 1 666 . 2 . 2 10 10 VAL HG12 H 1 0.91 0.02 . 2 . . . . A 7 VAL HG12 . 34994 1 667 . 2 . 2 10 10 VAL HG13 H 1 0.91 0.02 . 2 . . . . A 7 VAL HG13 . 34994 1 668 . 2 . 2 10 10 VAL HG21 H 1 0.92 0.02 . 2 . . . . A 7 VAL HG21 . 34994 1 669 . 2 . 2 10 10 VAL HG22 H 1 0.92 0.02 . 2 . . . . A 7 VAL HG22 . 34994 1 670 . 2 . 2 10 10 VAL HG23 H 1 0.92 0.02 . 2 . . . . A 7 VAL HG23 . 34994 1 671 . 2 . 2 10 10 VAL C C 13 176.99 0.2 . 1 . . . . A 7 VAL C . 34994 1 672 . 2 . 2 10 10 VAL CA C 13 64.02 0.2 . 1 . . . . A 7 VAL CA . 34994 1 673 . 2 . 2 10 10 VAL CB C 13 31.39 0.2 . 1 . . . . A 7 VAL CB . 34994 1 674 . 2 . 2 10 10 VAL CG1 C 13 21.55 0.2 . 2 . . . . A 7 VAL CG1 . 34994 1 675 . 2 . 2 10 10 VAL CG2 C 13 23.35 0.2 . 2 . . . . A 7 VAL CG2 . 34994 1 676 . 2 . 2 10 10 VAL N N 15 128.84 0.2 . 1 . . . . A 7 VAL N . 34994 1 677 . 2 . 2 11 11 MET H H 1 9.45 0.02 . 1 . . . . A 8 MET H . 34994 1 678 . 2 . 2 11 11 MET HA H 1 4.15 0.02 . 1 . . . . A 8 MET HA . 34994 1 679 . 2 . 2 11 11 MET HB2 H 1 1.18 0.02 . 2 . . . . A 8 MET HB2 . 34994 1 680 . 2 . 2 11 11 MET HB3 H 1 1.11 0.02 . 2 . . . . A 8 MET HB3 . 34994 1 681 . 2 . 2 11 11 MET HG2 H 1 2.09 0.02 . 2 . . . . A 8 MET HG2 . 34994 1 682 . 2 . 2 11 11 MET HG3 H 1 2.23 0.02 . 2 . . . . A 8 MET HG3 . 34994 1 683 . 2 . 2 11 11 MET HE1 H 1 1.81 0.02 . 1 . . . . A 8 MET HE1 . 34994 1 684 . 2 . 2 11 11 MET HE2 H 1 1.81 0.02 . 1 . . . . A 8 MET HE2 . 34994 1 685 . 2 . 2 11 11 MET HE3 H 1 1.81 0.02 . 1 . . . . A 8 MET HE3 . 34994 1 686 . 2 . 2 11 11 MET C C 13 174.63 0.2 . 1 . . . . A 8 MET C . 34994 1 687 . 2 . 2 11 11 MET CA C 13 56.8 0.2 . 1 . . . . A 8 MET CA . 34994 1 688 . 2 . 2 11 11 MET CB C 13 33.67 0.2 . 1 . . . . A 8 MET CB . 34994 1 689 . 2 . 2 11 11 MET CG C 13 31.65 0.2 . 1 . . . . A 8 MET CG . 34994 1 690 . 2 . 2 11 11 MET CE C 13 16.05 0.2 . 1 . . . . A 8 MET CE . 34994 1 691 . 2 . 2 11 11 MET N N 15 127.99 0.2 . 1 . . . . A 8 MET N . 34994 1 692 . 2 . 2 12 12 TYR H H 1 7.01 0.02 . 1 . . . . A 9 TYR H . 34994 1 693 . 2 . 2 12 12 TYR HA H 1 4.88 0.02 . 1 . . . . A 9 TYR HA . 34994 1 694 . 2 . 2 12 12 TYR HB2 H 1 3.03 0.02 . 2 . . . . A 9 TYR HB2 . 34994 1 695 . 2 . 2 12 12 TYR HB3 H 1 2.35 0.02 . 2 . . . . A 9 TYR HB3 . 34994 1 696 . 2 . 2 12 12 TYR HD1 H 1 6.67 0.02 . 1 . . . . A 9 TYR HD1 . 34994 1 697 . 2 . 2 12 12 TYR HD2 H 1 6.67 0.02 . 1 . . . . A 9 TYR HD2 . 34994 1 698 . 2 . 2 12 12 TYR HE1 H 1 6.67 0.02 . 1 . . . . A 9 TYR HE1 . 34994 1 699 . 2 . 2 12 12 TYR HE2 H 1 6.67 0.02 . 1 . . . . A 9 TYR HE2 . 34994 1 700 . 2 . 2 12 12 TYR C C 13 173.11 0.2 . 1 . . . . A 9 TYR C . 34994 1 701 . 2 . 2 12 12 TYR CA C 13 53.92 0.2 . 1 . . . . A 9 TYR CA . 34994 1 702 . 2 . 2 12 12 TYR CB C 13 42 0.2 . 1 . . . . A 9 TYR CB . 34994 1 703 . 2 . 2 12 12 TYR CD1 C 13 134.07 0.2 . 1 . . . . A 9 TYR CD1 . 34994 1 704 . 2 . 2 12 12 TYR CD2 C 13 134.07 0.2 . 1 . . . . A 9 TYR CD2 . 34994 1 705 . 2 . 2 12 12 TYR CE1 C 13 117.48 0.2 . 1 . . . . A 9 TYR CE1 . 34994 1 706 . 2 . 2 12 12 TYR CE2 C 13 117.48 0.2 . 1 . . . . A 9 TYR CE2 . 34994 1 707 . 2 . 2 12 12 TYR N N 15 113.83 0.2 . 1 . . . . A 9 TYR N . 34994 1 708 . 2 . 2 13 13 ASP H H 1 8.61 0.02 . 1 . . . . A 10 ASP H . 34994 1 709 . 2 . 2 13 13 ASP HA H 1 4.64 0.02 . 1 . . . . A 10 ASP HA . 34994 1 710 . 2 . 2 13 13 ASP HB2 H 1 2.91 0.02 . 2 . . . . A 10 ASP HB2 . 34994 1 711 . 2 . 2 13 13 ASP HB3 H 1 2.61 0.02 . 2 . . . . A 10 ASP HB3 . 34994 1 712 . 2 . 2 13 13 ASP C C 13 175.9 0.2 . 1 . . . . A 10 ASP C . 34994 1 713 . 2 . 2 13 13 ASP CA C 13 55.8 0.2 . 1 . . . . A 10 ASP CA . 34994 1 714 . 2 . 2 13 13 ASP CB C 13 41.34 0.2 . 1 . . . . A 10 ASP CB . 34994 1 715 . 2 . 2 13 13 ASP N N 15 118.69 0.2 . 1 . . . . A 10 ASP N . 34994 1 716 . 2 . 2 14 14 PHE H H 1 8.79 0.02 . 1 . . . . A 11 PHE H . 34994 1 717 . 2 . 2 14 14 PHE HA H 1 4.92 0.02 . 1 . . . . A 11 PHE HA . 34994 1 718 . 2 . 2 14 14 PHE HB2 H 1 3.21 0.02 . 2 . . . . A 11 PHE HB2 . 34994 1 719 . 2 . 2 14 14 PHE HB3 H 1 3.01 0.02 . 2 . . . . A 11 PHE HB3 . 34994 1 720 . 2 . 2 14 14 PHE HD1 H 1 7.35 0.02 . 1 . . . . A 11 PHE HD1 . 34994 1 721 . 2 . 2 14 14 PHE HD2 H 1 7.35 0.02 . 1 . . . . A 11 PHE HD2 . 34994 1 722 . 2 . 2 14 14 PHE HE1 H 1 7.29 0.02 . 1 . . . . A 11 PHE HE1 . 34994 1 723 . 2 . 2 14 14 PHE HE2 H 1 7.29 0.02 . 1 . . . . A 11 PHE HE2 . 34994 1 724 . 2 . 2 14 14 PHE HZ H 1 7.63 0.02 . 1 . . . . A 11 PHE HZ . 34994 1 725 . 2 . 2 14 14 PHE C C 13 172.3 0.2 . 1 . . . . A 11 PHE C . 34994 1 726 . 2 . 2 14 14 PHE CA C 13 57.08 0.2 . 1 . . . . A 11 PHE CA . 34994 1 727 . 2 . 2 14 14 PHE CB C 13 41.47 0.2 . 1 . . . . A 11 PHE CB . 34994 1 728 . 2 . 2 14 14 PHE CD1 C 13 132.47 0.2 . 1 . . . . A 11 PHE CD1 . 34994 1 729 . 2 . 2 14 14 PHE CD2 C 13 132.47 0.2 . 1 . . . . A 11 PHE CD2 . 34994 1 730 . 2 . 2 14 14 PHE CE1 C 13 131.15 0.2 . 1 . . . . A 11 PHE CE1 . 34994 1 731 . 2 . 2 14 14 PHE CE2 C 13 131.15 0.2 . 1 . . . . A 11 PHE CE2 . 34994 1 732 . 2 . 2 14 14 PHE CZ C 13 130.02 0.2 . 1 . . . . A 11 PHE CZ . 34994 1 733 . 2 . 2 14 14 PHE N N 15 122.15 0.2 . 1 . . . . A 11 PHE N . 34994 1 734 . 2 . 2 15 15 ALA H H 1 7.92 0.02 . 1 . . . . A 12 ALA H . 34994 1 735 . 2 . 2 15 15 ALA HA H 1 4.42 0.02 . 1 . . . . A 12 ALA HA . 34994 1 736 . 2 . 2 15 15 ALA HB1 H 1 1.13 0.02 . 1 . . . . A 12 ALA HB1 . 34994 1 737 . 2 . 2 15 15 ALA HB2 H 1 1.13 0.02 . 1 . . . . A 12 ALA HB2 . 34994 1 738 . 2 . 2 15 15 ALA HB3 H 1 1.13 0.02 . 1 . . . . A 12 ALA HB3 . 34994 1 739 . 2 . 2 15 15 ALA C C 13 174.64 0.2 . 1 . . . . A 12 ALA C . 34994 1 740 . 2 . 2 15 15 ALA CA C 13 49.84 0.2 . 1 . . . . A 12 ALA CA . 34994 1 741 . 2 . 2 15 15 ALA CB C 13 19.07 0.2 . 1 . . . . A 12 ALA CB . 34994 1 742 . 2 . 2 15 15 ALA N N 15 131.43 0.2 . 1 . . . . A 12 ALA N . 34994 1 743 . 2 . 2 16 16 ALA H H 1 7.74 0.02 . 1 . . . . A 13 ALA H . 34994 1 744 . 2 . 2 16 16 ALA HA H 1 3.87 0.02 . 1 . . . . A 13 ALA HA . 34994 1 745 . 2 . 2 16 16 ALA HB1 H 1 1.06 0.02 . 1 . . . . A 13 ALA HB1 . 34994 1 746 . 2 . 2 16 16 ALA HB2 H 1 1.06 0.02 . 1 . . . . A 13 ALA HB2 . 34994 1 747 . 2 . 2 16 16 ALA HB3 H 1 1.06 0.02 . 1 . . . . A 13 ALA HB3 . 34994 1 748 . 2 . 2 16 16 ALA C C 13 178.82 0.2 . 1 . . . . A 13 ALA C . 34994 1 749 . 2 . 2 16 16 ALA CA C 13 51.75 0.2 . 1 . . . . A 13 ALA CA . 34994 1 750 . 2 . 2 16 16 ALA CB C 13 21 0.2 . 1 . . . . A 13 ALA CB . 34994 1 751 . 2 . 2 16 16 ALA N N 15 125.2 0.2 . 1 . . . . A 13 ALA N . 34994 1 752 . 2 . 2 17 17 GLU H H 1 8.69 0.02 . 1 . . . . A 14 GLU H . 34994 1 753 . 2 . 2 17 17 GLU HA H 1 4.58 0.02 . 1 . . . . A 14 GLU HA . 34994 1 754 . 2 . 2 17 17 GLU HB2 H 1 1.95 0.02 . 2 . . . . A 14 GLU HB2 . 34994 1 755 . 2 . 2 17 17 GLU HB3 H 1 1.86 0.02 . 2 . . . . A 14 GLU HB3 . 34994 1 756 . 2 . 2 17 17 GLU HG2 H 1 2.23 0.02 . 1 . . . . A 14 GLU HG2 . 34994 1 757 . 2 . 2 17 17 GLU HG3 H 1 2.23 0.02 . 1 . . . . A 14 GLU HG3 . 34994 1 758 . 2 . 2 17 17 GLU C C 13 175.12 0.2 . 1 . . . . A 14 GLU C . 34994 1 759 . 2 . 2 17 17 GLU CA C 13 53.72 0.2 . 1 . . . . A 14 GLU CA . 34994 1 760 . 2 . 2 17 17 GLU CB C 13 29.64 0.2 . 1 . . . . A 14 GLU CB . 34994 1 761 . 2 . 2 17 17 GLU CG C 13 35.88 0.2 . 1 . . . . A 14 GLU CG . 34994 1 762 . 2 . 2 17 17 GLU N N 15 124.67 0.2 . 1 . . . . A 14 GLU N . 34994 1 763 . 2 . 2 18 18 PRO HA H 1 4.29 0.02 . 1 . . . . A 15 PRO HA . 34994 1 764 . 2 . 2 18 18 PRO HB2 H 1 2.28 0.02 . 2 . . . . A 15 PRO HB2 . 34994 1 765 . 2 . 2 18 18 PRO HB3 H 1 1.87 0.02 . 2 . . . . A 15 PRO HB3 . 34994 1 766 . 2 . 2 18 18 PRO HG2 H 1 2.05 0.02 . 2 . . . . A 15 PRO HG2 . 34994 1 767 . 2 . 2 18 18 PRO HG3 H 1 1.95 0.02 . 2 . . . . A 15 PRO HG3 . 34994 1 768 . 2 . 2 18 18 PRO HD2 H 1 3.64 0.02 . 2 . . . . A 15 PRO HD2 . 34994 1 769 . 2 . 2 18 18 PRO HD3 H 1 3.84 0.02 . 2 . . . . A 15 PRO HD3 . 34994 1 770 . 2 . 2 18 18 PRO C C 13 177.41 0.2 . 1 . . . . A 15 PRO C . 34994 1 771 . 2 . 2 18 18 PRO CA C 13 63.87 0.2 . 1 . . . . A 15 PRO CA . 34994 1 772 . 2 . 2 18 18 PRO CB C 13 32.22 0.2 . 1 . . . . A 15 PRO CB . 34994 1 773 . 2 . 2 18 18 PRO CG C 13 27.46 0.2 . 1 . . . . A 15 PRO CG . 34994 1 774 . 2 . 2 18 18 PRO CD C 13 51.01 0.2 . 1 . . . . A 15 PRO CD . 34994 1 775 . 2 . 2 18 18 PRO N N 15 138.99 0.2 . 1 . . . . A 15 PRO N . 34994 1 776 . 2 . 2 19 19 GLY H H 1 8.62 0.02 . 1 . . . . A 16 GLY H . 34994 1 777 . 2 . 2 19 19 GLY HA2 H 1 4.18 0.02 . 2 . . . . A 16 GLY HA2 . 34994 1 778 . 2 . 2 19 19 GLY HA3 H 1 3.72 0.02 . 2 . . . . A 16 GLY HA3 . 34994 1 779 . 2 . 2 19 19 GLY C C 13 174.69 0.2 . 1 . . . . A 16 GLY C . 34994 1 780 . 2 . 2 19 19 GLY CA C 13 45.71 0.2 . 1 . . . . A 16 GLY CA . 34994 1 781 . 2 . 2 19 19 GLY N N 15 109.11 0.2 . 1 . . . . A 16 GLY N . 34994 1 782 . 2 . 2 20 20 ASN H H 1 7.98 0.02 . 1 . . . . A 17 ASN H . 34994 1 783 . 2 . 2 20 20 ASN HA H 1 4.86 0.02 . 1 . . . . A 17 ASN HA . 34994 1 784 . 2 . 2 20 20 ASN HB2 H 1 2.89 0.02 . 2 . . . . A 17 ASN HB2 . 34994 1 785 . 2 . 2 20 20 ASN HB3 H 1 2.47 0.02 . 2 . . . . A 17 ASN HB3 . 34994 1 786 . 2 . 2 20 20 ASN HD21 H 1 7.56 0.02 . 1 . . . . A 17 ASN HD21 . 34994 1 787 . 2 . 2 20 20 ASN HD22 H 1 6.38 0.02 . 1 . . . . A 17 ASN HD22 . 34994 1 788 . 2 . 2 20 20 ASN C C 13 174.2 0.2 . 1 . . . . A 17 ASN C . 34994 1 789 . 2 . 2 20 20 ASN CA C 13 52.38 0.2 . 1 . . . . A 17 ASN CA . 34994 1 790 . 2 . 2 20 20 ASN CB C 13 39.86 0.2 . 1 . . . . A 17 ASN CB . 34994 1 791 . 2 . 2 20 20 ASN CG C 13 176.75 0.2 . 1 . . . . A 17 ASN CG . 34994 1 792 . 2 . 2 20 20 ASN N N 15 118.54 0.2 . 1 . . . . A 17 ASN N . 34994 1 793 . 2 . 2 20 20 ASN ND2 N 15 111.19 0.2 . 1 . . . . A 17 ASN ND2 . 34994 1 794 . 2 . 2 21 21 ASN H H 1 8.56 0.02 . 1 . . . . A 18 ASN H . 34994 1 795 . 2 . 2 21 21 ASN HA H 1 4.35 0.02 . 1 . . . . A 18 ASN HA . 34994 1 796 . 2 . 2 21 21 ASN HB2 H 1 2.39 0.02 . 2 . . . . A 18 ASN HB2 . 34994 1 797 . 2 . 2 21 21 ASN HB3 H 1 2.26 0.02 . 2 . . . . A 18 ASN HB3 . 34994 1 798 . 2 . 2 21 21 ASN HD21 H 1 7.33 0.02 . 1 . . . . A 18 ASN HD21 . 34994 1 799 . 2 . 2 21 21 ASN HD22 H 1 6.75 0.02 . 1 . . . . A 18 ASN HD22 . 34994 1 800 . 2 . 2 21 21 ASN C C 13 174.15 0.2 . 1 . . . . A 18 ASN C . 34994 1 801 . 2 . 2 21 21 ASN CA C 13 54.41 0.2 . 1 . . . . A 18 ASN CA . 34994 1 802 . 2 . 2 21 21 ASN CB C 13 37.78 0.2 . 1 . . . . A 18 ASN CB . 34994 1 803 . 2 . 2 21 21 ASN CG C 13 178.55 0.2 . 1 . . . . A 18 ASN CG . 34994 1 804 . 2 . 2 21 21 ASN N N 15 116.34 0.2 . 1 . . . . A 18 ASN N . 34994 1 805 . 2 . 2 21 21 ASN ND2 N 15 114.21 0.2 . 1 . . . . A 18 ASN ND2 . 34994 1 806 . 2 . 2 22 22 GLU H H 1 8.23 0.02 . 1 . . . . A 19 GLU H . 34994 1 807 . 2 . 2 22 22 GLU HA H 1 4.48 0.02 . 1 . . . . A 19 GLU HA . 34994 1 808 . 2 . 2 22 22 GLU HB2 H 1 2.21 0.02 . 2 . . . . A 19 GLU HB2 . 34994 1 809 . 2 . 2 22 22 GLU HB3 H 1 1.99 0.02 . 2 . . . . A 19 GLU HB3 . 34994 1 810 . 2 . 2 22 22 GLU HG2 H 1 1.97 0.02 . 2 . . . . A 19 GLU HG2 . 34994 1 811 . 2 . 2 22 22 GLU HG3 H 1 1.87 0.02 . 2 . . . . A 19 GLU HG3 . 34994 1 812 . 2 . 2 22 22 GLU C C 13 175.32 0.2 . 1 . . . . A 19 GLU C . 34994 1 813 . 2 . 2 22 22 GLU CA C 13 55.75 0.2 . 1 . . . . A 19 GLU CA . 34994 1 814 . 2 . 2 22 22 GLU CB C 13 32.25 0.2 . 1 . . . . A 19 GLU CB . 34994 1 815 . 2 . 2 22 22 GLU CG C 13 36.53 0.2 . 1 . . . . A 19 GLU CG . 34994 1 816 . 2 . 2 22 22 GLU N N 15 117.66 0.2 . 1 . . . . A 19 GLU N . 34994 1 817 . 2 . 2 23 23 LEU H H 1 9.24 0.02 . 1 . . . . A 20 LEU H . 34994 1 818 . 2 . 2 23 23 LEU HA H 1 4.52 0.02 . 1 . . . . A 20 LEU HA . 34994 1 819 . 2 . 2 23 23 LEU HB2 H 1 0.48 0.02 . 2 . . . . A 20 LEU HB2 . 34994 1 820 . 2 . 2 23 23 LEU HB3 H 1 1.76 0.02 . 2 . . . . A 20 LEU HB3 . 34994 1 821 . 2 . 2 23 23 LEU HG H 1 1.34 0.02 . 1 . . . . A 20 LEU HG . 34994 1 822 . 2 . 2 23 23 LEU HD11 H 1 0.67 0.02 . 2 . . . . A 20 LEU HD11 . 34994 1 823 . 2 . 2 23 23 LEU HD12 H 1 0.67 0.02 . 2 . . . . A 20 LEU HD12 . 34994 1 824 . 2 . 2 23 23 LEU HD13 H 1 0.67 0.02 . 2 . . . . A 20 LEU HD13 . 34994 1 825 . 2 . 2 23 23 LEU HD21 H 1 0.52 0.02 . 2 . . . . A 20 LEU HD21 . 34994 1 826 . 2 . 2 23 23 LEU HD22 H 1 0.52 0.02 . 2 . . . . A 20 LEU HD22 . 34994 1 827 . 2 . 2 23 23 LEU HD23 H 1 0.52 0.02 . 2 . . . . A 20 LEU HD23 . 34994 1 828 . 2 . 2 23 23 LEU C C 13 173.54 0.2 . 1 . . . . A 20 LEU C . 34994 1 829 . 2 . 2 23 23 LEU CA C 13 53.25 0.2 . 1 . . . . A 20 LEU CA . 34994 1 830 . 2 . 2 23 23 LEU CB C 13 44.97 0.2 . 1 . . . . A 20 LEU CB . 34994 1 831 . 2 . 2 23 23 LEU CG C 13 26.15 0.2 . 1 . . . . A 20 LEU CG . 34994 1 832 . 2 . 2 23 23 LEU CD1 C 13 23.6 0.2 . 2 . . . . A 20 LEU CD1 . 34994 1 833 . 2 . 2 23 23 LEU CD2 C 13 24.76 0.2 . 2 . . . . A 20 LEU CD2 . 34994 1 834 . 2 . 2 23 23 LEU N N 15 127.54 0.2 . 1 . . . . A 20 LEU N . 34994 1 835 . 2 . 2 24 24 THR H H 1 8.01 0.02 . 1 . . . . A 21 THR H . 34994 1 836 . 2 . 2 24 24 THR HA H 1 4.55 0.02 . 1 . . . . A 21 THR HA . 34994 1 837 . 2 . 2 24 24 THR HB H 1 4.08 0.02 . 1 . . . . A 21 THR HB . 34994 1 838 . 2 . 2 24 24 THR HG21 H 1 1.31 0.02 . 1 . . . . A 21 THR HG21 . 34994 1 839 . 2 . 2 24 24 THR HG22 H 1 1.31 0.02 . 1 . . . . A 21 THR HG22 . 34994 1 840 . 2 . 2 24 24 THR HG23 H 1 1.31 0.02 . 1 . . . . A 21 THR HG23 . 34994 1 841 . 2 . 2 24 24 THR C C 13 175.42 0.2 . 1 . . . . A 21 THR C . 34994 1 842 . 2 . 2 24 24 THR CA C 13 64.01 0.2 . 1 . . . . A 21 THR CA . 34994 1 843 . 2 . 2 24 24 THR CB C 13 69.64 0.2 . 1 . . . . A 21 THR CB . 34994 1 844 . 2 . 2 24 24 THR CG2 C 13 22.23 0.2 . 1 . . . . A 21 THR CG2 . 34994 1 845 . 2 . 2 24 24 THR N N 15 123.22 0.2 . 1 . . . . A 21 THR N . 34994 1 846 . 2 . 2 25 25 VAL H H 1 8.9 0.02 . 1 . . . . A 22 VAL H . 34994 1 847 . 2 . 2 25 25 VAL HA H 1 4.98 0.02 . 1 . . . . A 22 VAL HA . 34994 1 848 . 2 . 2 25 25 VAL HB H 1 2.21 0.02 . 1 . . . . A 22 VAL HB . 34994 1 849 . 2 . 2 25 25 VAL HG11 H 1 1.26 0.02 . 2 . . . . A 22 VAL HG11 . 34994 1 850 . 2 . 2 25 25 VAL HG12 H 1 1.26 0.02 . 2 . . . . A 22 VAL HG12 . 34994 1 851 . 2 . 2 25 25 VAL HG13 H 1 1.26 0.02 . 2 . . . . A 22 VAL HG13 . 34994 1 852 . 2 . 2 25 25 VAL HG21 H 1 0.93 0.02 . 2 . . . . A 22 VAL HG21 . 34994 1 853 . 2 . 2 25 25 VAL HG22 H 1 0.93 0.02 . 2 . . . . A 22 VAL HG22 . 34994 1 854 . 2 . 2 25 25 VAL HG23 H 1 0.93 0.02 . 2 . . . . A 22 VAL HG23 . 34994 1 855 . 2 . 2 25 25 VAL C C 13 174.55 0.2 . 1 . . . . A 22 VAL C . 34994 1 856 . 2 . 2 25 25 VAL CA C 13 59.03 0.2 . 1 . . . . A 22 VAL CA . 34994 1 857 . 2 . 2 25 25 VAL CB C 13 37.45 0.2 . 1 . . . . A 22 VAL CB . 34994 1 858 . 2 . 2 25 25 VAL CG1 C 13 20.99 0.2 . 2 . . . . A 22 VAL CG1 . 34994 1 859 . 2 . 2 25 25 VAL CG2 C 13 23.1 0.2 . 2 . . . . A 22 VAL CG2 . 34994 1 860 . 2 . 2 25 25 VAL N N 15 120.15 0.2 . 1 . . . . A 22 VAL N . 34994 1 861 . 2 . 2 26 26 ASN H H 1 9.31 0.02 . 1 . . . . A 23 ASN H . 34994 1 862 . 2 . 2 26 26 ASN HA H 1 5.44 0.02 . 1 . . . . A 23 ASN HA . 34994 1 863 . 2 . 2 26 26 ASN HB2 H 1 2.82 0.02 . 2 . . . . A 23 ASN HB2 . 34994 1 864 . 2 . 2 26 26 ASN HB3 H 1 2.54 0.02 . 2 . . . . A 23 ASN HB3 . 34994 1 865 . 2 . 2 26 26 ASN HD21 H 1 6.81 0.02 . 1 . . . . A 23 ASN HD21 . 34994 1 866 . 2 . 2 26 26 ASN HD22 H 1 7.54 0.02 . 1 . . . . A 23 ASN HD22 . 34994 1 867 . 2 . 2 26 26 ASN C C 13 174.14 0.2 . 1 . . . . A 23 ASN C . 34994 1 868 . 2 . 2 26 26 ASN CA C 13 51.71 0.2 . 1 . . . . A 23 ASN CA . 34994 1 869 . 2 . 2 26 26 ASN CB C 13 42.43 0.2 . 1 . . . . A 23 ASN CB . 34994 1 870 . 2 . 2 26 26 ASN CG C 13 177.32 0.2 . 1 . . . . A 23 ASN CG . 34994 1 871 . 2 . 2 26 26 ASN N N 15 120.34 0.2 . 1 . . . . A 23 ASN N . 34994 1 872 . 2 . 2 26 26 ASN ND2 N 15 112.85 0.2 . 1 . . . . A 23 ASN ND2 . 34994 1 873 . 2 . 2 27 27 GLU H H 1 9.18 0.02 . 1 . . . . A 24 GLU H . 34994 1 874 . 2 . 2 27 27 GLU HA H 1 3.32 0.02 . 1 . . . . A 24 GLU HA . 34994 1 875 . 2 . 2 27 27 GLU HB2 H 1 1.9 0.02 . 2 . . . . A 24 GLU HB2 . 34994 1 876 . 2 . 2 27 27 GLU HB3 H 1 1.84 0.02 . 2 . . . . A 24 GLU HB3 . 34994 1 877 . 2 . 2 27 27 GLU HG2 H 1 2.2 0.02 . 2 . . . . A 24 GLU HG2 . 34994 1 878 . 2 . 2 27 27 GLU HG3 H 1 1.96 0.02 . 2 . . . . A 24 GLU HG3 . 34994 1 879 . 2 . 2 27 27 GLU C C 13 176.97 0.2 . 1 . . . . A 24 GLU C . 34994 1 880 . 2 . 2 27 27 GLU CA C 13 58.57 0.2 . 1 . . . . A 24 GLU CA . 34994 1 881 . 2 . 2 27 27 GLU CB C 13 29.33 0.2 . 1 . . . . A 24 GLU CB . 34994 1 882 . 2 . 2 27 27 GLU CG C 13 35.34 0.2 . 1 . . . . A 24 GLU CG . 34994 1 883 . 2 . 2 27 27 GLU N N 15 121.13 0.2 . 1 . . . . A 24 GLU N . 34994 1 884 . 2 . 2 28 28 GLY H H 1 9.15 0.02 . 1 . . . . A 25 GLY H . 34994 1 885 . 2 . 2 28 28 GLY HA2 H 1 3.49 0.02 . 2 . . . . A 25 GLY HA2 . 34994 1 886 . 2 . 2 28 28 GLY HA3 H 1 4.39 0.02 . 2 . . . . A 25 GLY HA3 . 34994 1 887 . 2 . 2 28 28 GLY C C 13 174.25 0.2 . 1 . . . . A 25 GLY C . 34994 1 888 . 2 . 2 28 28 GLY CA C 13 44.94 0.2 . 1 . . . . A 25 GLY CA . 34994 1 889 . 2 . 2 28 28 GLY N N 15 115.53 0.2 . 1 . . . . A 25 GLY N . 34994 1 890 . 2 . 2 29 29 GLU H H 1 8.22 0.02 . 1 . . . . A 26 GLU H . 34994 1 891 . 2 . 2 29 29 GLU HA H 1 4.29 0.02 . 1 . . . . A 26 GLU HA . 34994 1 892 . 2 . 2 29 29 GLU HB2 H 1 2.09 0.02 . 2 . . . . A 26 GLU HB2 . 34994 1 893 . 2 . 2 29 29 GLU HB3 H 1 2.33 0.02 . 2 . . . . A 26 GLU HB3 . 34994 1 894 . 2 . 2 29 29 GLU HG2 H 1 2.42 0.02 . 2 . . . . A 26 GLU HG2 . 34994 1 895 . 2 . 2 29 29 GLU HG3 H 1 2.35 0.02 . 2 . . . . A 26 GLU HG3 . 34994 1 896 . 2 . 2 29 29 GLU C C 13 174.27 0.2 . 1 . . . . A 26 GLU C . 34994 1 897 . 2 . 2 29 29 GLU CA C 13 57.35 0.2 . 1 . . . . A 26 GLU CA . 34994 1 898 . 2 . 2 29 29 GLU CB C 13 31.81 0.2 . 1 . . . . A 26 GLU CB . 34994 1 899 . 2 . 2 29 29 GLU CG C 13 37.23 0.2 . 1 . . . . A 26 GLU CG . 34994 1 900 . 2 . 2 29 29 GLU N N 15 122.19 0.2 . 1 . . . . A 26 GLU N . 34994 1 901 . 2 . 2 30 30 ILE H H 1 8.43 0.02 . 1 . . . . A 27 ILE H . 34994 1 902 . 2 . 2 30 30 ILE HA H 1 5.2 0.02 . 1 . . . . A 27 ILE HA . 34994 1 903 . 2 . 2 30 30 ILE HB H 1 1.93 0.02 . 1 . . . . A 27 ILE HB . 34994 1 904 . 2 . 2 30 30 ILE HG12 H 1 1.54 0.02 . 2 . . . . A 27 ILE HG12 . 34994 1 905 . 2 . 2 30 30 ILE HG13 H 1 1.4 0.02 . 2 . . . . A 27 ILE HG13 . 34994 1 906 . 2 . 2 30 30 ILE HG21 H 1 0.85 0.02 . 1 . . . . A 27 ILE HG21 . 34994 1 907 . 2 . 2 30 30 ILE HG22 H 1 0.85 0.02 . 1 . . . . A 27 ILE HG22 . 34994 1 908 . 2 . 2 30 30 ILE HG23 H 1 0.85 0.02 . 1 . . . . A 27 ILE HG23 . 34994 1 909 . 2 . 2 30 30 ILE HD11 H 1 0.8 0.02 . 1 . . . . A 27 ILE HD11 . 34994 1 910 . 2 . 2 30 30 ILE HD12 H 1 0.8 0.02 . 1 . . . . A 27 ILE HD12 . 34994 1 911 . 2 . 2 30 30 ILE HD13 H 1 0.8 0.02 . 1 . . . . A 27 ILE HD13 . 34994 1 912 . 2 . 2 30 30 ILE C C 13 177.89 0.2 . 1 . . . . A 27 ILE C . 34994 1 913 . 2 . 2 30 30 ILE CA C 13 58.7 0.2 . 1 . . . . A 27 ILE CA . 34994 1 914 . 2 . 2 30 30 ILE CB C 13 37.57 0.2 . 1 . . . . A 27 ILE CB . 34994 1 915 . 2 . 2 30 30 ILE CG1 C 13 27.28 0.2 . 1 . . . . A 27 ILE CG1 . 34994 1 916 . 2 . 2 30 30 ILE CG2 C 13 17.6 0.2 . 1 . . . . A 27 ILE CG2 . 34994 1 917 . 2 . 2 30 30 ILE CD1 C 13 10.85 0.2 . 1 . . . . A 27 ILE CD1 . 34994 1 918 . 2 . 2 30 30 ILE N N 15 122.25 0.2 . 1 . . . . A 27 ILE N . 34994 1 919 . 2 . 2 31 31 ILE H H 1 9.17 0.02 . 1 . . . . A 28 ILE H . 34994 1 920 . 2 . 2 31 31 ILE HA H 1 4.96 0.02 . 1 . . . . A 28 ILE HA . 34994 1 921 . 2 . 2 31 31 ILE HB H 1 1.7 0.02 . 1 . . . . A 28 ILE HB . 34994 1 922 . 2 . 2 31 31 ILE HG12 H 1 1.22 0.02 . 2 . . . . A 28 ILE HG12 . 34994 1 923 . 2 . 2 31 31 ILE HG13 H 1 0.92 0.02 . 2 . . . . A 28 ILE HG13 . 34994 1 924 . 2 . 2 31 31 ILE HG21 H 1 0.78 0.02 . 1 . . . . A 28 ILE HG21 . 34994 1 925 . 2 . 2 31 31 ILE HG22 H 1 0.78 0.02 . 1 . . . . A 28 ILE HG22 . 34994 1 926 . 2 . 2 31 31 ILE HG23 H 1 0.78 0.02 . 1 . . . . A 28 ILE HG23 . 34994 1 927 . 2 . 2 31 31 ILE HD11 H 1 0.6 0.02 . 1 . . . . A 28 ILE HD11 . 34994 1 928 . 2 . 2 31 31 ILE HD12 H 1 0.6 0.02 . 1 . . . . A 28 ILE HD12 . 34994 1 929 . 2 . 2 31 31 ILE HD13 H 1 0.6 0.02 . 1 . . . . A 28 ILE HD13 . 34994 1 930 . 2 . 2 31 31 ILE C C 13 174.59 0.2 . 1 . . . . A 28 ILE C . 34994 1 931 . 2 . 2 31 31 ILE CA C 13 58.87 0.2 . 1 . . . . A 28 ILE CA . 34994 1 932 . 2 . 2 31 31 ILE CB C 13 41.58 0.2 . 1 . . . . A 28 ILE CB . 34994 1 933 . 2 . 2 31 31 ILE CG1 C 13 25.22 0.2 . 1 . . . . A 28 ILE CG1 . 34994 1 934 . 2 . 2 31 31 ILE CG2 C 13 17.48 0.2 . 1 . . . . A 28 ILE CG2 . 34994 1 935 . 2 . 2 31 31 ILE CD1 C 13 14.41 0.2 . 1 . . . . A 28 ILE CD1 . 34994 1 936 . 2 . 2 31 31 ILE N N 15 121.61 0.2 . 1 . . . . A 28 ILE N . 34994 1 937 . 2 . 2 32 32 THR H H 1 8.66 0.02 . 1 . . . . A 29 THR H . 34994 1 938 . 2 . 2 32 32 THR HA H 1 4.87 0.02 . 1 . . . . A 29 THR HA . 34994 1 939 . 2 . 2 32 32 THR HB H 1 3.92 0.02 . 1 . . . . A 29 THR HB . 34994 1 940 . 2 . 2 32 32 THR HG21 H 1 1.12 0.02 . 1 . . . . A 29 THR HG21 . 34994 1 941 . 2 . 2 32 32 THR HG22 H 1 1.12 0.02 . 1 . . . . A 29 THR HG22 . 34994 1 942 . 2 . 2 32 32 THR HG23 H 1 1.12 0.02 . 1 . . . . A 29 THR HG23 . 34994 1 943 . 2 . 2 32 32 THR C C 13 174.26 0.2 . 1 . . . . A 29 THR C . 34994 1 944 . 2 . 2 32 32 THR CA C 13 62.02 0.2 . 1 . . . . A 29 THR CA . 34994 1 945 . 2 . 2 32 32 THR CB C 13 70.36 0.2 . 1 . . . . A 29 THR CB . 34994 1 946 . 2 . 2 32 32 THR CG2 C 13 21.74 0.2 . 1 . . . . A 29 THR CG2 . 34994 1 947 . 2 . 2 32 32 THR N N 15 116.26 0.2 . 1 . . . . A 29 THR N . 34994 1 948 . 2 . 2 33 33 ILE H H 1 8.98 0.02 . 1 . . . . A 30 ILE H . 34994 1 949 . 2 . 2 33 33 ILE HA H 1 4.37 0.02 . 1 . . . . A 30 ILE HA . 34994 1 950 . 2 . 2 33 33 ILE HB H 1 1.92 0.02 . 1 . . . . A 30 ILE HB . 34994 1 951 . 2 . 2 33 33 ILE HG12 H 1 1.3 0.02 . 2 . . . . A 30 ILE HG12 . 34994 1 952 . 2 . 2 33 33 ILE HG13 H 1 1.13 0.02 . 2 . . . . A 30 ILE HG13 . 34994 1 953 . 2 . 2 33 33 ILE HG21 H 1 0.85 0.02 . 1 . . . . A 30 ILE HG21 . 34994 1 954 . 2 . 2 33 33 ILE HG22 H 1 0.85 0.02 . 1 . . . . A 30 ILE HG22 . 34994 1 955 . 2 . 2 33 33 ILE HG23 H 1 0.85 0.02 . 1 . . . . A 30 ILE HG23 . 34994 1 956 . 2 . 2 33 33 ILE HD11 H 1 0.66 0.02 . 1 . . . . A 30 ILE HD11 . 34994 1 957 . 2 . 2 33 33 ILE HD12 H 1 0.66 0.02 . 1 . . . . A 30 ILE HD12 . 34994 1 958 . 2 . 2 33 33 ILE HD13 H 1 0.66 0.02 . 1 . . . . A 30 ILE HD13 . 34994 1 959 . 2 . 2 33 33 ILE C C 13 175.98 0.2 . 1 . . . . A 30 ILE C . 34994 1 960 . 2 . 2 33 33 ILE CA C 13 60.14 0.2 . 1 . . . . A 30 ILE CA . 34994 1 961 . 2 . 2 33 33 ILE CB C 13 36.98 0.2 . 1 . . . . A 30 ILE CB . 34994 1 962 . 2 . 2 33 33 ILE CG1 C 13 26.77 0.2 . 1 . . . . A 30 ILE CG1 . 34994 1 963 . 2 . 2 33 33 ILE CG2 C 13 17.42 0.2 . 1 . . . . A 30 ILE CG2 . 34994 1 964 . 2 . 2 33 33 ILE CD1 C 13 12.14 0.2 . 1 . . . . A 30 ILE CD1 . 34994 1 965 . 2 . 2 33 33 ILE N N 15 126.22 0.2 . 1 . . . . A 30 ILE N . 34994 1 966 . 2 . 2 34 34 THR H H 1 8.95 0.02 . 1 . . . . A 31 THR H . 34994 1 967 . 2 . 2 34 34 THR HA H 1 4.4 0.02 . 1 . . . . A 31 THR HA . 34994 1 968 . 2 . 2 34 34 THR HB H 1 4.15 0.02 . 1 . . . . A 31 THR HB . 34994 1 969 . 2 . 2 34 34 THR HG21 H 1 1.01 0.02 . 1 . . . . A 31 THR HG21 . 34994 1 970 . 2 . 2 34 34 THR HG22 H 1 1.01 0.02 . 1 . . . . A 31 THR HG22 . 34994 1 971 . 2 . 2 34 34 THR HG23 H 1 1.01 0.02 . 1 . . . . A 31 THR HG23 . 34994 1 972 . 2 . 2 34 34 THR C C 13 176.48 0.2 . 1 . . . . A 31 THR C . 34994 1 973 . 2 . 2 34 34 THR CA C 13 62.77 0.2 . 1 . . . . A 31 THR CA . 34994 1 974 . 2 . 2 34 34 THR CB C 13 67.84 0.2 . 1 . . . . A 31 THR CB . 34994 1 975 . 2 . 2 34 34 THR CG2 C 13 23.35 0.2 . 1 . . . . A 31 THR CG2 . 34994 1 976 . 2 . 2 34 34 THR N N 15 121.38 0.2 . 1 . . . . A 31 THR N . 34994 1 977 . 2 . 2 35 35 ASN H H 1 7.43 0.02 . 1 . . . . A 32 ASN H . 34994 1 978 . 2 . 2 35 35 ASN HA H 1 4.95 0.02 . 1 . . . . A 32 ASN HA . 34994 1 979 . 2 . 2 35 35 ASN HB2 H 1 2.78 0.02 . 2 . . . . A 32 ASN HB2 . 34994 1 980 . 2 . 2 35 35 ASN HB3 H 1 2.74 0.02 . 2 . . . . A 32 ASN HB3 . 34994 1 981 . 2 . 2 35 35 ASN HD21 H 1 6.9 0.02 . 1 . . . . A 32 ASN HD21 . 34994 1 982 . 2 . 2 35 35 ASN HD22 H 1 7.58 0.02 . 1 . . . . A 32 ASN HD22 . 34994 1 983 . 2 . 2 35 35 ASN C C 13 173.58 0.2 . 1 . . . . A 32 ASN C . 34994 1 984 . 2 . 2 35 35 ASN CA C 13 51.6 0.2 . 1 . . . . A 32 ASN CA . 34994 1 985 . 2 . 2 35 35 ASN CB C 13 40.28 0.2 . 1 . . . . A 32 ASN CB . 34994 1 986 . 2 . 2 35 35 ASN CG C 13 176.55 0.2 . 1 . . . . A 32 ASN CG . 34994 1 987 . 2 . 2 35 35 ASN N N 15 117.99 0.2 . 1 . . . . A 32 ASN N . 34994 1 988 . 2 . 2 35 35 ASN ND2 N 15 111.56 0.2 . 1 . . . . A 32 ASN ND2 . 34994 1 989 . 2 . 2 36 36 PRO HA H 1 4.39 0.02 . 1 . . . . A 33 PRO HA . 34994 1 990 . 2 . 2 36 36 PRO HB2 H 1 2.19 0.02 . 2 . . . . A 33 PRO HB2 . 34994 1 991 . 2 . 2 36 36 PRO HB3 H 1 2.14 0.02 . 2 . . . . A 33 PRO HB3 . 34994 1 992 . 2 . 2 36 36 PRO HG2 H 1 2.01 0.02 . 2 . . . . A 33 PRO HG2 . 34994 1 993 . 2 . 2 36 36 PRO HG3 H 1 1.98 0.02 . 2 . . . . A 33 PRO HG3 . 34994 1 994 . 2 . 2 36 36 PRO HD2 H 1 3.89 0.02 . 2 . . . . A 33 PRO HD2 . 34994 1 995 . 2 . 2 36 36 PRO HD3 H 1 3.59 0.02 . 2 . . . . A 33 PRO HD3 . 34994 1 996 . 2 . 2 36 36 PRO C C 13 175.29 0.2 . 1 . . . . A 33 PRO C . 34994 1 997 . 2 . 2 36 36 PRO CA C 13 63.92 0.2 . 1 . . . . A 33 PRO CA . 34994 1 998 . 2 . 2 36 36 PRO CB C 13 32.56 0.2 . 1 . . . . A 33 PRO CB . 34994 1 999 . 2 . 2 36 36 PRO CG C 13 26.23 0.2 . 1 . . . . A 33 PRO CG . 34994 1 1000 . 2 . 2 36 36 PRO CD C 13 50.8 0.2 . 1 . . . . A 33 PRO CD . 34994 1 1001 . 2 . 2 36 36 PRO N N 15 134.55 0.2 . 1 . . . . A 33 PRO N . 34994 1 1002 . 2 . 2 37 37 ASP H H 1 7.95 0.02 . 1 . . . . A 34 ASP H . 34994 1 1003 . 2 . 2 37 37 ASP HA H 1 4.84 0.02 . 1 . . . . A 34 ASP HA . 34994 1 1004 . 2 . 2 37 37 ASP HB2 H 1 2.77 0.02 . 2 . . . . A 34 ASP HB2 . 34994 1 1005 . 2 . 2 37 37 ASP HB3 H 1 2.66 0.02 . 2 . . . . A 34 ASP HB3 . 34994 1 1006 . 2 . 2 37 37 ASP C C 13 175.09 0.2 . 1 . . . . A 34 ASP C . 34994 1 1007 . 2 . 2 37 37 ASP CA C 13 54.69 0.2 . 1 . . . . A 34 ASP CA . 34994 1 1008 . 2 . 2 37 37 ASP CB C 13 41.25 0.2 . 1 . . . . A 34 ASP CB . 34994 1 1009 . 2 . 2 37 37 ASP N N 15 117.36 0.2 . 1 . . . . A 34 ASP N . 34994 1 1010 . 2 . 2 38 38 VAL H H 1 7.83 0.02 . 1 . . . . A 35 VAL H . 34994 1 1011 . 2 . 2 38 38 VAL HA H 1 4.12 0.02 . 1 . . . . A 35 VAL HA . 34994 1 1012 . 2 . 2 38 38 VAL HB H 1 2.22 0.02 . 1 . . . . A 35 VAL HB . 34994 1 1013 . 2 . 2 38 38 VAL HG11 H 1 0.92 0.02 . 2 . . . . A 35 VAL HG11 . 34994 1 1014 . 2 . 2 38 38 VAL HG12 H 1 0.92 0.02 . 2 . . . . A 35 VAL HG12 . 34994 1 1015 . 2 . 2 38 38 VAL HG13 H 1 0.92 0.02 . 2 . . . . A 35 VAL HG13 . 34994 1 1016 . 2 . 2 38 38 VAL HG21 H 1 0.87 0.02 . 2 . . . . A 35 VAL HG21 . 34994 1 1017 . 2 . 2 38 38 VAL HG22 H 1 0.87 0.02 . 2 . . . . A 35 VAL HG22 . 34994 1 1018 . 2 . 2 38 38 VAL HG23 H 1 0.87 0.02 . 2 . . . . A 35 VAL HG23 . 34994 1 1019 . 2 . 2 38 38 VAL C C 13 176.09 0.2 . 1 . . . . A 35 VAL C . 34994 1 1020 . 2 . 2 38 38 VAL CA C 13 62.62 0.2 . 1 . . . . A 35 VAL CA . 34994 1 1021 . 2 . 2 38 38 VAL CB C 13 31.85 0.2 . 1 . . . . A 35 VAL CB . 34994 1 1022 . 2 . 2 38 38 VAL CG1 C 13 21.71 0.2 . 2 . . . . A 35 VAL CG1 . 34994 1 1023 . 2 . 2 38 38 VAL CG2 C 13 21.75 0.2 . 2 . . . . A 35 VAL CG2 . 34994 1 1024 . 2 . 2 38 38 VAL N N 15 120.06 0.2 . 1 . . . . A 35 VAL N . 34994 1 1025 . 2 . 2 39 39 GLY H H 1 8.23 0.02 . 1 . . . . A 36 GLY H . 34994 1 1026 . 2 . 2 39 39 GLY HA2 H 1 4.51 0.02 . 2 . . . . A 36 GLY HA2 . 34994 1 1027 . 2 . 2 39 39 GLY HA3 H 1 3.9 0.02 . 2 . . . . A 36 GLY HA3 . 34994 1 1028 . 2 . 2 39 39 GLY C C 13 174.89 0.2 . 1 . . . . A 36 GLY C . 34994 1 1029 . 2 . 2 39 39 GLY CA C 13 44.18 0.2 . 1 . . . . A 36 GLY CA . 34994 1 1030 . 2 . 2 39 39 GLY N N 15 109.83 0.2 . 1 . . . . A 36 GLY N . 34994 1 1031 . 2 . 2 40 40 GLY H H 1 8.54 0.02 . 1 . . . . A 37 GLY H . 34994 1 1032 . 2 . 2 40 40 GLY HA2 H 1 4.08 0.02 . 2 . . . . A 37 GLY HA2 . 34994 1 1033 . 2 . 2 40 40 GLY HA3 H 1 3.93 0.02 . 2 . . . . A 37 GLY HA3 . 34994 1 1034 . 2 . 2 40 40 GLY C C 13 174.35 0.2 . 1 . . . . A 37 GLY C . 34994 1 1035 . 2 . 2 40 40 GLY CA C 13 47.35 0.2 . 1 . . . . A 37 GLY CA . 34994 1 1036 . 2 . 2 40 40 GLY N N 15 105.96 0.2 . 1 . . . . A 37 GLY N . 34994 1 1037 . 2 . 2 41 41 GLY H H 1 8.63 0.02 . 1 . . . . A 38 GLY H . 34994 1 1038 . 2 . 2 41 41 GLY HA2 H 1 4.05 0.02 . 2 . . . . A 38 GLY HA2 . 34994 1 1039 . 2 . 2 41 41 GLY HA3 H 1 3.63 0.02 . 2 . . . . A 38 GLY HA3 . 34994 1 1040 . 2 . 2 41 41 GLY C C 13 174.57 0.2 . 1 . . . . A 38 GLY C . 34994 1 1041 . 2 . 2 41 41 GLY CA C 13 44.88 0.2 . 1 . . . . A 38 GLY CA . 34994 1 1042 . 2 . 2 41 41 GLY N N 15 105.87 0.2 . 1 . . . . A 38 GLY N . 34994 1 1043 . 2 . 2 42 42 TRP H H 1 7.53 0.02 . 1 . . . . A 39 TRP H . 34994 1 1044 . 2 . 2 42 42 TRP HA H 1 4.98 0.02 . 1 . . . . A 39 TRP HA . 34994 1 1045 . 2 . 2 42 42 TRP HB2 H 1 3.21 0.02 . 2 . . . . A 39 TRP HB2 . 34994 1 1046 . 2 . 2 42 42 TRP HB3 H 1 3.08 0.02 . 2 . . . . A 39 TRP HB3 . 34994 1 1047 . 2 . 2 42 42 TRP HD1 H 1 7.42 0.02 . 1 . . . . A 39 TRP HD1 . 34994 1 1048 . 2 . 2 42 42 TRP HE1 H 1 10.58 0.02 . 1 . . . . A 39 TRP HE1 . 34994 1 1049 . 2 . 2 42 42 TRP HE3 H 1 7.1 0.02 . 1 . . . . A 39 TRP HE3 . 34994 1 1050 . 2 . 2 42 42 TRP HZ2 H 1 7.21 0.02 . 1 . . . . A 39 TRP HZ2 . 34994 1 1051 . 2 . 2 42 42 TRP HZ3 H 1 6.49 0.02 . 1 . . . . A 39 TRP HZ3 . 34994 1 1052 . 2 . 2 42 42 TRP HH2 H 1 7.1 0.02 . 1 . . . . A 39 TRP HH2 . 34994 1 1053 . 2 . 2 42 42 TRP C C 13 174.68 0.2 . 1 . . . . A 39 TRP C . 34994 1 1054 . 2 . 2 42 42 TRP CA C 13 56.59 0.2 . 1 . . . . A 39 TRP CA . 34994 1 1055 . 2 . 2 42 42 TRP CB C 13 32.95 0.2 . 1 . . . . A 39 TRP CB . 34994 1 1056 . 2 . 2 42 42 TRP CD1 C 13 129.58 0.2 . 1 . . . . A 39 TRP CD1 . 34994 1 1057 . 2 . 2 42 42 TRP CE3 C 13 120.32 0.2 . 1 . . . . A 39 TRP CE3 . 34994 1 1058 . 2 . 2 42 42 TRP CZ2 C 13 114.5 0.2 . 1 . . . . A 39 TRP CZ2 . 34994 1 1059 . 2 . 2 42 42 TRP CZ3 C 13 120.45 0.2 . 1 . . . . A 39 TRP CZ3 . 34994 1 1060 . 2 . 2 42 42 TRP CH2 C 13 123.63 0.2 . 1 . . . . A 39 TRP CH2 . 34994 1 1061 . 2 . 2 42 42 TRP N N 15 120.88 0.2 . 1 . . . . A 39 TRP N . 34994 1 1062 . 2 . 2 42 42 TRP NE1 N 15 129.57 0.2 . 1 . . . . A 39 TRP NE1 . 34994 1 1063 . 2 . 2 43 43 LEU H H 1 9.22 0.02 . 1 . . . . A 40 LEU H . 34994 1 1064 . 2 . 2 43 43 LEU HA H 1 4.69 0.02 . 1 . . . . A 40 LEU HA . 34994 1 1065 . 2 . 2 43 43 LEU HB2 H 1 1.94 0.02 . 2 . . . . A 40 LEU HB2 . 34994 1 1066 . 2 . 2 43 43 LEU HB3 H 1 1.89 0.02 . 2 . . . . A 40 LEU HB3 . 34994 1 1067 . 2 . 2 43 43 LEU HG H 1 1.85 0.02 . 1 . . . . A 40 LEU HG . 34994 1 1068 . 2 . 2 43 43 LEU HD11 H 1 0.83 0.02 . 2 . . . . A 40 LEU HD11 . 34994 1 1069 . 2 . 2 43 43 LEU HD12 H 1 0.83 0.02 . 2 . . . . A 40 LEU HD12 . 34994 1 1070 . 2 . 2 43 43 LEU HD13 H 1 0.83 0.02 . 2 . . . . A 40 LEU HD13 . 34994 1 1071 . 2 . 2 43 43 LEU HD21 H 1 0.67 0.02 . 2 . . . . A 40 LEU HD21 . 34994 1 1072 . 2 . 2 43 43 LEU HD22 H 1 0.67 0.02 . 2 . . . . A 40 LEU HD22 . 34994 1 1073 . 2 . 2 43 43 LEU HD23 H 1 0.67 0.02 . 2 . . . . A 40 LEU HD23 . 34994 1 1074 . 2 . 2 43 43 LEU C C 13 174.49 0.2 . 1 . . . . A 40 LEU C . 34994 1 1075 . 2 . 2 43 43 LEU CA C 13 53.91 0.2 . 1 . . . . A 40 LEU CA . 34994 1 1076 . 2 . 2 43 43 LEU CB C 13 44.12 0.2 . 1 . . . . A 40 LEU CB . 34994 1 1077 . 2 . 2 43 43 LEU CG C 13 25.37 0.2 . 1 . . . . A 40 LEU CG . 34994 1 1078 . 2 . 2 43 43 LEU CD1 C 13 27.47 0.2 . 2 . . . . A 40 LEU CD1 . 34994 1 1079 . 2 . 2 43 43 LEU CD2 C 13 24.55 0.2 . 2 . . . . A 40 LEU CD2 . 34994 1 1080 . 2 . 2 43 43 LEU N N 15 118.9 0.2 . 1 . . . . A 40 LEU N . 34994 1 1081 . 2 . 2 44 44 GLU H H 1 8.88 0.02 . 1 . . . . A 41 GLU H . 34994 1 1082 . 2 . 2 44 44 GLU HA H 1 4.96 0.02 . 1 . . . . A 41 GLU HA . 34994 1 1083 . 2 . 2 44 44 GLU HB2 H 1 2.11 0.02 . 2 . . . . A 41 GLU HB2 . 34994 1 1084 . 2 . 2 44 44 GLU HB3 H 1 1.75 0.02 . 2 . . . . A 41 GLU HB3 . 34994 1 1085 . 2 . 2 44 44 GLU HG2 H 1 2.16 0.02 . 2 . . . . A 41 GLU HG2 . 34994 1 1086 . 2 . 2 44 44 GLU HG3 H 1 2 0.02 . 2 . . . . A 41 GLU HG3 . 34994 1 1087 . 2 . 2 44 44 GLU C C 13 175.01 0.2 . 1 . . . . A 41 GLU C . 34994 1 1088 . 2 . 2 44 44 GLU CA C 13 55.34 0.2 . 1 . . . . A 41 GLU CA . 34994 1 1089 . 2 . 2 44 44 GLU CB C 13 33.76 0.2 . 1 . . . . A 41 GLU CB . 34994 1 1090 . 2 . 2 44 44 GLU CG C 13 38.14 0.2 . 1 . . . . A 41 GLU CG . 34994 1 1091 . 2 . 2 44 44 GLU N N 15 120.86 0.2 . 1 . . . . A 41 GLU N . 34994 1 1092 . 2 . 2 45 45 GLY H H 1 9.11 0.02 . 1 . . . . A 42 GLY H . 34994 1 1093 . 2 . 2 45 45 GLY HA2 H 1 5.35 0.02 . 2 . . . . A 42 GLY HA2 . 34994 1 1094 . 2 . 2 45 45 GLY HA3 H 1 3.34 0.02 . 2 . . . . A 42 GLY HA3 . 34994 1 1095 . 2 . 2 45 45 GLY C C 13 171.06 0.2 . 1 . . . . A 42 GLY C . 34994 1 1096 . 2 . 2 45 45 GLY CA C 13 44.34 0.2 . 1 . . . . A 42 GLY CA . 34994 1 1097 . 2 . 2 45 45 GLY N N 15 114.15 0.2 . 1 . . . . A 42 GLY N . 34994 1 1098 . 2 . 2 46 46 ARG H H 1 8.96 0.02 . 1 . . . . A 43 ARG H . 34994 1 1099 . 2 . 2 46 46 ARG HA H 1 5.66 0.02 . 1 . . . . A 43 ARG HA . 34994 1 1100 . 2 . 2 46 46 ARG HB2 H 1 1.63 0.02 . 2 . . . . A 43 ARG HB2 . 34994 1 1101 . 2 . 2 46 46 ARG HB3 H 1 1.48 0.02 . 2 . . . . A 43 ARG HB3 . 34994 1 1102 . 2 . 2 46 46 ARG HG2 H 1 1.77 0.02 . 2 . . . . A 43 ARG HG2 . 34994 1 1103 . 2 . 2 46 46 ARG HG3 H 1 1.36 0.02 . 2 . . . . A 43 ARG HG3 . 34994 1 1104 . 2 . 2 46 46 ARG HD2 H 1 3.13 0.02 . 2 . . . . A 43 ARG HD2 . 34994 1 1105 . 2 . 2 46 46 ARG HD3 H 1 3.1 0.02 . 2 . . . . A 43 ARG HD3 . 34994 1 1106 . 2 . 2 46 46 ARG C C 13 176.96 0.2 . 1 . . . . A 43 ARG C . 34994 1 1107 . 2 . 2 46 46 ARG CA C 13 54.02 0.2 . 1 . . . . A 43 ARG CA . 34994 1 1108 . 2 . 2 46 46 ARG CB C 13 34.72 0.2 . 1 . . . . A 43 ARG CB . 34994 1 1109 . 2 . 2 46 46 ARG CG C 13 27.11 0.2 . 1 . . . . A 43 ARG CG . 34994 1 1110 . 2 . 2 46 46 ARG CD C 13 43.92 0.2 . 1 . . . . A 43 ARG CD . 34994 1 1111 . 2 . 2 46 46 ARG N N 15 117.7 0.2 . 1 . . . . A 43 ARG N . 34994 1 1112 . 2 . 2 47 47 ASN H H 1 8.79 0.02 . 1 . . . . A 44 ASN H . 34994 1 1113 . 2 . 2 47 47 ASN HA H 1 5.04 0.02 . 1 . . . . A 44 ASN HA . 34994 1 1114 . 2 . 2 47 47 ASN HB2 H 1 3.84 0.02 . 2 . . . . A 44 ASN HB2 . 34994 1 1115 . 2 . 2 47 47 ASN HB3 H 1 2.88 0.02 . 2 . . . . A 44 ASN HB3 . 34994 1 1116 . 2 . 2 47 47 ASN HD21 H 1 9.08 0.02 . 1 . . . . A 44 ASN HD21 . 34994 1 1117 . 2 . 2 47 47 ASN HD22 H 1 7.87 0.02 . 1 . . . . A 44 ASN HD22 . 34994 1 1118 . 2 . 2 47 47 ASN C C 13 178.21 0.2 . 1 . . . . A 44 ASN C . 34994 1 1119 . 2 . 2 47 47 ASN CA C 13 51.52 0.2 . 1 . . . . A 44 ASN CA . 34994 1 1120 . 2 . 2 47 47 ASN CB C 13 39.81 0.2 . 1 . . . . A 44 ASN CB . 34994 1 1121 . 2 . 2 47 47 ASN CG C 13 176.41 0.2 . 1 . . . . A 44 ASN CG . 34994 1 1122 . 2 . 2 47 47 ASN N N 15 125.13 0.2 . 1 . . . . A 44 ASN N . 34994 1 1123 . 2 . 2 47 47 ASN ND2 N 15 115.18 0.2 . 1 . . . . A 44 ASN ND2 . 34994 1 1124 . 2 . 2 48 48 ILE H H 1 9.15 0.02 . 1 . . . . A 45 ILE H . 34994 1 1125 . 2 . 2 48 48 ILE HA H 1 4.14 0.02 . 1 . . . . A 45 ILE HA . 34994 1 1126 . 2 . 2 48 48 ILE HB H 1 2.11 0.02 . 1 . . . . A 45 ILE HB . 34994 1 1127 . 2 . 2 48 48 ILE HG12 H 1 1.53 0.02 . 2 . . . . A 45 ILE HG12 . 34994 1 1128 . 2 . 2 48 48 ILE HG13 H 1 1.46 0.02 . 2 . . . . A 45 ILE HG13 . 34994 1 1129 . 2 . 2 48 48 ILE HG21 H 1 1.07 0.02 . 1 . . . . A 45 ILE HG21 . 34994 1 1130 . 2 . 2 48 48 ILE HG22 H 1 1.07 0.02 . 1 . . . . A 45 ILE HG22 . 34994 1 1131 . 2 . 2 48 48 ILE HG23 H 1 1.07 0.02 . 1 . . . . A 45 ILE HG23 . 34994 1 1132 . 2 . 2 48 48 ILE HD11 H 1 0.98 0.02 . 1 . . . . A 45 ILE HD11 . 34994 1 1133 . 2 . 2 48 48 ILE HD12 H 1 0.98 0.02 . 1 . . . . A 45 ILE HD12 . 34994 1 1134 . 2 . 2 48 48 ILE HD13 H 1 0.98 0.02 . 1 . . . . A 45 ILE HD13 . 34994 1 1135 . 2 . 2 48 48 ILE C C 13 176.96 0.2 . 1 . . . . A 45 ILE C . 34994 1 1136 . 2 . 2 48 48 ILE CA C 13 63.53 0.2 . 1 . . . . A 45 ILE CA . 34994 1 1137 . 2 . 2 48 48 ILE CB C 13 38.58 0.2 . 1 . . . . A 45 ILE CB . 34994 1 1138 . 2 . 2 48 48 ILE CG1 C 13 28.32 0.2 . 1 . . . . A 45 ILE CG1 . 34994 1 1139 . 2 . 2 48 48 ILE CG2 C 13 17.91 0.2 . 1 . . . . A 45 ILE CG2 . 34994 1 1140 . 2 . 2 48 48 ILE CD1 C 13 14.13 0.2 . 1 . . . . A 45 ILE CD1 . 34994 1 1141 . 2 . 2 48 48 ILE N N 15 118.37 0.2 . 1 . . . . A 45 ILE N . 34994 1 1142 . 2 . 2 49 49 LYS H H 1 7.31 0.02 . 1 . . . . A 46 LYS H . 34994 1 1143 . 2 . 2 49 49 LYS HA H 1 4.32 0.02 . 1 . . . . A 46 LYS HA . 34994 1 1144 . 2 . 2 49 49 LYS HB2 H 1 2.04 0.02 . 2 . . . . A 46 LYS HB2 . 34994 1 1145 . 2 . 2 49 49 LYS HB3 H 1 1.82 0.02 . 2 . . . . A 46 LYS HB3 . 34994 1 1146 . 2 . 2 49 49 LYS HG2 H 1 1.46 0.02 . 1 . . . . A 46 LYS HG2 . 34994 1 1147 . 2 . 2 49 49 LYS HG3 H 1 1.46 0.02 . 1 . . . . A 46 LYS HG3 . 34994 1 1148 . 2 . 2 49 49 LYS HD2 H 1 1.69 0.02 . 1 . . . . A 46 LYS HD2 . 34994 1 1149 . 2 . 2 49 49 LYS HD3 H 1 1.69 0.02 . 1 . . . . A 46 LYS HD3 . 34994 1 1150 . 2 . 2 49 49 LYS HE2 H 1 2.97 0.02 . 1 . . . . A 46 LYS HE2 . 34994 1 1151 . 2 . 2 49 49 LYS HE3 H 1 2.97 0.02 . 1 . . . . A 46 LYS HE3 . 34994 1 1152 . 2 . 2 49 49 LYS C C 13 176.88 0.2 . 1 . . . . A 46 LYS C . 34994 1 1153 . 2 . 2 49 49 LYS CA C 13 56.53 0.2 . 1 . . . . A 46 LYS CA . 34994 1 1154 . 2 . 2 49 49 LYS CB C 13 32.56 0.2 . 1 . . . . A 46 LYS CB . 34994 1 1155 . 2 . 2 49 49 LYS CG C 13 25.49 0.2 . 1 . . . . A 46 LYS CG . 34994 1 1156 . 2 . 2 49 49 LYS CD C 13 29.31 0.2 . 1 . . . . A 46 LYS CD . 34994 1 1157 . 2 . 2 49 49 LYS CE C 13 42.02 0.2 . 1 . . . . A 46 LYS CE . 34994 1 1158 . 2 . 2 49 49 LYS N N 15 119.84 0.2 . 1 . . . . A 46 LYS N . 34994 1 1159 . 2 . 2 50 50 GLY H H 1 8.19 0.02 . 1 . . . . A 47 GLY H . 34994 1 1160 . 2 . 2 50 50 GLY HA2 H 1 3.5 0.02 . 2 . . . . A 47 GLY HA2 . 34994 1 1161 . 2 . 2 50 50 GLY HA3 H 1 4.33 0.02 . 2 . . . . A 47 GLY HA3 . 34994 1 1162 . 2 . 2 50 50 GLY C C 13 174.47 0.2 . 1 . . . . A 47 GLY C . 34994 1 1163 . 2 . 2 50 50 GLY CA C 13 45 0.2 . 1 . . . . A 47 GLY CA . 34994 1 1164 . 2 . 2 50 50 GLY N N 15 107.34 0.2 . 1 . . . . A 47 GLY N . 34994 1 1165 . 2 . 2 51 51 GLU H H 1 8.09 0.02 . 1 . . . . A 48 GLU H . 34994 1 1166 . 2 . 2 51 51 GLU HA H 1 4.24 0.02 . 1 . . . . A 48 GLU HA . 34994 1 1167 . 2 . 2 51 51 GLU HB2 H 1 2.01 0.02 . 2 . . . . A 48 GLU HB2 . 34994 1 1168 . 2 . 2 51 51 GLU HB3 H 1 1.9 0.02 . 2 . . . . A 48 GLU HB3 . 34994 1 1169 . 2 . 2 51 51 GLU HG2 H 1 2.19 0.02 . 1 . . . . A 48 GLU HG2 . 34994 1 1170 . 2 . 2 51 51 GLU HG3 H 1 2.19 0.02 . 1 . . . . A 48 GLU HG3 . 34994 1 1171 . 2 . 2 51 51 GLU C C 13 174.61 0.2 . 1 . . . . A 48 GLU C . 34994 1 1172 . 2 . 2 51 51 GLU CA C 13 56.1 0.2 . 1 . . . . A 48 GLU CA . 34994 1 1173 . 2 . 2 51 51 GLU CB C 13 29.92 0.2 . 1 . . . . A 48 GLU CB . 34994 1 1174 . 2 . 2 51 51 GLU CG C 13 36.49 0.2 . 1 . . . . A 48 GLU CG . 34994 1 1175 . 2 . 2 51 51 GLU N N 15 123.12 0.2 . 1 . . . . A 48 GLU N . 34994 1 1176 . 2 . 2 52 52 ARG H H 1 8.37 0.02 . 1 . . . . A 49 ARG H . 34994 1 1177 . 2 . 2 52 52 ARG HA H 1 5.69 0.02 . 1 . . . . A 49 ARG HA . 34994 1 1178 . 2 . 2 52 52 ARG HB2 H 1 1.81 0.02 . 2 . . . . A 49 ARG HB2 . 34994 1 1179 . 2 . 2 52 52 ARG HB3 H 1 1.64 0.02 . 2 . . . . A 49 ARG HB3 . 34994 1 1180 . 2 . 2 52 52 ARG HG2 H 1 1.45 0.02 . 2 . . . . A 49 ARG HG2 . 34994 1 1181 . 2 . 2 52 52 ARG HG3 H 1 1.63 0.02 . 2 . . . . A 49 ARG HG3 . 34994 1 1182 . 2 . 2 52 52 ARG HD2 H 1 3.23 0.02 . 2 . . . . A 49 ARG HD2 . 34994 1 1183 . 2 . 2 52 52 ARG HD3 H 1 3.12 0.02 . 2 . . . . A 49 ARG HD3 . 34994 1 1184 . 2 . 2 52 52 ARG C C 13 176.07 0.2 . 1 . . . . A 49 ARG C . 34994 1 1185 . 2 . 2 52 52 ARG CA C 13 53.7 0.2 . 1 . . . . A 49 ARG CA . 34994 1 1186 . 2 . 2 52 52 ARG CB C 13 35.2 0.2 . 1 . . . . A 49 ARG CB . 34994 1 1187 . 2 . 2 52 52 ARG CG C 13 27.21 0.2 . 1 . . . . A 49 ARG CG . 34994 1 1188 . 2 . 2 52 52 ARG CD C 13 43.95 0.2 . 1 . . . . A 49 ARG CD . 34994 1 1189 . 2 . 2 52 52 ARG N N 15 121.29 0.2 . 1 . . . . A 49 ARG N . 34994 1 1190 . 2 . 2 53 53 GLY H H 1 8.68 0.02 . 1 . . . . A 50 GLY H . 34994 1 1191 . 2 . 2 53 53 GLY HA2 H 1 3.85 0.02 . 1 . . . . A 50 GLY HA2 . 34994 1 1192 . 2 . 2 53 53 GLY HA3 H 1 3.85 0.02 . 1 . . . . A 50 GLY HA3 . 34994 1 1193 . 2 . 2 53 53 GLY C C 13 170.6 0.2 . 1 . . . . A 50 GLY C . 34994 1 1194 . 2 . 2 53 53 GLY CA C 13 45.63 0.2 . 1 . . . . A 50 GLY CA . 34994 1 1195 . 2 . 2 53 53 GLY N N 15 108.02 0.2 . 1 . . . . A 50 GLY N . 34994 1 1196 . 2 . 2 54 54 LEU H H 1 9.07 0.02 . 1 . . . . A 51 LEU H . 34994 1 1197 . 2 . 2 54 54 LEU HA H 1 5.32 0.02 . 1 . . . . A 51 LEU HA . 34994 1 1198 . 2 . 2 54 54 LEU HB2 H 1 1.31 0.02 . 2 . . . . A 51 LEU HB2 . 34994 1 1199 . 2 . 2 54 54 LEU HB3 H 1 1.17 0.02 . 2 . . . . A 51 LEU HB3 . 34994 1 1200 . 2 . 2 54 54 LEU HG H 1 1.56 0.02 . 1 . . . . A 51 LEU HG . 34994 1 1201 . 2 . 2 54 54 LEU HD11 H 1 0.67 0.02 . 2 . . . . A 51 LEU HD11 . 34994 1 1202 . 2 . 2 54 54 LEU HD12 H 1 0.67 0.02 . 2 . . . . A 51 LEU HD12 . 34994 1 1203 . 2 . 2 54 54 LEU HD13 H 1 0.67 0.02 . 2 . . . . A 51 LEU HD13 . 34994 1 1204 . 2 . 2 54 54 LEU HD21 H 1 0.21 0.02 . 2 . . . . A 51 LEU HD21 . 34994 1 1205 . 2 . 2 54 54 LEU HD22 H 1 0.21 0.02 . 2 . . . . A 51 LEU HD22 . 34994 1 1206 . 2 . 2 54 54 LEU HD23 H 1 0.21 0.02 . 2 . . . . A 51 LEU HD23 . 34994 1 1207 . 2 . 2 54 54 LEU C C 13 176.53 0.2 . 1 . . . . A 51 LEU C . 34994 1 1208 . 2 . 2 54 54 LEU CA C 13 54.69 0.2 . 1 . . . . A 51 LEU CA . 34994 1 1209 . 2 . 2 54 54 LEU CB C 13 43.33 0.2 . 1 . . . . A 51 LEU CB . 34994 1 1210 . 2 . 2 54 54 LEU CG C 13 26.61 0.2 . 1 . . . . A 51 LEU CG . 34994 1 1211 . 2 . 2 54 54 LEU CD1 C 13 23.73 0.2 . 2 . . . . A 51 LEU CD1 . 34994 1 1212 . 2 . 2 54 54 LEU CD2 C 13 24.92 0.2 . 2 . . . . A 51 LEU CD2 . 34994 1 1213 . 2 . 2 54 54 LEU N N 15 119.55 0.2 . 1 . . . . A 51 LEU N . 34994 1 1214 . 2 . 2 55 55 VAL H H 1 9.01 0.02 . 1 . . . . A 52 VAL H . 34994 1 1215 . 2 . 2 55 55 VAL HA H 1 4.45 0.02 . 1 . . . . A 52 VAL HA . 34994 1 1216 . 2 . 2 55 55 VAL HB H 1 1.63 0.02 . 1 . . . . A 52 VAL HB . 34994 1 1217 . 2 . 2 55 55 VAL HG11 H 1 0.95 0.02 . 2 . . . . A 52 VAL HG11 . 34994 1 1218 . 2 . 2 55 55 VAL HG12 H 1 0.95 0.02 . 2 . . . . A 52 VAL HG12 . 34994 1 1219 . 2 . 2 55 55 VAL HG13 H 1 0.95 0.02 . 2 . . . . A 52 VAL HG13 . 34994 1 1220 . 2 . 2 55 55 VAL HG21 H 1 0.81 0.02 . 2 . . . . A 52 VAL HG21 . 34994 1 1221 . 2 . 2 55 55 VAL HG22 H 1 0.81 0.02 . 2 . . . . A 52 VAL HG22 . 34994 1 1222 . 2 . 2 55 55 VAL HG23 H 1 0.81 0.02 . 2 . . . . A 52 VAL HG23 . 34994 1 1223 . 2 . 2 55 55 VAL C C 13 173.38 0.2 . 1 . . . . A 52 VAL C . 34994 1 1224 . 2 . 2 55 55 VAL CA C 13 58.74 0.2 . 1 . . . . A 52 VAL CA . 34994 1 1225 . 2 . 2 55 55 VAL CB C 13 37.75 0.2 . 1 . . . . A 52 VAL CB . 34994 1 1226 . 2 . 2 55 55 VAL CG1 C 13 22.34 0.2 . 2 . . . . A 52 VAL CG1 . 34994 1 1227 . 2 . 2 55 55 VAL CG2 C 13 21.21 0.2 . 2 . . . . A 52 VAL CG2 . 34994 1 1228 . 2 . 2 55 55 VAL N N 15 120.19 0.2 . 1 . . . . A 52 VAL N . 34994 1 1229 . 2 . 2 56 56 PRO HA H 1 3.99 0.02 . 1 . . . . A 53 PRO HA . 34994 1 1230 . 2 . 2 56 56 PRO HB2 H 1 1.47 0.02 . 2 . . . . A 53 PRO HB2 . 34994 1 1231 . 2 . 2 56 56 PRO HB3 H 1 1.4 0.02 . 2 . . . . A 53 PRO HB3 . 34994 1 1232 . 2 . 2 56 56 PRO HG2 H 1 0.2 0.02 . 2 . . . . A 53 PRO HG2 . 34994 1 1233 . 2 . 2 56 56 PRO HG3 H 1 0.07 0.02 . 2 . . . . A 53 PRO HG3 . 34994 1 1234 . 2 . 2 56 56 PRO HD2 H 1 2.04 0.02 . 2 . . . . A 53 PRO HD2 . 34994 1 1235 . 2 . 2 56 56 PRO HD3 H 1 2.01 0.02 . 2 . . . . A 53 PRO HD3 . 34994 1 1236 . 2 . 2 56 56 PRO C C 13 178.19 0.2 . 1 . . . . A 53 PRO C . 34994 1 1237 . 2 . 2 56 56 PRO CA C 13 62.44 0.2 . 1 . . . . A 53 PRO CA . 34994 1 1238 . 2 . 2 56 56 PRO CB C 13 31.97 0.2 . 1 . . . . A 53 PRO CB . 34994 1 1239 . 2 . 2 56 56 PRO CG C 13 27.62 0.2 . 1 . . . . A 53 PRO CG . 34994 1 1240 . 2 . 2 56 56 PRO CD C 13 50.39 0.2 . 1 . . . . A 53 PRO CD . 34994 1 1241 . 2 . 2 56 56 PRO N N 15 140.61 0.2 . 1 . . . . A 53 PRO N . 34994 1 1242 . 2 . 2 57 57 THR H H 1 8.71 0.02 . 1 . . . . A 54 THR H . 34994 1 1243 . 2 . 2 57 57 THR HA H 1 3.67 0.02 . 1 . . . . A 54 THR HA . 34994 1 1244 . 2 . 2 57 57 THR HB H 1 3.86 0.02 . 1 . . . . A 54 THR HB . 34994 1 1245 . 2 . 2 57 57 THR HG21 H 1 1.13 0.02 . 1 . . . . A 54 THR HG21 . 34994 1 1246 . 2 . 2 57 57 THR HG22 H 1 1.13 0.02 . 1 . . . . A 54 THR HG22 . 34994 1 1247 . 2 . 2 57 57 THR HG23 H 1 1.13 0.02 . 1 . . . . A 54 THR HG23 . 34994 1 1248 . 2 . 2 57 57 THR C C 13 176.88 0.2 . 1 . . . . A 54 THR C . 34994 1 1249 . 2 . 2 57 57 THR CA C 13 66.24 0.2 . 1 . . . . A 54 THR CA . 34994 1 1250 . 2 . 2 57 57 THR CB C 13 68.3 0.2 . 1 . . . . A 54 THR CB . 34994 1 1251 . 2 . 2 57 57 THR CG2 C 13 22.55 0.2 . 1 . . . . A 54 THR CG2 . 34994 1 1252 . 2 . 2 57 57 THR N N 15 122.52 0.2 . 1 . . . . A 54 THR N . 34994 1 1253 . 2 . 2 58 58 ASP H H 1 8.64 0.02 . 1 . . . . A 55 ASP H . 34994 1 1254 . 2 . 2 58 58 ASP HA H 1 4.73 0.02 . 1 . . . . A 55 ASP HA . 34994 1 1255 . 2 . 2 58 58 ASP HB2 H 1 2.78 0.02 . 2 . . . . A 55 ASP HB2 . 34994 1 1256 . 2 . 2 58 58 ASP HB3 H 1 2.67 0.02 . 2 . . . . A 55 ASP HB3 . 34994 1 1257 . 2 . 2 58 58 ASP C C 13 175.89 0.2 . 1 . . . . A 55 ASP C . 34994 1 1258 . 2 . 2 58 58 ASP CA C 13 55.43 0.2 . 1 . . . . A 55 ASP CA . 34994 1 1259 . 2 . 2 58 58 ASP CB C 13 39.5 0.2 . 1 . . . . A 55 ASP CB . 34994 1 1260 . 2 . 2 58 58 ASP N N 15 116.75 0.2 . 1 . . . . A 55 ASP N . 34994 1 1261 . 2 . 2 59 59 TYR H H 1 8.09 0.02 . 1 . . . . A 56 TYR H . 34994 1 1262 . 2 . 2 59 59 TYR HA H 1 4.84 0.02 . 1 . . . . A 56 TYR HA . 34994 1 1263 . 2 . 2 59 59 TYR HB2 H 1 3.37 0.02 . 2 . . . . A 56 TYR HB2 . 34994 1 1264 . 2 . 2 59 59 TYR HB3 H 1 3.25 0.02 . 2 . . . . A 56 TYR HB3 . 34994 1 1265 . 2 . 2 59 59 TYR HD1 H 1 7.18 0.02 . 1 . . . . A 56 TYR HD1 . 34994 1 1266 . 2 . 2 59 59 TYR HD2 H 1 7.18 0.02 . 1 . . . . A 56 TYR HD2 . 34994 1 1267 . 2 . 2 59 59 TYR HE1 H 1 6.9 0.02 . 1 . . . . A 56 TYR HE1 . 34994 1 1268 . 2 . 2 59 59 TYR HE2 H 1 6.9 0.02 . 1 . . . . A 56 TYR HE2 . 34994 1 1269 . 2 . 2 59 59 TYR C C 13 175.26 0.2 . 1 . . . . A 56 TYR C . 34994 1 1270 . 2 . 2 59 59 TYR CA C 13 58.16 0.2 . 1 . . . . A 56 TYR CA . 34994 1 1271 . 2 . 2 59 59 TYR CB C 13 37.67 0.2 . 1 . . . . A 56 TYR CB . 34994 1 1272 . 2 . 2 59 59 TYR CD1 C 13 132.48 0.2 . 1 . . . . A 56 TYR CD1 . 34994 1 1273 . 2 . 2 59 59 TYR CD2 C 13 132.48 0.2 . 1 . . . . A 56 TYR CD2 . 34994 1 1274 . 2 . 2 59 59 TYR CE1 C 13 118.46 0.2 . 1 . . . . A 56 TYR CE1 . 34994 1 1275 . 2 . 2 59 59 TYR CE2 C 13 118.46 0.2 . 1 . . . . A 56 TYR CE2 . 34994 1 1276 . 2 . 2 59 59 TYR N N 15 117.76 0.2 . 1 . . . . A 56 TYR N . 34994 1 1277 . 2 . 2 60 60 VAL H H 1 7.61 0.02 . 1 . . . . A 57 VAL H . 34994 1 1278 . 2 . 2 60 60 VAL HA H 1 5.32 0.02 . 1 . . . . A 57 VAL HA . 34994 1 1279 . 2 . 2 60 60 VAL HB H 1 1.85 0.02 . 1 . . . . A 57 VAL HB . 34994 1 1280 . 2 . 2 60 60 VAL HG11 H 1 0.79 0.02 . 2 . . . . A 57 VAL HG11 . 34994 1 1281 . 2 . 2 60 60 VAL HG12 H 1 0.79 0.02 . 2 . . . . A 57 VAL HG12 . 34994 1 1282 . 2 . 2 60 60 VAL HG13 H 1 0.79 0.02 . 2 . . . . A 57 VAL HG13 . 34994 1 1283 . 2 . 2 60 60 VAL HG21 H 1 0.75 0.02 . 2 . . . . A 57 VAL HG21 . 34994 1 1284 . 2 . 2 60 60 VAL HG22 H 1 0.75 0.02 . 2 . . . . A 57 VAL HG22 . 34994 1 1285 . 2 . 2 60 60 VAL HG23 H 1 0.75 0.02 . 2 . . . . A 57 VAL HG23 . 34994 1 1286 . 2 . 2 60 60 VAL C C 13 173.17 0.2 . 1 . . . . A 57 VAL C . 34994 1 1287 . 2 . 2 60 60 VAL CA C 13 58.54 0.2 . 1 . . . . A 57 VAL CA . 34994 1 1288 . 2 . 2 60 60 VAL CB C 13 34.96 0.2 . 1 . . . . A 57 VAL CB . 34994 1 1289 . 2 . 2 60 60 VAL CG1 C 13 19.21 0.2 . 2 . . . . A 57 VAL CG1 . 34994 1 1290 . 2 . 2 60 60 VAL CG2 C 13 21.32 0.2 . 2 . . . . A 57 VAL CG2 . 34994 1 1291 . 2 . 2 60 60 VAL N N 15 111.21 0.2 . 1 . . . . A 57 VAL N . 34994 1 1292 . 2 . 2 61 61 GLU H H 1 9.02 0.02 . 1 . . . . A 58 GLU H . 34994 1 1293 . 2 . 2 61 61 GLU HA H 1 4.72 0.02 . 1 . . . . A 58 GLU HA . 34994 1 1294 . 2 . 2 61 61 GLU HB2 H 1 2.04 0.02 . 2 . . . . A 58 GLU HB2 . 34994 1 1295 . 2 . 2 61 61 GLU HB3 H 1 1.98 0.02 . 2 . . . . A 58 GLU HB3 . 34994 1 1296 . 2 . 2 61 61 GLU HG2 H 1 2.24 0.02 . 2 . . . . A 58 GLU HG2 . 34994 1 1297 . 2 . 2 61 61 GLU HG3 H 1 2.08 0.02 . 2 . . . . A 58 GLU HG3 . 34994 1 1298 . 2 . 2 61 61 GLU C C 13 175.63 0.2 . 1 . . . . A 58 GLU C . 34994 1 1299 . 2 . 2 61 61 GLU CA C 13 54.12 0.2 . 1 . . . . A 58 GLU CA . 34994 1 1300 . 2 . 2 61 61 GLU CB C 13 32.3 0.2 . 1 . . . . A 58 GLU CB . 34994 1 1301 . 2 . 2 61 61 GLU CG C 13 36.1 0.2 . 1 . . . . A 58 GLU CG . 34994 1 1302 . 2 . 2 61 61 GLU N N 15 122.18 0.2 . 1 . . . . A 58 GLU N . 34994 1 1303 . 2 . 2 62 62 ILE H H 1 8.84 0.02 . 1 . . . . A 59 ILE H . 34994 1 1304 . 2 . 2 62 62 ILE HA H 1 3.97 0.02 . 1 . . . . A 59 ILE HA . 34994 1 1305 . 2 . 2 62 62 ILE HB H 1 1.84 0.02 . 1 . . . . A 59 ILE HB . 34994 1 1306 . 2 . 2 62 62 ILE HG12 H 1 1.56 0.02 . 2 . . . . A 59 ILE HG12 . 34994 1 1307 . 2 . 2 62 62 ILE HG13 H 1 1.21 0.02 . 2 . . . . A 59 ILE HG13 . 34994 1 1308 . 2 . 2 62 62 ILE HG21 H 1 0.94 0.02 . 1 . . . . A 59 ILE HG21 . 34994 1 1309 . 2 . 2 62 62 ILE HG22 H 1 0.94 0.02 . 1 . . . . A 59 ILE HG22 . 34994 1 1310 . 2 . 2 62 62 ILE HG23 H 1 0.94 0.02 . 1 . . . . A 59 ILE HG23 . 34994 1 1311 . 2 . 2 62 62 ILE HD11 H 1 0.77 0.02 . 1 . . . . A 59 ILE HD11 . 34994 1 1312 . 2 . 2 62 62 ILE HD12 H 1 0.77 0.02 . 1 . . . . A 59 ILE HD12 . 34994 1 1313 . 2 . 2 62 62 ILE HD13 H 1 0.77 0.02 . 1 . . . . A 59 ILE HD13 . 34994 1 1314 . 2 . 2 62 62 ILE C C 13 176.52 0.2 . 1 . . . . A 59 ILE C . 34994 1 1315 . 2 . 2 62 62 ILE CA C 13 62.2 0.2 . 1 . . . . A 59 ILE CA . 34994 1 1316 . 2 . 2 62 62 ILE CB C 13 36.87 0.2 . 1 . . . . A 59 ILE CB . 34994 1 1317 . 2 . 2 62 62 ILE CG1 C 13 28.48 0.2 . 1 . . . . A 59 ILE CG1 . 34994 1 1318 . 2 . 2 62 62 ILE CG2 C 13 17.8 0.2 . 1 . . . . A 59 ILE CG2 . 34994 1 1319 . 2 . 2 62 62 ILE CD1 C 13 11.54 0.2 . 1 . . . . A 59 ILE CD1 . 34994 1 1320 . 2 . 2 62 62 ILE N N 15 127.32 0.2 . 1 . . . . A 59 ILE N . 34994 1 1321 . 2 . 2 63 63 LEU H H 1 8.62 0.02 . 1 . . . . A 60 LEU H . 34994 1 1322 . 2 . 2 63 63 LEU HA H 1 4.69 0.02 . 1 . . . . A 60 LEU HA . 34994 1 1323 . 2 . 2 63 63 LEU HB2 H 1 1.57 0.02 . 2 . . . . A 60 LEU HB2 . 34994 1 1324 . 2 . 2 63 63 LEU HB3 H 1 1.5 0.02 . 2 . . . . A 60 LEU HB3 . 34994 1 1325 . 2 . 2 63 63 LEU HG H 1 1.71 0.02 . 1 . . . . A 60 LEU HG . 34994 1 1326 . 2 . 2 63 63 LEU HD11 H 1 0.87 0.02 . 2 . . . . A 60 LEU HD11 . 34994 1 1327 . 2 . 2 63 63 LEU HD12 H 1 0.87 0.02 . 2 . . . . A 60 LEU HD12 . 34994 1 1328 . 2 . 2 63 63 LEU HD13 H 1 0.87 0.02 . 2 . . . . A 60 LEU HD13 . 34994 1 1329 . 2 . 2 63 63 LEU HD21 H 1 0.86 0.02 . 2 . . . . A 60 LEU HD21 . 34994 1 1330 . 2 . 2 63 63 LEU HD22 H 1 0.86 0.02 . 2 . . . . A 60 LEU HD22 . 34994 1 1331 . 2 . 2 63 63 LEU HD23 H 1 0.86 0.02 . 2 . . . . A 60 LEU HD23 . 34994 1 1332 . 2 . 2 63 63 LEU C C 13 175.15 0.2 . 1 . . . . A 60 LEU C . 34994 1 1333 . 2 . 2 63 63 LEU CA C 13 52.9 0.2 . 1 . . . . A 60 LEU CA . 34994 1 1334 . 2 . 2 63 63 LEU CB C 13 41.15 0.2 . 1 . . . . A 60 LEU CB . 34994 1 1335 . 2 . 2 63 63 LEU CG C 13 27.2 0.2 . 1 . . . . A 60 LEU CG . 34994 1 1336 . 2 . 2 63 63 LEU CD1 C 13 22.73 0.2 . 2 . . . . A 60 LEU CD1 . 34994 1 1337 . 2 . 2 63 63 LEU CD2 C 13 25.68 0.2 . 2 . . . . A 60 LEU CD2 . 34994 1 1338 . 2 . 2 63 63 LEU N N 15 130.18 0.2 . 1 . . . . A 60 LEU N . 34994 1 1339 . 2 . 2 64 64 PRO HA H 1 4.51 0.02 . 1 . . . . A 61 PRO HA . 34994 1 1340 . 2 . 2 64 64 PRO HB2 H 1 2.34 0.02 . 2 . . . . A 61 PRO HB2 . 34994 1 1341 . 2 . 2 64 64 PRO HB3 H 1 1.97 0.02 . 2 . . . . A 61 PRO HB3 . 34994 1 1342 . 2 . 2 64 64 PRO HG2 H 1 2.05 0.02 . 1 . . . . A 61 PRO HG2 . 34994 1 1343 . 2 . 2 64 64 PRO HG3 H 1 2.05 0.02 . 1 . . . . A 61 PRO HG3 . 34994 1 1344 . 2 . 2 64 64 PRO HD2 H 1 3.9 0.02 . 2 . . . . A 61 PRO HD2 . 34994 1 1345 . 2 . 2 64 64 PRO HD3 H 1 3.64 0.02 . 2 . . . . A 61 PRO HD3 . 34994 1 1346 . 2 . 2 64 64 PRO C C 13 177.1 0.2 . 1 . . . . A 61 PRO C . 34994 1 1347 . 2 . 2 64 64 PRO CA C 13 62.85 0.2 . 1 . . . . A 61 PRO CA . 34994 1 1348 . 2 . 2 64 64 PRO CB C 13 32.22 0.2 . 1 . . . . A 61 PRO CB . 34994 1 1349 . 2 . 2 64 64 PRO CG C 13 27.44 0.2 . 1 . . . . A 61 PRO CG . 34994 1 1350 . 2 . 2 64 64 PRO CD C 13 50.57 0.2 . 1 . . . . A 61 PRO CD . 34994 1 1351 . 2 . 2 64 64 PRO N N 15 135.39 0.2 . 1 . . . . A 61 PRO N . 34994 1 1352 . 2 . 2 65 65 SER H H 1 8.49 0.02 . 1 . . . . A 62 SER H . 34994 1 1353 . 2 . 2 65 65 SER HA H 1 4.46 0.02 . 1 . . . . A 62 SER HA . 34994 1 1354 . 2 . 2 65 65 SER HB2 H 1 3.9 0.02 . 1 . . . . A 62 SER HB2 . 34994 1 1355 . 2 . 2 65 65 SER HB3 H 1 3.9 0.02 . 1 . . . . A 62 SER HB3 . 34994 1 1356 . 2 . 2 65 65 SER C C 13 174.41 0.2 . 1 . . . . A 62 SER C . 34994 1 1357 . 2 . 2 65 65 SER CA C 13 58.6 0.2 . 1 . . . . A 62 SER CA . 34994 1 1358 . 2 . 2 65 65 SER CB C 13 64 0.2 . 1 . . . . A 62 SER CB . 34994 1 1359 . 2 . 2 65 65 SER N N 15 116.64 0.2 . 1 . . . . A 62 SER N . 34994 1 1360 . 2 . 2 66 66 ASP H H 1 8.41 0.02 . 1 . . . . A 63 ASP H . 34994 1 1361 . 2 . 2 66 66 ASP HA H 1 4.68 0.02 . 1 . . . . A 63 ASP HA . 34994 1 1362 . 2 . 2 66 66 ASP HB2 H 1 2.7 0.02 . 2 . . . . A 63 ASP HB2 . 34994 1 1363 . 2 . 2 66 66 ASP HB3 H 1 2.66 0.02 . 2 . . . . A 63 ASP HB3 . 34994 1 1364 . 2 . 2 66 66 ASP C C 13 175.51 0.2 . 1 . . . . A 63 ASP C . 34994 1 1365 . 2 . 2 66 66 ASP CA C 13 54.29 0.2 . 1 . . . . A 63 ASP CA . 34994 1 1366 . 2 . 2 66 66 ASP CB C 13 41.36 0.2 . 1 . . . . A 63 ASP CB . 34994 1 1367 . 2 . 2 66 66 ASP N N 15 122.62 0.2 . 1 . . . . A 63 ASP N . 34994 1 1368 . 2 . 2 67 67 GLY H H 1 7.91 0.02 . 1 . . . . A 64 GLY H . 34994 1 1369 . 2 . 2 67 67 GLY HA2 H 1 3.74 0.02 . 1 . . . . A 64 GLY HA2 . 34994 1 1370 . 2 . 2 67 67 GLY HA3 H 1 3.74 0.02 . 1 . . . . A 64 GLY HA3 . 34994 1 1371 . 2 . 2 67 67 GLY C C 13 178.94 0.2 . 1 . . . . A 64 GLY C . 34994 1 1372 . 2 . 2 67 67 GLY CA C 13 46.31 0.2 . 1 . . . . A 64 GLY CA . 34994 1 1373 . 2 . 2 67 67 GLY N N 15 114.85 0.2 . 1 . . . . A 64 GLY N . 34994 1 stop_ save_