data_34702 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34702 _Entry.Title ; Red1-Iss10 complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-01-18 _Entry.Accession_date 2022-01-18 _Entry.Last_release_date 2022-02-21 _Entry.Original_release_date 2022-02-21 _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 C. Mackereth C. D. . . 34702 2 J. Kadlec J. . . . 34702 3 H. Laroussi H. . . . 34702 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'MTREC complex' . 34702 RNA . 34702 'RNA degradation' . 34702 meiosis . 34702 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34702 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 379 34702 '15N chemical shifts' 88 34702 '1H chemical shifts' 650 34702 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 . . 2022-09-02 . original BMRB . 34702 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7QUU 'BMRB Entry Tracking System' 34702 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34702 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 36002457 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural analysis of Red1 as a conserved scaffold of the RNA-targeting MTREC/PAXT complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 13 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 4969 _Citation.Page_last 4969 _Citation.Year 2022 _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 Anne-Emmanuelle Foucher A. E. . . 34702 1 2 Leila Touat-Todeschini L. . . . 34702 1 3 Ariadna Juarez-Martinez A. B. . . 34702 1 4 Auriane Rakitch A. . . . 34702 1 5 Hamida Laroussi H. . . . 34702 1 6 Claire Karczewski C. . . . 34702 1 7 Samira Acajjaoui S. . . . 34702 1 8 Montserrat Soler-Lopez M. . . . 34702 1 9 Stephen Cusack S. . . . 34702 1 10 Cameron Mackereth C. D. . . 34702 1 11 Andre Verdel A. . . . 34702 1 12 Jan Kadlec J. . . . 34702 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34702 _Assembly.ID 1 _Assembly.Name 'Uncharacterized protein C7D4.14c, NURS complex subunit red1' _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 A yes . . . . . . 34702 1 2 unit_2 2 $entity_2 B B yes . . . . . . 34702 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34702 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGWSHPQFEKSSDAVEPSVE KEYKKIISFRDTVFEGKHQQ FLVPNNVRLKFLRDR ; _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 55 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 6592.497 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -10 MET . 34702 1 2 -9 GLY . 34702 1 3 -8 TRP . 34702 1 4 -7 SER . 34702 1 5 -6 HIS . 34702 1 6 -5 PRO . 34702 1 7 -4 GLN . 34702 1 8 -3 PHE . 34702 1 9 -2 GLU . 34702 1 10 -1 LYS . 34702 1 11 0 SER . 34702 1 12 1 SER . 34702 1 13 2 ASP . 34702 1 14 3 ALA . 34702 1 15 4 VAL . 34702 1 16 5 GLU . 34702 1 17 6 PRO . 34702 1 18 7 SER . 34702 1 19 8 VAL . 34702 1 20 9 GLU . 34702 1 21 10 LYS . 34702 1 22 11 GLU . 34702 1 23 12 TYR . 34702 1 24 13 LYS . 34702 1 25 14 LYS . 34702 1 26 15 ILE . 34702 1 27 16 ILE . 34702 1 28 17 SER . 34702 1 29 18 PHE . 34702 1 30 19 ARG . 34702 1 31 20 ASP . 34702 1 32 21 THR . 34702 1 33 22 VAL . 34702 1 34 23 PHE . 34702 1 35 24 GLU . 34702 1 36 25 GLY . 34702 1 37 26 LYS . 34702 1 38 27 HIS . 34702 1 39 28 GLN . 34702 1 40 29 GLN . 34702 1 41 30 PHE . 34702 1 42 31 LEU . 34702 1 43 32 VAL . 34702 1 44 33 PRO . 34702 1 45 34 ASN . 34702 1 46 35 ASN . 34702 1 47 36 VAL . 34702 1 48 37 ARG . 34702 1 49 38 LEU . 34702 1 50 39 LYS . 34702 1 51 40 PHE . 34702 1 52 41 LEU . 34702 1 53 42 ARG . 34702 1 54 43 ASP . 34702 1 55 44 ARG . 34702 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 34702 1 . GLY 2 2 34702 1 . TRP 3 3 34702 1 . SER 4 4 34702 1 . HIS 5 5 34702 1 . PRO 6 6 34702 1 . GLN 7 7 34702 1 . PHE 8 8 34702 1 . GLU 9 9 34702 1 . LYS 10 10 34702 1 . SER 11 11 34702 1 . SER 12 12 34702 1 . ASP 13 13 34702 1 . ALA 14 14 34702 1 . VAL 15 15 34702 1 . GLU 16 16 34702 1 . PRO 17 17 34702 1 . SER 18 18 34702 1 . VAL 19 19 34702 1 . GLU 20 20 34702 1 . LYS 21 21 34702 1 . GLU 22 22 34702 1 . TYR 23 23 34702 1 . LYS 24 24 34702 1 . LYS 25 25 34702 1 . ILE 26 26 34702 1 . ILE 27 27 34702 1 . SER 28 28 34702 1 . PHE 29 29 34702 1 . ARG 30 30 34702 1 . ASP 31 31 34702 1 . THR 32 32 34702 1 . VAL 33 33 34702 1 . PHE 34 34 34702 1 . GLU 35 35 34702 1 . GLY 36 36 34702 1 . LYS 37 37 34702 1 . HIS 38 38 34702 1 . GLN 39 39 34702 1 . GLN 40 40 34702 1 . PHE 41 41 34702 1 . LEU 42 42 34702 1 . VAL 43 43 34702 1 . PRO 44 44 34702 1 . ASN 45 45 34702 1 . ASN 46 46 34702 1 . VAL 47 47 34702 1 . ARG 48 48 34702 1 . LEU 49 49 34702 1 . LYS 50 50 34702 1 . PHE 51 51 34702 1 . LEU 52 52 34702 1 . ARG 53 53 34702 1 . ASP 54 54 34702 1 . ARG 55 55 34702 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34702 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMGTTNQKEAEKAVSQLFE VGVRFNDFIAEGIEPSVVHT LFLKLGLDS ; _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 49 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 5299.981 _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 1 188 GLY . 34702 2 2 189 ALA . 34702 2 3 190 MET . 34702 2 4 191 GLY . 34702 2 5 192 THR . 34702 2 6 193 THR . 34702 2 7 194 ASN . 34702 2 8 195 GLN . 34702 2 9 196 LYS . 34702 2 10 197 GLU . 34702 2 11 198 ALA . 34702 2 12 199 GLU . 34702 2 13 200 LYS . 34702 2 14 201 ALA . 34702 2 15 202 VAL . 34702 2 16 203 SER . 34702 2 17 204 GLN . 34702 2 18 205 LEU . 34702 2 19 206 PHE . 34702 2 20 207 GLU . 34702 2 21 208 VAL . 34702 2 22 209 GLY . 34702 2 23 210 VAL . 34702 2 24 211 ARG . 34702 2 25 212 PHE . 34702 2 26 213 ASN . 34702 2 27 214 ASP . 34702 2 28 215 PHE . 34702 2 29 216 ILE . 34702 2 30 217 ALA . 34702 2 31 218 GLU . 34702 2 32 219 GLY . 34702 2 33 220 ILE . 34702 2 34 221 GLU . 34702 2 35 222 PRO . 34702 2 36 223 SER . 34702 2 37 224 VAL . 34702 2 38 225 VAL . 34702 2 39 226 HIS . 34702 2 40 227 THR . 34702 2 41 228 LEU . 34702 2 42 229 PHE . 34702 2 43 230 LEU . 34702 2 44 231 LYS . 34702 2 45 232 LEU . 34702 2 46 233 GLY . 34702 2 47 234 LEU . 34702 2 48 235 ASP . 34702 2 49 236 SER . 34702 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 34702 2 . ALA 2 2 34702 2 . MET 3 3 34702 2 . GLY 4 4 34702 2 . THR 5 5 34702 2 . THR 6 6 34702 2 . ASN 7 7 34702 2 . GLN 8 8 34702 2 . LYS 9 9 34702 2 . GLU 10 10 34702 2 . ALA 11 11 34702 2 . GLU 12 12 34702 2 . LYS 13 13 34702 2 . ALA 14 14 34702 2 . VAL 15 15 34702 2 . SER 16 16 34702 2 . GLN 17 17 34702 2 . LEU 18 18 34702 2 . PHE 19 19 34702 2 . GLU 20 20 34702 2 . VAL 21 21 34702 2 . GLY 22 22 34702 2 . VAL 23 23 34702 2 . ARG 24 24 34702 2 . PHE 25 25 34702 2 . ASN 26 26 34702 2 . ASP 27 27 34702 2 . PHE 28 28 34702 2 . ILE 29 29 34702 2 . ALA 30 30 34702 2 . GLU 31 31 34702 2 . GLY 32 32 34702 2 . ILE 33 33 34702 2 . GLU 34 34 34702 2 . PRO 35 35 34702 2 . SER 36 36 34702 2 . VAL 37 37 34702 2 . VAL 38 38 34702 2 . HIS 39 39 34702 2 . THR 40 40 34702 2 . LEU 41 41 34702 2 . PHE 42 42 34702 2 . LEU 43 43 34702 2 . LYS 44 44 34702 2 . LEU 45 45 34702 2 . GLY 46 46 34702 2 . LEU 47 47 34702 2 . ASP 48 48 34702 2 . SER 49 49 34702 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 34702 _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 . 4896 organism . 'Schizosaccharomyces pombe' 'fission yeast' . . Eukaryota Fungi Schizosaccharomyces pombe '972 / ATCC 24843' . . . . . . . . . . SPAC7D4.14c . 34702 1 2 2 $entity_2 . 4896 organism . 'Schizosaccharomyces pombe' 'fission yeast' . . Eukaryota Fungi Schizosaccharomyces pombe '972 / ATCC 24843' . . . . . . . . . . 'red1, iss3, SPAC1006.03c' . 34702 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 34702 _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 BL21(DE3)' . . 469008 . . . . . . . . . . . . 34702 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . . . . . . . . . . . 34702 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34702 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 150 uM [U-99% 15N] Red1, 150 uM [U-99% 15N] Iss10, 20 mM TRIS, 150 mM sodium chloride, 5 mM beta-mercaptoethanol, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Red1 '[U-99% 15N]' . . 2 $entity_2 . . 150 . . uM . . . . 34702 1 2 Iss10 '[U-99% 15N]' . . 1 $entity_1 . . 150 . . uM . . . . 34702 1 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 34702 1 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 34702 1 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 34702 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34702 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 500 uM [U-99% 13C; U-99% 15N] Red1, 500 uM [U-99% 13C; U-99% 15N] Iss10, 20 mM TRIS, 150 mM sodium chloride, 5 mM beta-mercaptoethanol, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Red1 '[U-99% 13C; U-99% 15N]' . . 2 $entity_2 . . 500 . . uM . . . . 34702 2 2 Iss10 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 34702 2 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 34702 2 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 34702 2 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 34702 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 34702 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 500 uM [U-99% 13C; U-99% 15N] Red1, 500 uM [U-99% 13C; U-99% 15N] Iss10, 20 mM TRIS, 150 mM sodium chloride, 5 mM beta-mercaptoethanol, 100% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Red1 '[U-99% 13C; U-99% 15N]' . . 2 $entity_2 . . 500 . . uM . . . . 34702 3 2 Iss10 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 34702 3 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 34702 3 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 34702 3 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 34702 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 34702 _Sample.ID 4 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 150 uM [U-99% 13C; U-99% 15N] Red1, 150 uM [U-99% 13C; U-99% 15N] Iss10, 20 mM TRIS, 150 mM sodium chloride, 5 mM beta-mercaptoethanol, 100% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Red1 '[U-99% 13C; U-99% 15N]' . . 2 $entity_2 . . 150 . . uM . . . . 34702 4 2 Iss10 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 150 . . uM . . . . 34702 4 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 34702 4 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 34702 4 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 34702 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34702 _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 34702 1 pH 7.5 . pH 34702 1 pressure 1 . atm 34702 1 temperature 298 . K 34702 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34702 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version 4.0.6 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34702 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 34702 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34702 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 34702 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 34702 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34702 _Software.ID 3 _Software.Type . _Software.Name Sparky _Software.Version NMRFAM _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 34702 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34702 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34702 _Software.ID 4 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 34702 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34702 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 34702 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'PA TXI 700S4 H-C/N-D-05 Z BTO' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34702 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'TCI 800S6 H-C/N-D-05 Z P' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _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 34702 _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 NEO' . 700 . . . 34702 1 2 NMR_spectrometer_2 Bruker 'AVANCE NEO' . 800 . . . 34702 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 34702 _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 . . . . . . . . . . . . . . . . . 34702 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34702 1 3 '3D HNCO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 4 '3D HN(CA)CO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 5 '3D HNCA' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 6 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 8 '3D HNHA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 9 '3D HA(CACO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 10 '3D H(CCO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 11 '3D H(CCO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34702 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34702 1 14 '3D 1H-15N NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 15 '3D 1H-13C NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34702 1 16 '2D 1H-1H TOCSY' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 17 '2D DQF-COSY' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 18 '2D 1H-1H NOESY' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 19 '2D TROSY-RDC isotropic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 1 20 '2D TROSY-RDC phage' no . . . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34702 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 34702 _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 . . . . . 34702 1 H 1 water protons . . . . ppm 4.773 internal direct 1.0 . . . . . 34702 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 34702 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 34702 _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' . . . 34702 1 2 '2D 1H-13C HSQC' . . . 34702 1 3 '3D HNCO' . . . 34702 1 4 '3D HN(CA)CO' . . . 34702 1 5 '3D HNCA' . . . 34702 1 6 '3D HNCACB' . . . 34702 1 7 '3D CBCA(CO)NH' . . . 34702 1 8 '3D HNHA' . . . 34702 1 9 '3D HA(CACO)NH' . . . 34702 1 10 '3D H(CCO)NH' . . . 34702 1 11 '3D H(CCO)NH' . . . 34702 1 12 '3D HCCH-TOCSY' . . . 34702 1 13 '3D HCCH-TOCSY' . . . 34702 1 14 '3D 1H-15N NOESY' . . . 34702 1 15 '3D 1H-13C NOESY' . . . 34702 1 16 '2D 1H-1H TOCSY' . . . 34702 1 17 '2D DQF-COSY' . . . 34702 1 18 '2D 1H-1H NOESY' . . . 34702 1 19 '2D TROSY-RDC isotropic' . . . 34702 1 20 '2D TROSY-RDC phage' . . . 34702 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 12 12 SER HA H 1 4.472 0.02 . 1 . . . . A 1 SER HA . 34702 1 2 . 1 1 1 12 12 SER HB2 H 1 3.859 0.02 . 2 . . . . A 1 SER HB2 . 34702 1 3 . 1 1 1 12 12 SER HB3 H 1 3.929 0.02 . 2 . . . . A 1 SER HB3 . 34702 1 4 . 1 1 1 12 12 SER CA C 13 58.418 0.2 . 1 . . . . A 1 SER CA . 34702 1 5 . 1 1 1 12 12 SER CB C 13 63.764 0.2 . 1 . . . . A 1 SER CB . 34702 1 6 . 1 1 1 13 13 ASP H H 1 8.3 0.02 . 1 . . . . A 2 ASP H . 34702 1 7 . 1 1 1 13 13 ASP HA H 1 4.631 0.02 . 1 . . . . A 2 ASP HA . 34702 1 8 . 1 1 1 13 13 ASP HB2 H 1 2.632 0.02 . 2 . . . . A 2 ASP HB2 . 34702 1 9 . 1 1 1 13 13 ASP HB3 H 1 2.709 0.02 . 2 . . . . A 2 ASP HB3 . 34702 1 10 . 1 1 1 13 13 ASP C C 13 175.757 0.2 . 1 . . . . A 2 ASP C . 34702 1 11 . 1 1 1 13 13 ASP CA C 13 54.349 0.2 . 1 . . . . A 2 ASP CA . 34702 1 12 . 1 1 1 13 13 ASP CB C 13 41.093 0.2 . 1 . . . . A 2 ASP CB . 34702 1 13 . 1 1 1 13 13 ASP N N 15 122.353 0.2 . 1 . . . . A 2 ASP N . 34702 1 14 . 1 1 1 14 14 ALA H H 1 8.054 0.02 . 1 . . . . A 3 ALA H . 34702 1 15 . 1 1 1 14 14 ALA HA H 1 4.347 0.02 . 1 . . . . A 3 ALA HA . 34702 1 16 . 1 1 1 14 14 ALA HB1 H 1 1.393 0.02 . 1 . . . . A 3 ALA HB1 . 34702 1 17 . 1 1 1 14 14 ALA HB2 H 1 1.393 0.02 . 1 . . . . A 3 ALA HB2 . 34702 1 18 . 1 1 1 14 14 ALA HB3 H 1 1.393 0.02 . 1 . . . . A 3 ALA HB3 . 34702 1 19 . 1 1 1 14 14 ALA C C 13 177.471 0.2 . 1 . . . . A 3 ALA C . 34702 1 20 . 1 1 1 14 14 ALA CA C 13 52.423 0.2 . 1 . . . . A 3 ALA CA . 34702 1 21 . 1 1 1 14 14 ALA CB C 13 19.304 0.2 . 1 . . . . A 3 ALA CB . 34702 1 22 . 1 1 1 14 14 ALA N N 15 123.905 0.2 . 1 . . . . A 3 ALA N . 34702 1 23 . 1 1 1 15 15 VAL H H 1 8.109 0.02 . 1 . . . . A 4 VAL H . 34702 1 24 . 1 1 1 15 15 VAL HA H 1 4.147 0.02 . 1 . . . . A 4 VAL HA . 34702 1 25 . 1 1 1 15 15 VAL HB H 1 2.072 0.02 . 1 . . . . A 4 VAL HB . 34702 1 26 . 1 1 1 15 15 VAL HG11 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG11 . 34702 1 27 . 1 1 1 15 15 VAL HG12 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG12 . 34702 1 28 . 1 1 1 15 15 VAL HG13 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG13 . 34702 1 29 . 1 1 1 15 15 VAL HG21 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG21 . 34702 1 30 . 1 1 1 15 15 VAL HG22 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG22 . 34702 1 31 . 1 1 1 15 15 VAL HG23 H 1 0.956 0.02 . 2 . . . . A 4 VAL HG23 . 34702 1 32 . 1 1 1 15 15 VAL C C 13 175.873 0.2 . 1 . . . . A 4 VAL C . 34702 1 33 . 1 1 1 15 15 VAL CA C 13 61.751 0.2 . 1 . . . . A 4 VAL CA . 34702 1 34 . 1 1 1 15 15 VAL CB C 13 32.905 0.2 . 1 . . . . A 4 VAL CB . 34702 1 35 . 1 1 1 15 15 VAL CG1 C 13 21.42 0.2 . 2 . . . . A 4 VAL CG1 . 34702 1 36 . 1 1 1 15 15 VAL CG2 C 13 20.515 0.2 . 2 . . . . A 4 VAL CG2 . 34702 1 37 . 1 1 1 15 15 VAL N N 15 119.699 0.2 . 1 . . . . A 4 VAL N . 34702 1 38 . 1 1 1 16 16 GLU H H 1 8.588 0.02 . 1 . . . . A 5 GLU H . 34702 1 39 . 1 1 1 16 16 GLU HA H 1 4.608 0.02 . 1 . . . . A 5 GLU HA . 34702 1 40 . 1 1 1 16 16 GLU HB2 H 1 1.944 0.02 . 1 . . . . A 5 GLU HB2 . 34702 1 41 . 1 1 1 16 16 GLU HB3 H 1 1.944 0.02 . 1 . . . . A 5 GLU HB3 . 34702 1 42 . 1 1 1 16 16 GLU HG2 H 1 2.296 0.02 . 1 . . . . A 5 GLU HG2 . 34702 1 43 . 1 1 1 16 16 GLU HG3 H 1 2.296 0.02 . 1 . . . . A 5 GLU HG3 . 34702 1 44 . 1 1 1 16 16 GLU C C 13 174.759 0.2 . 1 . . . . A 5 GLU C . 34702 1 45 . 1 1 1 16 16 GLU CA C 13 54.474 0.2 . 1 . . . . A 5 GLU CA . 34702 1 46 . 1 1 1 16 16 GLU CB C 13 29.998 0.2 . 1 . . . . A 5 GLU CB . 34702 1 47 . 1 1 1 16 16 GLU CG C 13 36.112 0.2 . 1 . . . . A 5 GLU CG . 34702 1 48 . 1 1 1 16 16 GLU N N 15 126.859 0.2 . 1 . . . . A 5 GLU N . 34702 1 49 . 1 1 1 17 17 PRO HA H 1 4.435 0.02 . 1 . . . . A 6 PRO HA . 34702 1 50 . 1 1 1 17 17 PRO HB2 H 1 2.378 0.02 . 1 . . . . A 6 PRO HB2 . 34702 1 51 . 1 1 1 17 17 PRO HB3 H 1 2.378 0.02 . 1 . . . . A 6 PRO HB3 . 34702 1 52 . 1 1 1 17 17 PRO HG2 H 1 2.047 0.02 . 1 . . . . A 6 PRO HG2 . 34702 1 53 . 1 1 1 17 17 PRO HG3 H 1 2.047 0.02 . 1 . . . . A 6 PRO HG3 . 34702 1 54 . 1 1 1 17 17 PRO HD2 H 1 3.935 0.02 . 2 . . . . A 6 PRO HD2 . 34702 1 55 . 1 1 1 17 17 PRO HD3 H 1 3.765 0.02 . 2 . . . . A 6 PRO HD3 . 34702 1 56 . 1 1 1 17 17 PRO CA C 13 64.04 0.2 . 1 . . . . A 6 PRO CA . 34702 1 57 . 1 1 1 17 17 PRO CB C 13 32.256 0.2 . 1 . . . . A 6 PRO CB . 34702 1 58 . 1 1 1 17 17 PRO CG C 13 27.583 0.2 . 1 . . . . A 6 PRO CG . 34702 1 59 . 1 1 1 17 17 PRO CD C 13 50.932 0.2 . 1 . . . . A 6 PRO CD . 34702 1 60 . 1 1 1 18 18 SER HA H 1 4.283 0.02 . 1 . . . . A 7 SER HA . 34702 1 61 . 1 1 1 18 18 SER HB2 H 1 3.96 0.02 . 1 . . . . A 7 SER HB2 . 34702 1 62 . 1 1 1 18 18 SER HB3 H 1 3.96 0.02 . 1 . . . . A 7 SER HB3 . 34702 1 63 . 1 1 1 18 18 SER C C 13 176.404 0.2 . 1 . . . . A 7 SER C . 34702 1 64 . 1 1 1 18 18 SER CA C 13 60.099 0.2 . 1 . . . . A 7 SER CA . 34702 1 65 . 1 1 1 18 18 SER CB C 13 62.597 0.2 . 1 . . . . A 7 SER CB . 34702 1 66 . 1 1 1 19 19 VAL H H 1 7.978 0.02 . 1 . . . . A 8 VAL H . 34702 1 67 . 1 1 1 19 19 VAL HA H 1 3.542 0.02 . 1 . . . . A 8 VAL HA . 34702 1 68 . 1 1 1 19 19 VAL HB H 1 1.902 0.02 . 1 . . . . A 8 VAL HB . 34702 1 69 . 1 1 1 19 19 VAL HG11 H 1 0.788 0.02 . 2 . . . . A 8 VAL HG11 . 34702 1 70 . 1 1 1 19 19 VAL HG12 H 1 0.788 0.02 . 2 . . . . A 8 VAL HG12 . 34702 1 71 . 1 1 1 19 19 VAL HG13 H 1 0.788 0.02 . 2 . . . . A 8 VAL HG13 . 34702 1 72 . 1 1 1 19 19 VAL HG21 H 1 0.627 0.02 . 2 . . . . A 8 VAL HG21 . 34702 1 73 . 1 1 1 19 19 VAL HG22 H 1 0.627 0.02 . 2 . . . . A 8 VAL HG22 . 34702 1 74 . 1 1 1 19 19 VAL HG23 H 1 0.627 0.02 . 2 . . . . A 8 VAL HG23 . 34702 1 75 . 1 1 1 19 19 VAL C C 13 176.72 0.2 . 1 . . . . A 8 VAL C . 34702 1 76 . 1 1 1 19 19 VAL CA C 13 65.594 0.2 . 1 . . . . A 8 VAL CA . 34702 1 77 . 1 1 1 19 19 VAL CB C 13 31.112 0.2 . 1 . . . . A 8 VAL CB . 34702 1 78 . 1 1 1 19 19 VAL CG1 C 13 21.677 0.2 . 2 . . . . A 8 VAL CG1 . 34702 1 79 . 1 1 1 19 19 VAL CG2 C 13 20.851 0.2 . 2 . . . . A 8 VAL CG2 . 34702 1 80 . 1 1 1 19 19 VAL N N 15 123.158 0.2 . 1 . . . . A 8 VAL N . 34702 1 81 . 1 1 1 20 20 GLU H H 1 7.77 0.02 . 1 . . . . A 9 GLU H . 34702 1 82 . 1 1 1 20 20 GLU HA H 1 2.595 0.02 . 1 . . . . A 9 GLU HA . 34702 1 83 . 1 1 1 20 20 GLU HB2 H 1 2.04 0.02 . 1 . . . . A 9 GLU HB2 . 34702 1 84 . 1 1 1 20 20 GLU HB3 H 1 2.04 0.02 . 1 . . . . A 9 GLU HB3 . 34702 1 85 . 1 1 1 20 20 GLU HG2 H 1 2.062 0.02 . 1 . . . . A 9 GLU HG2 . 34702 1 86 . 1 1 1 20 20 GLU HG3 H 1 2.062 0.02 . 1 . . . . A 9 GLU HG3 . 34702 1 87 . 1 1 1 20 20 GLU C C 13 176.906 0.2 . 1 . . . . A 9 GLU C . 34702 1 88 . 1 1 1 20 20 GLU CA C 13 59.803 0.2 . 1 . . . . A 9 GLU CA . 34702 1 89 . 1 1 1 20 20 GLU CB C 13 29.072 0.2 . 1 . . . . A 9 GLU CB . 34702 1 90 . 1 1 1 20 20 GLU CG C 13 33.176 0.2 . 1 . . . . A 9 GLU CG . 34702 1 91 . 1 1 1 20 20 GLU N N 15 119.531 0.2 . 1 . . . . A 9 GLU N . 34702 1 92 . 1 1 1 21 21 LYS H H 1 7.963 0.02 . 1 . . . . A 10 LYS H . 34702 1 93 . 1 1 1 21 21 LYS HA H 1 3.872 0.02 . 1 . . . . A 10 LYS HA . 34702 1 94 . 1 1 1 21 21 LYS HB2 H 1 1.82 0.02 . 1 . . . . A 10 LYS HB2 . 34702 1 95 . 1 1 1 21 21 LYS HB3 H 1 1.82 0.02 . 1 . . . . A 10 LYS HB3 . 34702 1 96 . 1 1 1 21 21 LYS HG2 H 1 1.445 0.02 . 1 . . . . A 10 LYS HG2 . 34702 1 97 . 1 1 1 21 21 LYS HG3 H 1 1.445 0.02 . 1 . . . . A 10 LYS HG3 . 34702 1 98 . 1 1 1 21 21 LYS HD2 H 1 1.643 0.02 . 1 . . . . A 10 LYS HD2 . 34702 1 99 . 1 1 1 21 21 LYS HD3 H 1 1.643 0.02 . 1 . . . . A 10 LYS HD3 . 34702 1 100 . 1 1 1 21 21 LYS HE2 H 1 2.942 0.02 . 1 . . . . A 10 LYS HE2 . 34702 1 101 . 1 1 1 21 21 LYS HE3 H 1 2.942 0.02 . 1 . . . . A 10 LYS HE3 . 34702 1 102 . 1 1 1 21 21 LYS C C 13 179.878 0.2 . 1 . . . . A 10 LYS C . 34702 1 103 . 1 1 1 21 21 LYS CA C 13 59.021 0.2 . 1 . . . . A 10 LYS CA . 34702 1 104 . 1 1 1 21 21 LYS CB C 13 31.532 0.2 . 1 . . . . A 10 LYS CB . 34702 1 105 . 1 1 1 21 21 LYS CG C 13 24.897 0.2 . 1 . . . . A 10 LYS CG . 34702 1 106 . 1 1 1 21 21 LYS CD C 13 28.594 0.2 . 1 . . . . A 10 LYS CD . 34702 1 107 . 1 1 1 21 21 LYS CE C 13 41.909 0.2 . 1 . . . . A 10 LYS CE . 34702 1 108 . 1 1 1 21 21 LYS N N 15 118.011 0.2 . 1 . . . . A 10 LYS N . 34702 1 109 . 1 1 1 22 22 GLU H H 1 8.136 0.02 . 1 . . . . A 11 GLU H . 34702 1 110 . 1 1 1 22 22 GLU HA H 1 4.181 0.02 . 1 . . . . A 11 GLU HA . 34702 1 111 . 1 1 1 22 22 GLU HB2 H 1 2.205 0.02 . 1 . . . . A 11 GLU HB2 . 34702 1 112 . 1 1 1 22 22 GLU HB3 H 1 2.205 0.02 . 1 . . . . A 11 GLU HB3 . 34702 1 113 . 1 1 1 22 22 GLU HG2 H 1 2.577 0.02 . 1 . . . . A 11 GLU HG2 . 34702 1 114 . 1 1 1 22 22 GLU HG3 H 1 2.577 0.02 . 1 . . . . A 11 GLU HG3 . 34702 1 115 . 1 1 1 22 22 GLU C C 13 179.231 0.2 . 1 . . . . A 11 GLU C . 34702 1 116 . 1 1 1 22 22 GLU CA C 13 58.46 0.2 . 1 . . . . A 11 GLU CA . 34702 1 117 . 1 1 1 22 22 GLU CB C 13 29.102 0.2 . 1 . . . . A 11 GLU CB . 34702 1 118 . 1 1 1 22 22 GLU CG C 13 36.169 0.2 . 1 . . . . A 11 GLU CG . 34702 1 119 . 1 1 1 22 22 GLU N N 15 119.911 0.2 . 1 . . . . A 11 GLU N . 34702 1 120 . 1 1 1 23 23 TYR H H 1 8.455 0.02 . 1 . . . . A 12 TYR H . 34702 1 121 . 1 1 1 23 23 TYR HA H 1 4.461 0.02 . 1 . . . . A 12 TYR HA . 34702 1 122 . 1 1 1 23 23 TYR HB2 H 1 3.393 0.02 . 2 . . . . A 12 TYR HB2 . 34702 1 123 . 1 1 1 23 23 TYR HB3 H 1 2.98 0.02 . 2 . . . . A 12 TYR HB3 . 34702 1 124 . 1 1 1 23 23 TYR HD1 H 1 6.847 0.02 . 1 . . . . A 12 TYR HD1 . 34702 1 125 . 1 1 1 23 23 TYR HD2 H 1 6.847 0.02 . 1 . . . . A 12 TYR HD2 . 34702 1 126 . 1 1 1 23 23 TYR HE1 H 1 6.711 0.02 . 1 . . . . A 12 TYR HE1 . 34702 1 127 . 1 1 1 23 23 TYR HE2 H 1 6.711 0.02 . 1 . . . . A 12 TYR HE2 . 34702 1 128 . 1 1 1 23 23 TYR C C 13 178.913 0.2 . 1 . . . . A 12 TYR C . 34702 1 129 . 1 1 1 23 23 TYR CA C 13 58.256 0.2 . 1 . . . . A 12 TYR CA . 34702 1 130 . 1 1 1 23 23 TYR CB C 13 36.492 0.2 . 1 . . . . A 12 TYR CB . 34702 1 131 . 1 1 1 23 23 TYR CD1 C 13 130.44 0.2 . 1 . . . . A 12 TYR CD1 . 34702 1 132 . 1 1 1 23 23 TYR CD2 C 13 130.44 0.2 . 1 . . . . A 12 TYR CD2 . 34702 1 133 . 1 1 1 23 23 TYR CE1 C 13 118.216 0.2 . 1 . . . . A 12 TYR CE1 . 34702 1 134 . 1 1 1 23 23 TYR CE2 C 13 118.216 0.2 . 1 . . . . A 12 TYR CE2 . 34702 1 135 . 1 1 1 23 23 TYR N N 15 118.807 0.2 . 1 . . . . A 12 TYR N . 34702 1 136 . 1 1 1 24 24 LYS H H 1 8.128 0.02 . 1 . . . . A 13 LYS H . 34702 1 137 . 1 1 1 24 24 LYS HA H 1 4.036 0.02 . 1 . . . . A 13 LYS HA . 34702 1 138 . 1 1 1 24 24 LYS HB2 H 1 2.001 0.02 . 1 . . . . A 13 LYS HB2 . 34702 1 139 . 1 1 1 24 24 LYS HB3 H 1 2.001 0.02 . 1 . . . . A 13 LYS HB3 . 34702 1 140 . 1 1 1 24 24 LYS HG2 H 1 1.733 0.02 . 1 . . . . A 13 LYS HG2 . 34702 1 141 . 1 1 1 24 24 LYS HG3 H 1 1.733 0.02 . 1 . . . . A 13 LYS HG3 . 34702 1 142 . 1 1 1 24 24 LYS HD2 H 1 1.751 0.02 . 1 . . . . A 13 LYS HD2 . 34702 1 143 . 1 1 1 24 24 LYS HD3 H 1 1.751 0.02 . 1 . . . . A 13 LYS HD3 . 34702 1 144 . 1 1 1 24 24 LYS HE2 H 1 3.005 0.02 . 1 . . . . A 13 LYS HE2 . 34702 1 145 . 1 1 1 24 24 LYS HE3 H 1 3.005 0.02 . 1 . . . . A 13 LYS HE3 . 34702 1 146 . 1 1 1 24 24 LYS C C 13 179.303 0.2 . 1 . . . . A 13 LYS C . 34702 1 147 . 1 1 1 24 24 LYS CA C 13 60.378 0.2 . 1 . . . . A 13 LYS CA . 34702 1 148 . 1 1 1 24 24 LYS CB C 13 31.866 0.2 . 1 . . . . A 13 LYS CB . 34702 1 149 . 1 1 1 24 24 LYS CG C 13 25.926 0.2 . 1 . . . . A 13 LYS CG . 34702 1 150 . 1 1 1 24 24 LYS CD C 13 29.197 0.2 . 1 . . . . A 13 LYS CD . 34702 1 151 . 1 1 1 24 24 LYS CE C 13 41.836 0.2 . 1 . . . . A 13 LYS CE . 34702 1 152 . 1 1 1 24 24 LYS N N 15 117.679 0.2 . 1 . . . . A 13 LYS N . 34702 1 153 . 1 1 1 25 25 LYS H H 1 7.822 0.02 . 1 . . . . A 14 LYS H . 34702 1 154 . 1 1 1 25 25 LYS HA H 1 4.128 0.02 . 1 . . . . A 14 LYS HA . 34702 1 155 . 1 1 1 25 25 LYS HB2 H 1 2.163 0.02 . 2 . . . . A 14 LYS HB2 . 34702 1 156 . 1 1 1 25 25 LYS HB3 H 1 1.846 0.02 . 2 . . . . A 14 LYS HB3 . 34702 1 157 . 1 1 1 25 25 LYS HG2 H 1 1.483 0.02 . 1 . . . . A 14 LYS HG2 . 34702 1 158 . 1 1 1 25 25 LYS HG3 H 1 1.483 0.02 . 1 . . . . A 14 LYS HG3 . 34702 1 159 . 1 1 1 25 25 LYS HD2 H 1 1.751 0.02 . 1 . . . . A 14 LYS HD2 . 34702 1 160 . 1 1 1 25 25 LYS HD3 H 1 1.751 0.02 . 1 . . . . A 14 LYS HD3 . 34702 1 161 . 1 1 1 25 25 LYS HE2 H 1 2.894 0.02 . 1 . . . . A 14 LYS HE2 . 34702 1 162 . 1 1 1 25 25 LYS HE3 H 1 2.894 0.02 . 1 . . . . A 14 LYS HE3 . 34702 1 163 . 1 1 1 25 25 LYS C C 13 180.272 0.2 . 1 . . . . A 14 LYS C . 34702 1 164 . 1 1 1 25 25 LYS CA C 13 60 0.2 . 1 . . . . A 14 LYS CA . 34702 1 165 . 1 1 1 25 25 LYS CB C 13 33.425 0.2 . 1 . . . . A 14 LYS CB . 34702 1 166 . 1 1 1 25 25 LYS CG C 13 25.596 0.2 . 1 . . . . A 14 LYS CG . 34702 1 167 . 1 1 1 25 25 LYS CD C 13 28.941 0.2 . 1 . . . . A 14 LYS CD . 34702 1 168 . 1 1 1 25 25 LYS CE C 13 41.833 0.2 . 1 . . . . A 14 LYS CE . 34702 1 169 . 1 1 1 25 25 LYS N N 15 120.802 0.2 . 1 . . . . A 14 LYS N . 34702 1 170 . 1 1 1 26 26 ILE H H 1 8.231 0.02 . 1 . . . . A 15 ILE H . 34702 1 171 . 1 1 1 26 26 ILE HA H 1 3.773 0.02 . 1 . . . . A 15 ILE HA . 34702 1 172 . 1 1 1 26 26 ILE HB H 1 2.37 0.02 . 1 . . . . A 15 ILE HB . 34702 1 173 . 1 1 1 26 26 ILE HG12 H 1 1.07 0.02 . 2 . . . . A 15 ILE HG12 . 34702 1 174 . 1 1 1 26 26 ILE HG13 H 1 2.339 0.02 . 2 . . . . A 15 ILE HG13 . 34702 1 175 . 1 1 1 26 26 ILE HG21 H 1 1.139 0.02 . 1 . . . . A 15 ILE HG21 . 34702 1 176 . 1 1 1 26 26 ILE HG22 H 1 1.139 0.02 . 1 . . . . A 15 ILE HG22 . 34702 1 177 . 1 1 1 26 26 ILE HG23 H 1 1.139 0.02 . 1 . . . . A 15 ILE HG23 . 34702 1 178 . 1 1 1 26 26 ILE HD11 H 1 0.903 0.02 . 1 . . . . A 15 ILE HD11 . 34702 1 179 . 1 1 1 26 26 ILE HD12 H 1 0.903 0.02 . 1 . . . . A 15 ILE HD12 . 34702 1 180 . 1 1 1 26 26 ILE HD13 H 1 0.903 0.02 . 1 . . . . A 15 ILE HD13 . 34702 1 181 . 1 1 1 26 26 ILE C C 13 176.943 0.2 . 1 . . . . A 15 ILE C . 34702 1 182 . 1 1 1 26 26 ILE CA C 13 66.519 0.2 . 1 . . . . A 15 ILE CA . 34702 1 183 . 1 1 1 26 26 ILE CB C 13 38.466 0.2 . 1 . . . . A 15 ILE CB . 34702 1 184 . 1 1 1 26 26 ILE CG1 C 13 31.723 0.2 . 1 . . . . A 15 ILE CG1 . 34702 1 185 . 1 1 1 26 26 ILE CG2 C 13 18.747 0.2 . 1 . . . . A 15 ILE CG2 . 34702 1 186 . 1 1 1 26 26 ILE CD1 C 13 14.727 0.2 . 1 . . . . A 15 ILE CD1 . 34702 1 187 . 1 1 1 26 26 ILE N N 15 122.351 0.2 . 1 . . . . A 15 ILE N . 34702 1 188 . 1 1 1 27 27 ILE H H 1 8.223 0.02 . 1 . . . . A 16 ILE H . 34702 1 189 . 1 1 1 27 27 ILE HA H 1 3.394 0.02 . 1 . . . . A 16 ILE HA . 34702 1 190 . 1 1 1 27 27 ILE HB H 1 1.895 0.02 . 1 . . . . A 16 ILE HB . 34702 1 191 . 1 1 1 27 27 ILE HG12 H 1 0.835 0.02 . 2 . . . . A 16 ILE HG12 . 34702 1 192 . 1 1 1 27 27 ILE HG13 H 1 1.74 0.02 . 2 . . . . A 16 ILE HG13 . 34702 1 193 . 1 1 1 27 27 ILE HG21 H 1 0.968 0.02 . 1 . . . . A 16 ILE HG21 . 34702 1 194 . 1 1 1 27 27 ILE HG22 H 1 0.968 0.02 . 1 . . . . A 16 ILE HG22 . 34702 1 195 . 1 1 1 27 27 ILE HG23 H 1 0.968 0.02 . 1 . . . . A 16 ILE HG23 . 34702 1 196 . 1 1 1 27 27 ILE HD11 H 1 0.895 0.02 . 1 . . . . A 16 ILE HD11 . 34702 1 197 . 1 1 1 27 27 ILE HD12 H 1 0.895 0.02 . 1 . . . . A 16 ILE HD12 . 34702 1 198 . 1 1 1 27 27 ILE HD13 H 1 0.895 0.02 . 1 . . . . A 16 ILE HD13 . 34702 1 199 . 1 1 1 27 27 ILE C C 13 177.187 0.2 . 1 . . . . A 16 ILE C . 34702 1 200 . 1 1 1 27 27 ILE CA C 13 66.078 0.2 . 1 . . . . A 16 ILE CA . 34702 1 201 . 1 1 1 27 27 ILE CB C 13 38.891 0.2 . 1 . . . . A 16 ILE CB . 34702 1 202 . 1 1 1 27 27 ILE CG1 C 13 29.91 0.2 . 1 . . . . A 16 ILE CG1 . 34702 1 203 . 1 1 1 27 27 ILE CG2 C 13 17.54 0.2 . 1 . . . . A 16 ILE CG2 . 34702 1 204 . 1 1 1 27 27 ILE CD1 C 13 14.57 0.2 . 1 . . . . A 16 ILE CD1 . 34702 1 205 . 1 1 1 27 27 ILE N N 15 121.524 0.2 . 1 . . . . A 16 ILE N . 34702 1 206 . 1 1 1 28 28 SER H H 1 8.412 0.02 . 1 . . . . A 17 SER H . 34702 1 207 . 1 1 1 28 28 SER HA H 1 4.34 0.02 . 1 . . . . A 17 SER HA . 34702 1 208 . 1 1 1 28 28 SER HB2 H 1 4.061 0.02 . 1 . . . . A 17 SER HB2 . 34702 1 209 . 1 1 1 28 28 SER HB3 H 1 4.061 0.02 . 1 . . . . A 17 SER HB3 . 34702 1 210 . 1 1 1 28 28 SER C C 13 176.953 0.2 . 1 . . . . A 17 SER C . 34702 1 211 . 1 1 1 28 28 SER CA C 13 62.18 0.2 . 1 . . . . A 17 SER CA . 34702 1 212 . 1 1 1 28 28 SER CB C 13 63.268 0.2 . 1 . . . . A 17 SER CB . 34702 1 213 . 1 1 1 28 28 SER N N 15 113.919 0.2 . 1 . . . . A 17 SER N . 34702 1 214 . 1 1 1 29 29 PHE H H 1 8.149 0.02 . 1 . . . . A 18 PHE H . 34702 1 215 . 1 1 1 29 29 PHE HA H 1 5.005 0.02 . 1 . . . . A 18 PHE HA . 34702 1 216 . 1 1 1 29 29 PHE HB2 H 1 3.451 0.02 . 2 . . . . A 18 PHE HB2 . 34702 1 217 . 1 1 1 29 29 PHE HB3 H 1 3.581 0.02 . 2 . . . . A 18 PHE HB3 . 34702 1 218 . 1 1 1 29 29 PHE HD1 H 1 7 0.02 . 1 . . . . A 18 PHE HD1 . 34702 1 219 . 1 1 1 29 29 PHE HD2 H 1 7 0.02 . 1 . . . . A 18 PHE HD2 . 34702 1 220 . 1 1 1 29 29 PHE HE1 H 1 6.06 0.02 . 1 . . . . A 18 PHE HE1 . 34702 1 221 . 1 1 1 29 29 PHE HE2 H 1 6.06 0.02 . 1 . . . . A 18 PHE HE2 . 34702 1 222 . 1 1 1 29 29 PHE HZ H 1 6.318 0.02 . 1 . . . . A 18 PHE HZ . 34702 1 223 . 1 1 1 29 29 PHE C C 13 176.417 0.2 . 1 . . . . A 18 PHE C . 34702 1 224 . 1 1 1 29 29 PHE CA C 13 57.556 0.2 . 1 . . . . A 18 PHE CA . 34702 1 225 . 1 1 1 29 29 PHE CB C 13 38.555 0.2 . 1 . . . . A 18 PHE CB . 34702 1 226 . 1 1 1 29 29 PHE CE1 C 13 131.019 0.2 . 1 . . . . A 18 PHE CE1 . 34702 1 227 . 1 1 1 29 29 PHE CE2 C 13 131.019 0.2 . 1 . . . . A 18 PHE CE2 . 34702 1 228 . 1 1 1 29 29 PHE CZ C 13 128.701 0.2 . 1 . . . . A 18 PHE CZ . 34702 1 229 . 1 1 1 29 29 PHE N N 15 124.162 0.2 . 1 . . . . A 18 PHE N . 34702 1 230 . 1 1 1 30 30 ARG H H 1 8.273 0.02 . 1 . . . . A 19 ARG H . 34702 1 231 . 1 1 1 30 30 ARG HA H 1 3.621 0.02 . 1 . . . . A 19 ARG HA . 34702 1 232 . 1 1 1 30 30 ARG HB2 H 1 2.393 0.02 . 2 . . . . A 19 ARG HB2 . 34702 1 233 . 1 1 1 30 30 ARG HB3 H 1 1.674 0.02 . 2 . . . . A 19 ARG HB3 . 34702 1 234 . 1 1 1 30 30 ARG HG2 H 1 1.409 0.02 . 1 . . . . A 19 ARG HG2 . 34702 1 235 . 1 1 1 30 30 ARG HG3 H 1 1.409 0.02 . 1 . . . . A 19 ARG HG3 . 34702 1 236 . 1 1 1 30 30 ARG HD2 H 1 2.755 0.02 . 1 . . . . A 19 ARG HD2 . 34702 1 237 . 1 1 1 30 30 ARG HD3 H 1 2.755 0.02 . 1 . . . . A 19 ARG HD3 . 34702 1 238 . 1 1 1 30 30 ARG C C 13 179.297 0.2 . 1 . . . . A 19 ARG C . 34702 1 239 . 1 1 1 30 30 ARG CA C 13 60.791 0.2 . 1 . . . . A 19 ARG CA . 34702 1 240 . 1 1 1 30 30 ARG CB C 13 27.033 0.2 . 1 . . . . A 19 ARG CB . 34702 1 241 . 1 1 1 30 30 ARG CG C 13 27 0.2 . 1 . . . . A 19 ARG CG . 34702 1 242 . 1 1 1 30 30 ARG CD C 13 40.012 0.2 . 1 . . . . A 19 ARG CD . 34702 1 243 . 1 1 1 30 30 ARG N N 15 120.243 0.2 . 1 . . . . A 19 ARG N . 34702 1 244 . 1 1 1 31 31 ASP H H 1 9.14 0.02 . 1 . . . . A 20 ASP H . 34702 1 245 . 1 1 1 31 31 ASP HA H 1 4.25 0.02 . 1 . . . . A 20 ASP HA . 34702 1 246 . 1 1 1 31 31 ASP HB2 H 1 2.992 0.02 . 2 . . . . A 20 ASP HB2 . 34702 1 247 . 1 1 1 31 31 ASP HB3 H 1 2.813 0.02 . 2 . . . . A 20 ASP HB3 . 34702 1 248 . 1 1 1 31 31 ASP C C 13 177.118 0.2 . 1 . . . . A 20 ASP C . 34702 1 249 . 1 1 1 31 31 ASP CA C 13 58.392 0.2 . 1 . . . . A 20 ASP CA . 34702 1 250 . 1 1 1 31 31 ASP CB C 13 39.47 0.2 . 1 . . . . A 20 ASP CB . 34702 1 251 . 1 1 1 31 31 ASP N N 15 121.351 0.2 . 1 . . . . A 20 ASP N . 34702 1 252 . 1 1 1 32 32 THR H H 1 8.565 0.02 . 1 . . . . A 21 THR H . 34702 1 253 . 1 1 1 32 32 THR HA H 1 3.948 0.02 . 1 . . . . A 21 THR HA . 34702 1 254 . 1 1 1 32 32 THR HB H 1 4.654 0.02 . 1 . . . . A 21 THR HB . 34702 1 255 . 1 1 1 32 32 THR HG21 H 1 1.343 0.02 . 1 . . . . A 21 THR HG21 . 34702 1 256 . 1 1 1 32 32 THR HG22 H 1 1.343 0.02 . 1 . . . . A 21 THR HG22 . 34702 1 257 . 1 1 1 32 32 THR HG23 H 1 1.343 0.02 . 1 . . . . A 21 THR HG23 . 34702 1 258 . 1 1 1 32 32 THR C C 13 176.171 0.2 . 1 . . . . A 21 THR C . 34702 1 259 . 1 1 1 32 32 THR CA C 13 67.552 0.2 . 1 . . . . A 21 THR CA . 34702 1 260 . 1 1 1 32 32 THR CB C 13 69.006 0.2 . 1 . . . . A 21 THR CB . 34702 1 261 . 1 1 1 32 32 THR CG2 C 13 21.78 0.2 . 1 . . . . A 21 THR CG2 . 34702 1 262 . 1 1 1 32 32 THR N N 15 116.704 0.2 . 1 . . . . A 21 THR N . 34702 1 263 . 1 1 1 33 33 VAL H H 1 8.255 0.02 . 1 . . . . A 22 VAL H . 34702 1 264 . 1 1 1 33 33 VAL HA H 1 3.915 0.02 . 1 . . . . A 22 VAL HA . 34702 1 265 . 1 1 1 33 33 VAL HB H 1 1.948 0.02 . 1 . . . . A 22 VAL HB . 34702 1 266 . 1 1 1 33 33 VAL HG11 H 1 0.609 0.02 . 2 . . . . A 22 VAL HG11 . 34702 1 267 . 1 1 1 33 33 VAL HG12 H 1 0.609 0.02 . 2 . . . . A 22 VAL HG12 . 34702 1 268 . 1 1 1 33 33 VAL HG13 H 1 0.609 0.02 . 2 . . . . A 22 VAL HG13 . 34702 1 269 . 1 1 1 33 33 VAL HG21 H 1 0.277 0.02 . 2 . . . . A 22 VAL HG21 . 34702 1 270 . 1 1 1 33 33 VAL HG22 H 1 0.277 0.02 . 2 . . . . A 22 VAL HG22 . 34702 1 271 . 1 1 1 33 33 VAL HG23 H 1 0.277 0.02 . 2 . . . . A 22 VAL HG23 . 34702 1 272 . 1 1 1 33 33 VAL C C 13 180.406 0.2 . 1 . . . . A 22 VAL C . 34702 1 273 . 1 1 1 33 33 VAL CA C 13 66.031 0.2 . 1 . . . . A 22 VAL CA . 34702 1 274 . 1 1 1 33 33 VAL CB C 13 31.959 0.2 . 1 . . . . A 22 VAL CB . 34702 1 275 . 1 1 1 33 33 VAL CG1 C 13 24.544 0.2 . 2 . . . . A 22 VAL CG1 . 34702 1 276 . 1 1 1 33 33 VAL CG2 C 13 20.447 0.2 . 2 . . . . A 22 VAL CG2 . 34702 1 277 . 1 1 1 33 33 VAL N N 15 120.561 0.2 . 1 . . . . A 22 VAL N . 34702 1 278 . 1 1 1 34 34 PHE H H 1 8.964 0.02 . 1 . . . . A 23 PHE H . 34702 1 279 . 1 1 1 34 34 PHE HA H 1 3.805 0.02 . 1 . . . . A 23 PHE HA . 34702 1 280 . 1 1 1 34 34 PHE HB2 H 1 2.269 0.02 . 1 . . . . A 23 PHE HB2 . 34702 1 281 . 1 1 1 34 34 PHE HB3 H 1 2.269 0.02 . 1 . . . . A 23 PHE HB3 . 34702 1 282 . 1 1 1 34 34 PHE HD1 H 1 7.104 0.02 . 1 . . . . A 23 PHE HD1 . 34702 1 283 . 1 1 1 34 34 PHE HD2 H 1 7.104 0.02 . 1 . . . . A 23 PHE HD2 . 34702 1 284 . 1 1 1 34 34 PHE HE1 H 1 7.172 0.02 . 1 . . . . A 23 PHE HE1 . 34702 1 285 . 1 1 1 34 34 PHE HE2 H 1 7.172 0.02 . 1 . . . . A 23 PHE HE2 . 34702 1 286 . 1 1 1 34 34 PHE HZ H 1 7.283 0.02 . 1 . . . . A 23 PHE HZ . 34702 1 287 . 1 1 1 34 34 PHE C C 13 176.011 0.2 . 1 . . . . A 23 PHE C . 34702 1 288 . 1 1 1 34 34 PHE CA C 13 62.185 0.2 . 1 . . . . A 23 PHE CA . 34702 1 289 . 1 1 1 34 34 PHE CB C 13 37.013 0.2 . 1 . . . . A 23 PHE CB . 34702 1 290 . 1 1 1 34 34 PHE N N 15 119.19 0.2 . 1 . . . . A 23 PHE N . 34702 1 291 . 1 1 1 35 35 GLU H H 1 8.061 0.02 . 1 . . . . A 24 GLU H . 34702 1 292 . 1 1 1 35 35 GLU HA H 1 4.382 0.02 . 1 . . . . A 24 GLU HA . 34702 1 293 . 1 1 1 35 35 GLU HB2 H 1 2.218 0.02 . 1 . . . . A 24 GLU HB2 . 34702 1 294 . 1 1 1 35 35 GLU HB3 H 1 2.218 0.02 . 1 . . . . A 24 GLU HB3 . 34702 1 295 . 1 1 1 35 35 GLU HG2 H 1 2.447 0.02 . 2 . . . . A 24 GLU HG2 . 34702 1 296 . 1 1 1 35 35 GLU HG3 H 1 2.756 0.02 . 2 . . . . A 24 GLU HG3 . 34702 1 297 . 1 1 1 35 35 GLU C C 13 177.632 0.2 . 1 . . . . A 24 GLU C . 34702 1 298 . 1 1 1 35 35 GLU CA C 13 56.853 0.2 . 1 . . . . A 24 GLU CA . 34702 1 299 . 1 1 1 35 35 GLU CB C 13 30.295 0.2 . 1 . . . . A 24 GLU CB . 34702 1 300 . 1 1 1 35 35 GLU CG C 13 37.452 0.2 . 1 . . . . A 24 GLU CG . 34702 1 301 . 1 1 1 35 35 GLU N N 15 115.583 0.2 . 1 . . . . A 24 GLU N . 34702 1 302 . 1 1 1 36 36 GLY H H 1 8.02 0.02 . 1 . . . . A 25 GLY H . 34702 1 303 . 1 1 1 36 36 GLY HA2 H 1 4.215 0.02 . 2 . . . . A 25 GLY HA2 . 34702 1 304 . 1 1 1 36 36 GLY HA3 H 1 4.088 0.02 . 2 . . . . A 25 GLY HA3 . 34702 1 305 . 1 1 1 36 36 GLY C C 13 176.018 0.2 . 1 . . . . A 25 GLY C . 34702 1 306 . 1 1 1 36 36 GLY CA C 13 46.205 0.2 . 1 . . . . A 25 GLY CA . 34702 1 307 . 1 1 1 36 36 GLY N N 15 107.473 0.2 . 1 . . . . A 25 GLY N . 34702 1 308 . 1 1 1 37 37 LYS H H 1 7.909 0.02 . 1 . . . . A 26 LYS H . 34702 1 309 . 1 1 1 37 37 LYS HA H 1 4.435 0.02 . 1 . . . . A 26 LYS HA . 34702 1 310 . 1 1 1 37 37 LYS HB2 H 1 1.819 0.02 . 2 . . . . A 26 LYS HB2 . 34702 1 311 . 1 1 1 37 37 LYS HB3 H 1 2.173 0.02 . 2 . . . . A 26 LYS HB3 . 34702 1 312 . 1 1 1 37 37 LYS HG2 H 1 1.354 0.02 . 1 . . . . A 26 LYS HG2 . 34702 1 313 . 1 1 1 37 37 LYS HG3 H 1 1.354 0.02 . 1 . . . . A 26 LYS HG3 . 34702 1 314 . 1 1 1 37 37 LYS HD2 H 1 1.735 0.02 . 1 . . . . A 26 LYS HD2 . 34702 1 315 . 1 1 1 37 37 LYS HD3 H 1 1.735 0.02 . 1 . . . . A 26 LYS HD3 . 34702 1 316 . 1 1 1 37 37 LYS HE2 H 1 3.011 0.02 . 1 . . . . A 26 LYS HE2 . 34702 1 317 . 1 1 1 37 37 LYS HE3 H 1 3.011 0.02 . 1 . . . . A 26 LYS HE3 . 34702 1 318 . 1 1 1 37 37 LYS C C 13 175.598 0.2 . 1 . . . . A 26 LYS C . 34702 1 319 . 1 1 1 37 37 LYS CA C 13 55.724 0.2 . 1 . . . . A 26 LYS CA . 34702 1 320 . 1 1 1 37 37 LYS CB C 13 34.071 0.2 . 1 . . . . A 26 LYS CB . 34702 1 321 . 1 1 1 37 37 LYS CG C 13 25.464 0.2 . 1 . . . . A 26 LYS CG . 34702 1 322 . 1 1 1 37 37 LYS CD C 13 29.108 0.2 . 1 . . . . A 26 LYS CD . 34702 1 323 . 1 1 1 37 37 LYS CE C 13 42.169 0.2 . 1 . . . . A 26 LYS CE . 34702 1 324 . 1 1 1 37 37 LYS N N 15 117.137 0.2 . 1 . . . . A 26 LYS N . 34702 1 325 . 1 1 1 38 38 HIS H H 1 8.998 0.02 . 1 . . . . A 27 HIS H . 34702 1 326 . 1 1 1 38 38 HIS HA H 1 4.367 0.02 . 1 . . . . A 27 HIS HA . 34702 1 327 . 1 1 1 38 38 HIS HB2 H 1 2.701 0.02 . 2 . . . . A 27 HIS HB2 . 34702 1 328 . 1 1 1 38 38 HIS HB3 H 1 3.72 0.02 . 2 . . . . A 27 HIS HB3 . 34702 1 329 . 1 1 1 38 38 HIS HD2 H 1 7.273 0.02 . 1 . . . . A 27 HIS HD2 . 34702 1 330 . 1 1 1 38 38 HIS HE1 H 1 7.805 0.02 . 1 . . . . A 27 HIS HE1 . 34702 1 331 . 1 1 1 38 38 HIS C C 13 175.692 0.2 . 1 . . . . A 27 HIS C . 34702 1 332 . 1 1 1 38 38 HIS CA C 13 58.205 0.2 . 1 . . . . A 27 HIS CA . 34702 1 333 . 1 1 1 38 38 HIS CB C 13 33.823 0.2 . 1 . . . . A 27 HIS CB . 34702 1 334 . 1 1 1 38 38 HIS CD2 C 13 117.931 0.2 . 1 . . . . A 27 HIS CD2 . 34702 1 335 . 1 1 1 38 38 HIS CE1 C 13 139.562 0.2 . 1 . . . . A 27 HIS CE1 . 34702 1 336 . 1 1 1 38 38 HIS N N 15 125.44 0.2 . 1 . . . . A 27 HIS N . 34702 1 337 . 1 1 1 39 39 GLN H H 1 8.358 0.02 . 1 . . . . A 28 GLN H . 34702 1 338 . 1 1 1 39 39 GLN HA H 1 4.004 0.02 . 1 . . . . A 28 GLN HA . 34702 1 339 . 1 1 1 39 39 GLN HB2 H 1 1.853 0.02 . 2 . . . . A 28 GLN HB2 . 34702 1 340 . 1 1 1 39 39 GLN HB3 H 1 1.987 0.02 . 2 . . . . A 28 GLN HB3 . 34702 1 341 . 1 1 1 39 39 GLN HG2 H 1 2.303 0.02 . 1 . . . . A 28 GLN HG2 . 34702 1 342 . 1 1 1 39 39 GLN HG3 H 1 2.303 0.02 . 1 . . . . A 28 GLN HG3 . 34702 1 343 . 1 1 1 39 39 GLN HE21 H 1 6.793 0.02 . 2 . . . . A 28 GLN HE21 . 34702 1 344 . 1 1 1 39 39 GLN HE22 H 1 7.426 0.02 . 2 . . . . A 28 GLN HE22 . 34702 1 345 . 1 1 1 39 39 GLN C C 13 176.319 0.2 . 1 . . . . A 28 GLN C . 34702 1 346 . 1 1 1 39 39 GLN CA C 13 57.847 0.2 . 1 . . . . A 28 GLN CA . 34702 1 347 . 1 1 1 39 39 GLN CB C 13 29.029 0.2 . 1 . . . . A 28 GLN CB . 34702 1 348 . 1 1 1 39 39 GLN CG C 13 33.928 0.2 . 1 . . . . A 28 GLN CG . 34702 1 349 . 1 1 1 39 39 GLN N N 15 123.472 0.2 . 1 . . . . A 28 GLN N . 34702 1 350 . 1 1 1 39 39 GLN NE2 N 15 112.436 0.2 . 1 . . . . A 28 GLN NE2 . 34702 1 351 . 1 1 1 40 40 GLN H H 1 9.88 0.02 . 1 . . . . A 29 GLN H . 34702 1 352 . 1 1 1 40 40 GLN HA H 1 4.286 0.02 . 1 . . . . A 29 GLN HA . 34702 1 353 . 1 1 1 40 40 GLN HB2 H 1 1.628 0.02 . 2 . . . . A 29 GLN HB2 . 34702 1 354 . 1 1 1 40 40 GLN HB3 H 1 1.4 0.02 . 2 . . . . A 29 GLN HB3 . 34702 1 355 . 1 1 1 40 40 GLN HG2 H 1 1.687 0.02 . 2 . . . . A 29 GLN HG2 . 34702 1 356 . 1 1 1 40 40 GLN HG3 H 1 1.927 0.02 . 2 . . . . A 29 GLN HG3 . 34702 1 357 . 1 1 1 40 40 GLN HE21 H 1 6.797 0.02 . 2 . . . . A 29 GLN HE21 . 34702 1 358 . 1 1 1 40 40 GLN HE22 H 1 7.238 0.02 . 2 . . . . A 29 GLN HE22 . 34702 1 359 . 1 1 1 40 40 GLN C C 13 175.425 0.2 . 1 . . . . A 29 GLN C . 34702 1 360 . 1 1 1 40 40 GLN CA C 13 56.468 0.2 . 1 . . . . A 29 GLN CA . 34702 1 361 . 1 1 1 40 40 GLN CB C 13 31.135 0.2 . 1 . . . . A 29 GLN CB . 34702 1 362 . 1 1 1 40 40 GLN CG C 13 33.483 0.2 . 1 . . . . A 29 GLN CG . 34702 1 363 . 1 1 1 40 40 GLN N N 15 120.095 0.2 . 1 . . . . A 29 GLN N . 34702 1 364 . 1 1 1 40 40 GLN NE2 N 15 111.916 0.2 . 1 . . . . A 29 GLN NE2 . 34702 1 365 . 1 1 1 41 41 PHE H H 1 7.815 0.02 . 1 . . . . A 30 PHE H . 34702 1 366 . 1 1 1 41 41 PHE HA H 1 4.631 0.02 . 1 . . . . A 30 PHE HA . 34702 1 367 . 1 1 1 41 41 PHE HB2 H 1 2.642 0.02 . 2 . . . . A 30 PHE HB2 . 34702 1 368 . 1 1 1 41 41 PHE HB3 H 1 2.306 0.02 . 2 . . . . A 30 PHE HB3 . 34702 1 369 . 1 1 1 41 41 PHE HD1 H 1 6.588 0.02 . 1 . . . . A 30 PHE HD1 . 34702 1 370 . 1 1 1 41 41 PHE HD2 H 1 6.588 0.02 . 1 . . . . A 30 PHE HD2 . 34702 1 371 . 1 1 1 41 41 PHE HE1 H 1 7.212 0.02 . 1 . . . . A 30 PHE HE1 . 34702 1 372 . 1 1 1 41 41 PHE HE2 H 1 7.212 0.02 . 1 . . . . A 30 PHE HE2 . 34702 1 373 . 1 1 1 41 41 PHE HZ H 1 7.297 0.02 . 1 . . . . A 30 PHE HZ . 34702 1 374 . 1 1 1 41 41 PHE C C 13 173.007 0.2 . 1 . . . . A 30 PHE C . 34702 1 375 . 1 1 1 41 41 PHE CA C 13 57.259 0.2 . 1 . . . . A 30 PHE CA . 34702 1 376 . 1 1 1 41 41 PHE CB C 13 39.79 0.2 . 1 . . . . A 30 PHE CB . 34702 1 377 . 1 1 1 41 41 PHE CD1 C 13 131.325 0.2 . 1 . . . . A 30 PHE CD1 . 34702 1 378 . 1 1 1 41 41 PHE CD2 C 13 131.325 0.2 . 1 . . . . A 30 PHE CD2 . 34702 1 379 . 1 1 1 41 41 PHE N N 15 119.961 0.2 . 1 . . . . A 30 PHE N . 34702 1 380 . 1 1 1 42 42 LEU H H 1 8.083 0.02 . 1 . . . . A 31 LEU H . 34702 1 381 . 1 1 1 42 42 LEU HA H 1 4.568 0.02 . 1 . . . . A 31 LEU HA . 34702 1 382 . 1 1 1 42 42 LEU HB2 H 1 1.541 0.02 . 1 . . . . A 31 LEU HB2 . 34702 1 383 . 1 1 1 42 42 LEU HB3 H 1 1.541 0.02 . 1 . . . . A 31 LEU HB3 . 34702 1 384 . 1 1 1 42 42 LEU HG H 1 1.532 0.02 . 1 . . . . A 31 LEU HG . 34702 1 385 . 1 1 1 42 42 LEU HD11 H 1 0.799 0.02 . 1 . . . . A 31 LEU HD11 . 34702 1 386 . 1 1 1 42 42 LEU HD12 H 1 0.799 0.02 . 1 . . . . A 31 LEU HD12 . 34702 1 387 . 1 1 1 42 42 LEU HD13 H 1 0.799 0.02 . 1 . . . . A 31 LEU HD13 . 34702 1 388 . 1 1 1 42 42 LEU HD21 H 1 0.81 0.02 . 1 . . . . A 31 LEU HD21 . 34702 1 389 . 1 1 1 42 42 LEU HD22 H 1 0.81 0.02 . 1 . . . . A 31 LEU HD22 . 34702 1 390 . 1 1 1 42 42 LEU HD23 H 1 0.81 0.02 . 1 . . . . A 31 LEU HD23 . 34702 1 391 . 1 1 1 42 42 LEU C C 13 176.823 0.2 . 1 . . . . A 31 LEU C . 34702 1 392 . 1 1 1 42 42 LEU CA C 13 53.821 0.2 . 1 . . . . A 31 LEU CA . 34702 1 393 . 1 1 1 42 42 LEU CB C 13 43.05 0.2 . 1 . . . . A 31 LEU CB . 34702 1 394 . 1 1 1 42 42 LEU CG C 13 27.293 0.2 . 1 . . . . A 31 LEU CG . 34702 1 395 . 1 1 1 42 42 LEU CD1 C 13 23.638 0.2 . 1 . . . . A 31 LEU CD1 . 34702 1 396 . 1 1 1 42 42 LEU CD2 C 13 24.687 0.2 . 1 . . . . A 31 LEU CD2 . 34702 1 397 . 1 1 1 42 42 LEU N N 15 124.025 0.2 . 1 . . . . A 31 LEU N . 34702 1 398 . 1 1 1 43 43 VAL H H 1 8.391 0.02 . 1 . . . . A 32 VAL H . 34702 1 399 . 1 1 1 43 43 VAL HA H 1 4.492 0.02 . 1 . . . . A 32 VAL HA . 34702 1 400 . 1 1 1 43 43 VAL HB H 1 1.768 0.02 . 1 . . . . A 32 VAL HB . 34702 1 401 . 1 1 1 43 43 VAL HG11 H 1 0.471 0.02 . 2 . . . . A 32 VAL HG11 . 34702 1 402 . 1 1 1 43 43 VAL HG12 H 1 0.471 0.02 . 2 . . . . A 32 VAL HG12 . 34702 1 403 . 1 1 1 43 43 VAL HG13 H 1 0.471 0.02 . 2 . . . . A 32 VAL HG13 . 34702 1 404 . 1 1 1 43 43 VAL HG21 H 1 0.461 0.02 . 2 . . . . A 32 VAL HG21 . 34702 1 405 . 1 1 1 43 43 VAL HG22 H 1 0.461 0.02 . 2 . . . . A 32 VAL HG22 . 34702 1 406 . 1 1 1 43 43 VAL HG23 H 1 0.461 0.02 . 2 . . . . A 32 VAL HG23 . 34702 1 407 . 1 1 1 43 43 VAL C C 13 173.89 0.2 . 1 . . . . A 32 VAL C . 34702 1 408 . 1 1 1 43 43 VAL CA C 13 58.408 0.2 . 1 . . . . A 32 VAL CA . 34702 1 409 . 1 1 1 43 43 VAL CB C 13 32.908 0.2 . 1 . . . . A 32 VAL CB . 34702 1 410 . 1 1 1 43 43 VAL CG1 C 13 20.133 0.2 . 2 . . . . A 32 VAL CG1 . 34702 1 411 . 1 1 1 43 43 VAL CG2 C 13 21.61 0.2 . 2 . . . . A 32 VAL CG2 . 34702 1 412 . 1 1 1 43 43 VAL N N 15 118.69 0.2 . 1 . . . . A 32 VAL N . 34702 1 413 . 1 1 1 44 44 PRO HA H 1 4.403 0.02 . 1 . . . . A 33 PRO HA . 34702 1 414 . 1 1 1 44 44 PRO HB2 H 1 2.378 0.02 . 2 . . . . A 33 PRO HB2 . 34702 1 415 . 1 1 1 44 44 PRO HB3 H 1 1.942 0.02 . 2 . . . . A 33 PRO HB3 . 34702 1 416 . 1 1 1 44 44 PRO HG2 H 1 2.113 0.02 . 1 . . . . A 33 PRO HG2 . 34702 1 417 . 1 1 1 44 44 PRO HG3 H 1 2.113 0.02 . 1 . . . . A 33 PRO HG3 . 34702 1 418 . 1 1 1 44 44 PRO HD2 H 1 3.979 0.02 . 2 . . . . A 33 PRO HD2 . 34702 1 419 . 1 1 1 44 44 PRO HD3 H 1 3.402 0.02 . 2 . . . . A 33 PRO HD3 . 34702 1 420 . 1 1 1 44 44 PRO CA C 13 63.973 0.2 . 1 . . . . A 33 PRO CA . 34702 1 421 . 1 1 1 44 44 PRO CB C 13 32.261 0.2 . 1 . . . . A 33 PRO CB . 34702 1 422 . 1 1 1 44 44 PRO CG C 13 27.523 0.2 . 1 . . . . A 33 PRO CG . 34702 1 423 . 1 1 1 44 44 PRO CD C 13 50.994 0.2 . 1 . . . . A 33 PRO CD . 34702 1 424 . 1 1 1 46 46 ASN HA H 1 4.413 0.02 . 1 . . . . A 35 ASN HA . 34702 1 425 . 1 1 1 46 46 ASN HB2 H 1 2.862 0.02 . 1 . . . . A 35 ASN HB2 . 34702 1 426 . 1 1 1 46 46 ASN HB3 H 1 2.862 0.02 . 1 . . . . A 35 ASN HB3 . 34702 1 427 . 1 1 1 46 46 ASN C C 13 177.287 0.2 . 1 . . . . A 35 ASN C . 34702 1 428 . 1 1 1 46 46 ASN CA C 13 56.265 0.2 . 1 . . . . A 35 ASN CA . 34702 1 429 . 1 1 1 46 46 ASN CB C 13 36.97 0.2 . 1 . . . . A 35 ASN CB . 34702 1 430 . 1 1 1 47 47 VAL H H 1 7.201 0.02 . 1 . . . . A 36 VAL H . 34702 1 431 . 1 1 1 47 47 VAL HA H 1 3.792 0.02 . 1 . . . . A 36 VAL HA . 34702 1 432 . 1 1 1 47 47 VAL HB H 1 2.092 0.02 . 1 . . . . A 36 VAL HB . 34702 1 433 . 1 1 1 47 47 VAL HG11 H 1 1.043 0.02 . 2 . . . . A 36 VAL HG11 . 34702 1 434 . 1 1 1 47 47 VAL HG12 H 1 1.043 0.02 . 2 . . . . A 36 VAL HG12 . 34702 1 435 . 1 1 1 47 47 VAL HG13 H 1 1.043 0.02 . 2 . . . . A 36 VAL HG13 . 34702 1 436 . 1 1 1 47 47 VAL HG21 H 1 0.989 0.02 . 2 . . . . A 36 VAL HG21 . 34702 1 437 . 1 1 1 47 47 VAL HG22 H 1 0.989 0.02 . 2 . . . . A 36 VAL HG22 . 34702 1 438 . 1 1 1 47 47 VAL HG23 H 1 0.989 0.02 . 2 . . . . A 36 VAL HG23 . 34702 1 439 . 1 1 1 47 47 VAL C C 13 177.444 0.2 . 1 . . . . A 36 VAL C . 34702 1 440 . 1 1 1 47 47 VAL CA C 13 65.4 0.2 . 1 . . . . A 36 VAL CA . 34702 1 441 . 1 1 1 47 47 VAL CB C 13 32.115 0.2 . 1 . . . . A 36 VAL CB . 34702 1 442 . 1 1 1 47 47 VAL CG1 C 13 22.038 0.2 . 2 . . . . A 36 VAL CG1 . 34702 1 443 . 1 1 1 47 47 VAL CG2 C 13 21.448 0.2 . 2 . . . . A 36 VAL CG2 . 34702 1 444 . 1 1 1 47 47 VAL N N 15 122.001 0.2 . 1 . . . . A 36 VAL N . 34702 1 445 . 1 1 1 48 48 ARG H H 1 7.883 0.02 . 1 . . . . A 37 ARG H . 34702 1 446 . 1 1 1 48 48 ARG HA H 1 4.322 0.02 . 1 . . . . A 37 ARG HA . 34702 1 447 . 1 1 1 48 48 ARG HB2 H 1 1.824 0.02 . 1 . . . . A 37 ARG HB2 . 34702 1 448 . 1 1 1 48 48 ARG HB3 H 1 1.824 0.02 . 1 . . . . A 37 ARG HB3 . 34702 1 449 . 1 1 1 48 48 ARG HG2 H 1 1.51 0.02 . 1 . . . . A 37 ARG HG2 . 34702 1 450 . 1 1 1 48 48 ARG HG3 H 1 1.51 0.02 . 1 . . . . A 37 ARG HG3 . 34702 1 451 . 1 1 1 48 48 ARG HD2 H 1 3.283 0.02 . 1 . . . . A 37 ARG HD2 . 34702 1 452 . 1 1 1 48 48 ARG HD3 H 1 3.283 0.02 . 1 . . . . A 37 ARG HD3 . 34702 1 453 . 1 1 1 48 48 ARG C C 13 178.115 0.2 . 1 . . . . A 37 ARG C . 34702 1 454 . 1 1 1 48 48 ARG CA C 13 59.364 0.2 . 1 . . . . A 37 ARG CA . 34702 1 455 . 1 1 1 48 48 ARG CB C 13 30.505 0.2 . 1 . . . . A 37 ARG CB . 34702 1 456 . 1 1 1 48 48 ARG CG C 13 27.664 0.2 . 1 . . . . A 37 ARG CG . 34702 1 457 . 1 1 1 48 48 ARG CD C 13 43.143 0.2 . 1 . . . . A 37 ARG CD . 34702 1 458 . 1 1 1 48 48 ARG N N 15 122.418 0.2 . 1 . . . . A 37 ARG N . 34702 1 459 . 1 1 1 49 49 LEU H H 1 8.3 0.02 . 1 . . . . A 38 LEU H . 34702 1 460 . 1 1 1 49 49 LEU HA H 1 4.081 0.02 . 1 . . . . A 38 LEU HA . 34702 1 461 . 1 1 1 49 49 LEU HB2 H 1 1.787 0.02 . 1 . . . . A 38 LEU HB2 . 34702 1 462 . 1 1 1 49 49 LEU HB3 H 1 1.787 0.02 . 1 . . . . A 38 LEU HB3 . 34702 1 463 . 1 1 1 49 49 LEU HG H 1 1.796 0.02 . 1 . . . . A 38 LEU HG . 34702 1 464 . 1 1 1 49 49 LEU HD11 H 1 0.897 0.02 . 2 . . . . A 38 LEU HD11 . 34702 1 465 . 1 1 1 49 49 LEU HD12 H 1 0.897 0.02 . 2 . . . . A 38 LEU HD12 . 34702 1 466 . 1 1 1 49 49 LEU HD13 H 1 0.897 0.02 . 2 . . . . A 38 LEU HD13 . 34702 1 467 . 1 1 1 49 49 LEU HD21 H 1 0.887 0.02 . 2 . . . . A 38 LEU HD21 . 34702 1 468 . 1 1 1 49 49 LEU HD22 H 1 0.887 0.02 . 2 . . . . A 38 LEU HD22 . 34702 1 469 . 1 1 1 49 49 LEU HD23 H 1 0.887 0.02 . 2 . . . . A 38 LEU HD23 . 34702 1 470 . 1 1 1 49 49 LEU C C 13 179.407 0.2 . 1 . . . . A 38 LEU C . 34702 1 471 . 1 1 1 49 49 LEU CA C 13 57.794 0.2 . 1 . . . . A 38 LEU CA . 34702 1 472 . 1 1 1 49 49 LEU CB C 13 41.887 0.2 . 1 . . . . A 38 LEU CB . 34702 1 473 . 1 1 1 49 49 LEU CG C 13 26.832 0.2 . 1 . . . . A 38 LEU CG . 34702 1 474 . 1 1 1 49 49 LEU CD1 C 13 25.199 0.2 . 2 . . . . A 38 LEU CD1 . 34702 1 475 . 1 1 1 49 49 LEU CD2 C 13 22.953 0.2 . 2 . . . . A 38 LEU CD2 . 34702 1 476 . 1 1 1 49 49 LEU N N 15 117.146 0.2 . 1 . . . . A 38 LEU N . 34702 1 477 . 1 1 1 50 50 LYS H H 1 7.52 0.02 . 1 . . . . A 39 LYS H . 34702 1 478 . 1 1 1 50 50 LYS HA H 1 4.001 0.02 . 1 . . . . A 39 LYS HA . 34702 1 479 . 1 1 1 50 50 LYS HB2 H 1 1.885 0.02 . 1 . . . . A 39 LYS HB2 . 34702 1 480 . 1 1 1 50 50 LYS HB3 H 1 1.885 0.02 . 1 . . . . A 39 LYS HB3 . 34702 1 481 . 1 1 1 50 50 LYS HG2 H 1 1.372 0.02 . 1 . . . . A 39 LYS HG2 . 34702 1 482 . 1 1 1 50 50 LYS HG3 H 1 1.372 0.02 . 1 . . . . A 39 LYS HG3 . 34702 1 483 . 1 1 1 50 50 LYS HD2 H 1 1.668 0.02 . 1 . . . . A 39 LYS HD2 . 34702 1 484 . 1 1 1 50 50 LYS HD3 H 1 1.668 0.02 . 1 . . . . A 39 LYS HD3 . 34702 1 485 . 1 1 1 50 50 LYS HE2 H 1 2.989 0.02 . 1 . . . . A 39 LYS HE2 . 34702 1 486 . 1 1 1 50 50 LYS HE3 H 1 2.989 0.02 . 1 . . . . A 39 LYS HE3 . 34702 1 487 . 1 1 1 50 50 LYS C C 13 177.678 0.2 . 1 . . . . A 39 LYS C . 34702 1 488 . 1 1 1 50 50 LYS CA C 13 59.122 0.2 . 1 . . . . A 39 LYS CA . 34702 1 489 . 1 1 1 50 50 LYS CB C 13 32.469 0.2 . 1 . . . . A 39 LYS CB . 34702 1 490 . 1 1 1 50 50 LYS CG C 13 25.119 0.2 . 1 . . . . A 39 LYS CG . 34702 1 491 . 1 1 1 50 50 LYS CD C 13 29.287 0.2 . 1 . . . . A 39 LYS CD . 34702 1 492 . 1 1 1 50 50 LYS CE C 13 42.115 0.2 . 1 . . . . A 39 LYS CE . 34702 1 493 . 1 1 1 50 50 LYS N N 15 119.447 0.2 . 1 . . . . A 39 LYS N . 34702 1 494 . 1 1 1 51 51 PHE H H 1 7.958 0.02 . 1 . . . . A 40 PHE H . 34702 1 495 . 1 1 1 51 51 PHE HA H 1 4.359 0.02 . 1 . . . . A 40 PHE HA . 34702 1 496 . 1 1 1 51 51 PHE HB2 H 1 3.358 0.02 . 2 . . . . A 40 PHE HB2 . 34702 1 497 . 1 1 1 51 51 PHE HB3 H 1 3.152 0.02 . 2 . . . . A 40 PHE HB3 . 34702 1 498 . 1 1 1 51 51 PHE HD1 H 1 7.112 0.02 . 1 . . . . A 40 PHE HD1 . 34702 1 499 . 1 1 1 51 51 PHE HD2 H 1 7.112 0.02 . 1 . . . . A 40 PHE HD2 . 34702 1 500 . 1 1 1 51 51 PHE HE1 H 1 6.864 0.02 . 1 . . . . A 40 PHE HE1 . 34702 1 501 . 1 1 1 51 51 PHE HE2 H 1 6.864 0.02 . 1 . . . . A 40 PHE HE2 . 34702 1 502 . 1 1 1 51 51 PHE HZ H 1 7.049 0.02 . 1 . . . . A 40 PHE HZ . 34702 1 503 . 1 1 1 51 51 PHE C C 13 177.248 0.2 . 1 . . . . A 40 PHE C . 34702 1 504 . 1 1 1 51 51 PHE CA C 13 60.134 0.2 . 1 . . . . A 40 PHE CA . 34702 1 505 . 1 1 1 51 51 PHE CB C 13 39.291 0.2 . 1 . . . . A 40 PHE CB . 34702 1 506 . 1 1 1 51 51 PHE N N 15 119.535 0.2 . 1 . . . . A 40 PHE N . 34702 1 507 . 1 1 1 52 52 LEU H H 1 8.101 0.02 . 1 . . . . A 41 LEU H . 34702 1 508 . 1 1 1 52 52 LEU HA H 1 3.964 0.02 . 1 . . . . A 41 LEU HA . 34702 1 509 . 1 1 1 52 52 LEU HB2 H 1 1.848 0.02 . 2 . . . . A 41 LEU HB2 . 34702 1 510 . 1 1 1 52 52 LEU HB3 H 1 1.564 0.02 . 2 . . . . A 41 LEU HB3 . 34702 1 511 . 1 1 1 52 52 LEU HG H 1 2.005 0.02 . 1 . . . . A 41 LEU HG . 34702 1 512 . 1 1 1 52 52 LEU HD11 H 1 0.979 0.02 . 2 . . . . A 41 LEU HD11 . 34702 1 513 . 1 1 1 52 52 LEU HD12 H 1 0.979 0.02 . 2 . . . . A 41 LEU HD12 . 34702 1 514 . 1 1 1 52 52 LEU HD13 H 1 0.979 0.02 . 2 . . . . A 41 LEU HD13 . 34702 1 515 . 1 1 1 52 52 LEU HD21 H 1 0.956 0.02 . 2 . . . . A 41 LEU HD21 . 34702 1 516 . 1 1 1 52 52 LEU HD22 H 1 0.956 0.02 . 2 . . . . A 41 LEU HD22 . 34702 1 517 . 1 1 1 52 52 LEU HD23 H 1 0.956 0.02 . 2 . . . . A 41 LEU HD23 . 34702 1 518 . 1 1 1 52 52 LEU C C 13 178.602 0.2 . 1 . . . . A 41 LEU C . 34702 1 519 . 1 1 1 52 52 LEU CA C 13 56.631 0.2 . 1 . . . . A 41 LEU CA . 34702 1 520 . 1 1 1 52 52 LEU CB C 13 42.217 0.2 . 1 . . . . A 41 LEU CB . 34702 1 521 . 1 1 1 52 52 LEU CG C 13 26.776 0.2 . 1 . . . . A 41 LEU CG . 34702 1 522 . 1 1 1 52 52 LEU CD1 C 13 25.606 0.2 . 2 . . . . A 41 LEU CD1 . 34702 1 523 . 1 1 1 52 52 LEU CD2 C 13 23.101 0.2 . 2 . . . . A 41 LEU CD2 . 34702 1 524 . 1 1 1 52 52 LEU N N 15 118.457 0.2 . 1 . . . . A 41 LEU N . 34702 1 525 . 1 1 1 53 53 ARG H H 1 7.782 0.02 . 1 . . . . A 42 ARG H . 34702 1 526 . 1 1 1 53 53 ARG HA H 1 4.179 0.02 . 1 . . . . A 42 ARG HA . 34702 1 527 . 1 1 1 53 53 ARG HB2 H 1 1.889 0.02 . 1 . . . . A 42 ARG HB2 . 34702 1 528 . 1 1 1 53 53 ARG HB3 H 1 1.889 0.02 . 1 . . . . A 42 ARG HB3 . 34702 1 529 . 1 1 1 53 53 ARG HG2 H 1 1.723 0.02 . 1 . . . . A 42 ARG HG2 . 34702 1 530 . 1 1 1 53 53 ARG HG3 H 1 1.723 0.02 . 1 . . . . A 42 ARG HG3 . 34702 1 531 . 1 1 1 53 53 ARG HD2 H 1 3.189 0.02 . 1 . . . . A 42 ARG HD2 . 34702 1 532 . 1 1 1 53 53 ARG HD3 H 1 3.189 0.02 . 1 . . . . A 42 ARG HD3 . 34702 1 533 . 1 1 1 53 53 ARG C C 13 176.878 0.2 . 1 . . . . A 42 ARG C . 34702 1 534 . 1 1 1 53 53 ARG CA C 13 57.593 0.2 . 1 . . . . A 42 ARG CA . 34702 1 535 . 1 1 1 53 53 ARG CB C 13 30.701 0.2 . 1 . . . . A 42 ARG CB . 34702 1 536 . 1 1 1 53 53 ARG CG C 13 27.047 0.2 . 1 . . . . A 42 ARG CG . 34702 1 537 . 1 1 1 53 53 ARG CD C 13 43.617 0.2 . 1 . . . . A 42 ARG CD . 34702 1 538 . 1 1 1 53 53 ARG N N 15 118.845 0.2 . 1 . . . . A 42 ARG N . 34702 1 539 . 1 1 1 54 54 ASP H H 1 7.857 0.02 . 1 . . . . A 43 ASP H . 34702 1 540 . 1 1 1 54 54 ASP HA H 1 4.648 0.02 . 1 . . . . A 43 ASP HA . 34702 1 541 . 1 1 1 54 54 ASP HB2 H 1 2.747 0.02 . 2 . . . . A 43 ASP HB2 . 34702 1 542 . 1 1 1 54 54 ASP HB3 H 1 2.572 0.02 . 2 . . . . A 43 ASP HB3 . 34702 1 543 . 1 1 1 54 54 ASP C C 13 175.333 0.2 . 1 . . . . A 43 ASP C . 34702 1 544 . 1 1 1 54 54 ASP CA C 13 54.47 0.2 . 1 . . . . A 43 ASP CA . 34702 1 545 . 1 1 1 54 54 ASP CB C 13 40.858 0.2 . 1 . . . . A 43 ASP CB . 34702 1 546 . 1 1 1 54 54 ASP N N 15 119.527 0.2 . 1 . . . . A 43 ASP N . 34702 1 547 . 1 1 1 55 55 ARG H H 1 7.43 0.02 . 1 . . . . A 44 ARG H . 34702 1 548 . 1 1 1 55 55 ARG HA H 1 3.938 0.02 . 1 . . . . A 44 ARG HA . 34702 1 549 . 1 1 1 55 55 ARG HB2 H 1 1.584 0.02 . 2 . . . . A 44 ARG HB2 . 34702 1 550 . 1 1 1 55 55 ARG HB3 H 1 1.62 0.02 . 2 . . . . A 44 ARG HB3 . 34702 1 551 . 1 1 1 55 55 ARG HG2 H 1 1.447 0.02 . 1 . . . . A 44 ARG HG2 . 34702 1 552 . 1 1 1 55 55 ARG HG3 H 1 1.447 0.02 . 1 . . . . A 44 ARG HG3 . 34702 1 553 . 1 1 1 55 55 ARG HD2 H 1 2.901 0.02 . 1 . . . . A 44 ARG HD2 . 34702 1 554 . 1 1 1 55 55 ARG HD3 H 1 2.901 0.02 . 1 . . . . A 44 ARG HD3 . 34702 1 555 . 1 1 1 55 55 ARG C C 13 180.887 0.2 . 1 . . . . A 44 ARG C . 34702 1 556 . 1 1 1 55 55 ARG CA C 13 57.714 0.2 . 1 . . . . A 44 ARG CA . 34702 1 557 . 1 1 1 55 55 ARG CB C 13 30.864 0.2 . 1 . . . . A 44 ARG CB . 34702 1 558 . 1 1 1 55 55 ARG CG C 13 26.481 0.2 . 1 . . . . A 44 ARG CG . 34702 1 559 . 1 1 1 55 55 ARG CD C 13 43.362 0.2 . 1 . . . . A 44 ARG CD . 34702 1 560 . 1 1 1 55 55 ARG N N 15 125.526 0.2 . 1 . . . . A 44 ARG N . 34702 1 561 . 2 2 2 4 4 GLY HA2 H 1 4.041 0.02 . 1 . . . . B 191 GLY HA2 . 34702 1 562 . 2 2 2 4 4 GLY HA3 H 1 4.041 0.02 . 1 . . . . B 191 GLY HA3 . 34702 1 563 . 2 2 2 4 4 GLY C C 13 174.241 0.2 . 1 . . . . B 191 GLY C . 34702 1 564 . 2 2 2 4 4 GLY CA C 13 45.335 0.2 . 1 . . . . B 191 GLY CA . 34702 1 565 . 2 2 2 5 5 THR H H 1 8.077 0.02 . 1 . . . . B 192 THR H . 34702 1 566 . 2 2 2 5 5 THR HA H 1 4.458 0.02 . 1 . . . . B 192 THR HA . 34702 1 567 . 2 2 2 5 5 THR HB H 1 4.332 0.02 . 1 . . . . B 192 THR HB . 34702 1 568 . 2 2 2 5 5 THR HG21 H 1 1.232 0.02 . 1 . . . . B 192 THR HG21 . 34702 1 569 . 2 2 2 5 5 THR HG22 H 1 1.232 0.02 . 1 . . . . B 192 THR HG22 . 34702 1 570 . 2 2 2 5 5 THR HG23 H 1 1.232 0.02 . 1 . . . . B 192 THR HG23 . 34702 1 571 . 2 2 2 5 5 THR CA C 13 61.339 0.2 . 1 . . . . B 192 THR CA . 34702 1 572 . 2 2 2 5 5 THR CB C 13 70.204 0.2 . 1 . . . . B 192 THR CB . 34702 1 573 . 2 2 2 5 5 THR CG2 C 13 21.257 0.2 . 1 . . . . B 192 THR CG2 . 34702 1 574 . 2 2 2 5 5 THR N N 15 113.511 0.2 . 1 . . . . B 192 THR N . 34702 1 575 . 2 2 2 6 6 THR H H 1 8.38 0.02 . 1 . . . . B 193 THR H . 34702 1 576 . 2 2 2 6 6 THR HA H 1 4.484 0.02 . 1 . . . . B 193 THR HA . 34702 1 577 . 2 2 2 6 6 THR HB H 1 4.353 0.02 . 1 . . . . B 193 THR HB . 34702 1 578 . 2 2 2 6 6 THR HG21 H 1 1.269 0.02 . 1 . . . . B 193 THR HG21 . 34702 1 579 . 2 2 2 6 6 THR HG22 H 1 1.269 0.02 . 1 . . . . B 193 THR HG22 . 34702 1 580 . 2 2 2 6 6 THR HG23 H 1 1.269 0.02 . 1 . . . . B 193 THR HG23 . 34702 1 581 . 2 2 2 6 6 THR CA C 13 61.71 0.2 . 1 . . . . B 193 THR CA . 34702 1 582 . 2 2 2 6 6 THR CB C 13 69.866 0.2 . 1 . . . . B 193 THR CB . 34702 1 583 . 2 2 2 6 6 THR CG2 C 13 21.065 0.2 . 1 . . . . B 193 THR CG2 . 34702 1 584 . 2 2 2 6 6 THR N N 15 116.477 0.2 . 1 . . . . B 193 THR N . 34702 1 585 . 2 2 2 7 7 ASN H H 1 9.38 0.02 . 1 . . . . B 194 ASN H . 34702 1 586 . 2 2 2 7 7 ASN HA H 1 4.792 0.02 . 1 . . . . B 194 ASN HA . 34702 1 587 . 2 2 2 7 7 ASN HB2 H 1 3.055 0.02 . 1 . . . . B 194 ASN HB2 . 34702 1 588 . 2 2 2 7 7 ASN HB3 H 1 3.055 0.02 . 1 . . . . B 194 ASN HB3 . 34702 1 589 . 2 2 2 7 7 ASN HD21 H 1 7.078 0.02 . 2 . . . . B 194 ASN HD21 . 34702 1 590 . 2 2 2 7 7 ASN HD22 H 1 8.15 0.02 . 2 . . . . B 194 ASN HD22 . 34702 1 591 . 2 2 2 7 7 ASN C C 13 175.829 0.2 . 1 . . . . B 194 ASN C . 34702 1 592 . 2 2 2 7 7 ASN CA C 13 54.636 0.2 . 1 . . . . B 194 ASN CA . 34702 1 593 . 2 2 2 7 7 ASN CB C 13 38.682 0.2 . 1 . . . . B 194 ASN CB . 34702 1 594 . 2 2 2 7 7 ASN N N 15 122.364 0.2 . 1 . . . . B 194 ASN N . 34702 1 595 . 2 2 2 7 7 ASN ND2 N 15 113.979 0.2 . 1 . . . . B 194 ASN ND2 . 34702 1 596 . 2 2 2 8 8 GLN H H 1 8.399 0.02 . 1 . . . . B 195 GLN H . 34702 1 597 . 2 2 2 8 8 GLN HA H 1 4.009 0.02 . 1 . . . . B 195 GLN HA . 34702 1 598 . 2 2 2 8 8 GLN HB2 H 1 2.072 0.02 . 1 . . . . B 195 GLN HB2 . 34702 1 599 . 2 2 2 8 8 GLN HB3 H 1 2.072 0.02 . 1 . . . . B 195 GLN HB3 . 34702 1 600 . 2 2 2 8 8 GLN HG2 H 1 2.35 0.02 . 2 . . . . B 195 GLN HG2 . 34702 1 601 . 2 2 2 8 8 GLN HG3 H 1 2.433 0.02 . 2 . . . . B 195 GLN HG3 . 34702 1 602 . 2 2 2 8 8 GLN HE21 H 1 6.964 0.02 . 2 . . . . B 195 GLN HE21 . 34702 1 603 . 2 2 2 8 8 GLN HE22 H 1 7.574 0.02 . 2 . . . . B 195 GLN HE22 . 34702 1 604 . 2 2 2 8 8 GLN C C 13 179.313 0.2 . 1 . . . . B 195 GLN C . 34702 1 605 . 2 2 2 8 8 GLN CA C 13 59.641 0.2 . 1 . . . . B 195 GLN CA . 34702 1 606 . 2 2 2 8 8 GLN CB C 13 29.225 0.2 . 1 . . . . B 195 GLN CB . 34702 1 607 . 2 2 2 8 8 GLN CG C 13 35.978 0.2 . 1 . . . . B 195 GLN CG . 34702 1 608 . 2 2 2 8 8 GLN N N 15 121.536 0.2 . 1 . . . . B 195 GLN N . 34702 1 609 . 2 2 2 8 8 GLN NE2 N 15 111.681 0.2 . 1 . . . . B 195 GLN NE2 . 34702 1 610 . 2 2 2 9 9 LYS H H 1 7.661 0.02 . 1 . . . . B 196 LYS H . 34702 1 611 . 2 2 2 9 9 LYS HA H 1 4.011 0.02 . 1 . . . . B 196 LYS HA . 34702 1 612 . 2 2 2 9 9 LYS HB2 H 1 2.013 0.02 . 1 . . . . B 196 LYS HB2 . 34702 1 613 . 2 2 2 9 9 LYS HB3 H 1 2.013 0.02 . 1 . . . . B 196 LYS HB3 . 34702 1 614 . 2 2 2 9 9 LYS HG2 H 1 1.583 0.02 . 2 . . . . B 196 LYS HG2 . 34702 1 615 . 2 2 2 9 9 LYS HG3 H 1 1.434 0.02 . 2 . . . . B 196 LYS HG3 . 34702 1 616 . 2 2 2 9 9 LYS HD2 H 1 1.74 0.02 . 1 . . . . B 196 LYS HD2 . 34702 1 617 . 2 2 2 9 9 LYS HD3 H 1 1.74 0.02 . 1 . . . . B 196 LYS HD3 . 34702 1 618 . 2 2 2 9 9 LYS HE2 H 1 3.017 0.02 . 1 . . . . B 196 LYS HE2 . 34702 1 619 . 2 2 2 9 9 LYS HE3 H 1 3.017 0.02 . 1 . . . . B 196 LYS HE3 . 34702 1 620 . 2 2 2 9 9 LYS C C 13 179.574 0.2 . 1 . . . . B 196 LYS C . 34702 1 621 . 2 2 2 9 9 LYS CA C 13 59.539 0.2 . 1 . . . . B 196 LYS CA . 34702 1 622 . 2 2 2 9 9 LYS CB C 13 32.098 0.2 . 1 . . . . B 196 LYS CB . 34702 1 623 . 2 2 2 9 9 LYS CG C 13 25.226 0.2 . 1 . . . . B 196 LYS CG . 34702 1 624 . 2 2 2 9 9 LYS CD C 13 29.223 0.2 . 1 . . . . B 196 LYS CD . 34702 1 625 . 2 2 2 9 9 LYS CE C 13 41.902 0.2 . 1 . . . . B 196 LYS CE . 34702 1 626 . 2 2 2 9 9 LYS N N 15 117.711 0.2 . 1 . . . . B 196 LYS N . 34702 1 627 . 2 2 2 10 10 GLU H H 1 7.505 0.02 . 1 . . . . B 197 GLU H . 34702 1 628 . 2 2 2 10 10 GLU HA H 1 4.049 0.02 . 1 . . . . B 197 GLU HA . 34702 1 629 . 2 2 2 10 10 GLU HB2 H 1 2.083 0.02 . 1 . . . . B 197 GLU HB2 . 34702 1 630 . 2 2 2 10 10 GLU HB3 H 1 2.083 0.02 . 1 . . . . B 197 GLU HB3 . 34702 1 631 . 2 2 2 10 10 GLU HG2 H 1 2.435 0.02 . 1 . . . . B 197 GLU HG2 . 34702 1 632 . 2 2 2 10 10 GLU HG3 H 1 2.435 0.02 . 1 . . . . B 197 GLU HG3 . 34702 1 633 . 2 2 2 10 10 GLU C C 13 179.314 0.2 . 1 . . . . B 197 GLU C . 34702 1 634 . 2 2 2 10 10 GLU CA C 13 58.585 0.2 . 1 . . . . B 197 GLU CA . 34702 1 635 . 2 2 2 10 10 GLU CB C 13 28.754 0.2 . 1 . . . . B 197 GLU CB . 34702 1 636 . 2 2 2 10 10 GLU CG C 13 35.639 0.2 . 1 . . . . B 197 GLU CG . 34702 1 637 . 2 2 2 10 10 GLU N N 15 119.38 0.2 . 1 . . . . B 197 GLU N . 34702 1 638 . 2 2 2 11 11 ALA H H 1 8.259 0.02 . 1 . . . . B 198 ALA H . 34702 1 639 . 2 2 2 11 11 ALA HA H 1 3.985 0.02 . 1 . . . . B 198 ALA HA . 34702 1 640 . 2 2 2 11 11 ALA HB1 H 1 1.225 0.02 . 1 . . . . B 198 ALA HB1 . 34702 1 641 . 2 2 2 11 11 ALA HB2 H 1 1.225 0.02 . 1 . . . . B 198 ALA HB2 . 34702 1 642 . 2 2 2 11 11 ALA HB3 H 1 1.225 0.02 . 1 . . . . B 198 ALA HB3 . 34702 1 643 . 2 2 2 11 11 ALA C C 13 178.686 0.2 . 1 . . . . B 198 ALA C . 34702 1 644 . 2 2 2 11 11 ALA CA C 13 55.276 0.2 . 1 . . . . B 198 ALA CA . 34702 1 645 . 2 2 2 11 11 ALA CB C 13 17.723 0.2 . 1 . . . . B 198 ALA CB . 34702 1 646 . 2 2 2 11 11 ALA N N 15 123.343 0.2 . 1 . . . . B 198 ALA N . 34702 1 647 . 2 2 2 12 12 GLU H H 1 8.185 0.02 . 1 . . . . B 199 GLU H . 34702 1 648 . 2 2 2 12 12 GLU HA H 1 3.671 0.02 . 1 . . . . B 199 GLU HA . 34702 1 649 . 2 2 2 12 12 GLU HB2 H 1 2.167 0.02 . 2 . . . . B 199 GLU HB2 . 34702 1 650 . 2 2 2 12 12 GLU HB3 H 1 1.99 0.02 . 2 . . . . B 199 GLU HB3 . 34702 1 651 . 2 2 2 12 12 GLU HG2 H 1 1.992 0.02 . 2 . . . . B 199 GLU HG2 . 34702 1 652 . 2 2 2 12 12 GLU HG3 H 1 2.384 0.02 . 2 . . . . B 199 GLU HG3 . 34702 1 653 . 2 2 2 12 12 GLU C C 13 178.281 0.2 . 1 . . . . B 199 GLU C . 34702 1 654 . 2 2 2 12 12 GLU CA C 13 60.17 0.2 . 1 . . . . B 199 GLU CA . 34702 1 655 . 2 2 2 12 12 GLU CB C 13 29.895 0.2 . 1 . . . . B 199 GLU CB . 34702 1 656 . 2 2 2 12 12 GLU CG C 13 37.517 0.2 . 1 . . . . B 199 GLU CG . 34702 1 657 . 2 2 2 12 12 GLU N N 15 118.374 0.2 . 1 . . . . B 199 GLU N . 34702 1 658 . 2 2 2 13 13 LYS H H 1 7.608 0.02 . 1 . . . . B 200 LYS H . 34702 1 659 . 2 2 2 13 13 LYS HA H 1 3.924 0.02 . 1 . . . . B 200 LYS HA . 34702 1 660 . 2 2 2 13 13 LYS HB2 H 1 1.845 0.02 . 1 . . . . B 200 LYS HB2 . 34702 1 661 . 2 2 2 13 13 LYS HB3 H 1 1.845 0.02 . 1 . . . . B 200 LYS HB3 . 34702 1 662 . 2 2 2 13 13 LYS HG2 H 1 1.444 0.02 . 2 . . . . B 200 LYS HG2 . 34702 1 663 . 2 2 2 13 13 LYS HG3 H 1 1.23 0.02 . 2 . . . . B 200 LYS HG3 . 34702 1 664 . 2 2 2 13 13 LYS HD2 H 1 1.65 0.02 . 1 . . . . B 200 LYS HD2 . 34702 1 665 . 2 2 2 13 13 LYS HD3 H 1 1.65 0.02 . 1 . . . . B 200 LYS HD3 . 34702 1 666 . 2 2 2 13 13 LYS HE2 H 1 2.851 0.02 . 1 . . . . B 200 LYS HE2 . 34702 1 667 . 2 2 2 13 13 LYS HE3 H 1 2.851 0.02 . 1 . . . . B 200 LYS HE3 . 34702 1 668 . 2 2 2 13 13 LYS C C 13 178.25 0.2 . 1 . . . . B 200 LYS C . 34702 1 669 . 2 2 2 13 13 LYS CA C 13 59.237 0.2 . 1 . . . . B 200 LYS CA . 34702 1 670 . 2 2 2 13 13 LYS CB C 13 32.096 0.2 . 1 . . . . B 200 LYS CB . 34702 1 671 . 2 2 2 13 13 LYS CG C 13 24.478 0.2 . 1 . . . . B 200 LYS CG . 34702 1 672 . 2 2 2 13 13 LYS CD C 13 29.327 0.2 . 1 . . . . B 200 LYS CD . 34702 1 673 . 2 2 2 13 13 LYS CE C 13 41.812 0.2 . 1 . . . . B 200 LYS CE . 34702 1 674 . 2 2 2 13 13 LYS N N 15 119.146 0.2 . 1 . . . . B 200 LYS N . 34702 1 675 . 2 2 2 14 14 ALA H H 1 8.245 0.02 . 1 . . . . B 201 ALA H . 34702 1 676 . 2 2 2 14 14 ALA HA H 1 4.209 0.02 . 1 . . . . B 201 ALA HA . 34702 1 677 . 2 2 2 14 14 ALA HB1 H 1 1.424 0.02 . 1 . . . . B 201 ALA HB1 . 34702 1 678 . 2 2 2 14 14 ALA HB2 H 1 1.424 0.02 . 1 . . . . B 201 ALA HB2 . 34702 1 679 . 2 2 2 14 14 ALA HB3 H 1 1.424 0.02 . 1 . . . . B 201 ALA HB3 . 34702 1 680 . 2 2 2 14 14 ALA C C 13 179.383 0.2 . 1 . . . . B 201 ALA C . 34702 1 681 . 2 2 2 14 14 ALA CA C 13 54.997 0.2 . 1 . . . . B 201 ALA CA . 34702 1 682 . 2 2 2 14 14 ALA CB C 13 18.864 0.2 . 1 . . . . B 201 ALA CB . 34702 1 683 . 2 2 2 14 14 ALA N N 15 120.813 0.2 . 1 . . . . B 201 ALA N . 34702 1 684 . 2 2 2 15 15 VAL H H 1 8.422 0.02 . 1 . . . . B 202 VAL H . 34702 1 685 . 2 2 2 15 15 VAL HA H 1 3.637 0.02 . 1 . . . . B 202 VAL HA . 34702 1 686 . 2 2 2 15 15 VAL HB H 1 2.063 0.02 . 1 . . . . B 202 VAL HB . 34702 1 687 . 2 2 2 15 15 VAL HG11 H 1 1.11 0.02 . 2 . . . . B 202 VAL HG11 . 34702 1 688 . 2 2 2 15 15 VAL HG12 H 1 1.11 0.02 . 2 . . . . B 202 VAL HG12 . 34702 1 689 . 2 2 2 15 15 VAL HG13 H 1 1.11 0.02 . 2 . . . . B 202 VAL HG13 . 34702 1 690 . 2 2 2 15 15 VAL HG21 H 1 0.539 0.02 . 2 . . . . B 202 VAL HG21 . 34702 1 691 . 2 2 2 15 15 VAL HG22 H 1 0.539 0.02 . 2 . . . . B 202 VAL HG22 . 34702 1 692 . 2 2 2 15 15 VAL HG23 H 1 0.539 0.02 . 2 . . . . B 202 VAL HG23 . 34702 1 693 . 2 2 2 15 15 VAL C C 13 177.253 0.2 . 1 . . . . B 202 VAL C . 34702 1 694 . 2 2 2 15 15 VAL CA C 13 67.827 0.2 . 1 . . . . B 202 VAL CA . 34702 1 695 . 2 2 2 15 15 VAL CB C 13 31.022 0.2 . 1 . . . . B 202 VAL CB . 34702 1 696 . 2 2 2 15 15 VAL CG1 C 13 24.633 0.2 . 2 . . . . B 202 VAL CG1 . 34702 1 697 . 2 2 2 15 15 VAL CG2 C 13 22.936 0.2 . 2 . . . . B 202 VAL CG2 . 34702 1 698 . 2 2 2 15 15 VAL N N 15 117.738 0.2 . 1 . . . . B 202 VAL N . 34702 1 699 . 2 2 2 16 16 SER H H 1 7.716 0.02 . 1 . . . . B 203 SER H . 34702 1 700 . 2 2 2 16 16 SER HA H 1 3.99 0.02 . 1 . . . . B 203 SER HA . 34702 1 701 . 2 2 2 16 16 SER HB2 H 1 3.937 0.02 . 1 . . . . B 203 SER HB2 . 34702 1 702 . 2 2 2 16 16 SER HB3 H 1 3.937 0.02 . 1 . . . . B 203 SER HB3 . 34702 1 703 . 2 2 2 16 16 SER C C 13 177.01 0.2 . 1 . . . . B 203 SER C . 34702 1 704 . 2 2 2 16 16 SER CA C 13 62.681 0.2 . 1 . . . . B 203 SER CA . 34702 1 705 . 2 2 2 16 16 SER CB C 13 63.653 0.2 . 1 . . . . B 203 SER CB . 34702 1 706 . 2 2 2 16 16 SER N N 15 114.616 0.2 . 1 . . . . B 203 SER N . 34702 1 707 . 2 2 2 17 17 GLN H H 1 8.377 0.02 . 1 . . . . B 204 GLN H . 34702 1 708 . 2 2 2 17 17 GLN HA H 1 4.044 0.02 . 1 . . . . B 204 GLN HA . 34702 1 709 . 2 2 2 17 17 GLN HB2 H 1 2.13 0.02 . 1 . . . . B 204 GLN HB2 . 34702 1 710 . 2 2 2 17 17 GLN HB3 H 1 2.13 0.02 . 1 . . . . B 204 GLN HB3 . 34702 1 711 . 2 2 2 17 17 GLN HG2 H 1 2.442 0.02 . 2 . . . . B 204 GLN HG2 . 34702 1 712 . 2 2 2 17 17 GLN HG3 H 1 2.587 0.02 . 2 . . . . B 204 GLN HG3 . 34702 1 713 . 2 2 2 17 17 GLN HE21 H 1 6.584 0.02 . 2 . . . . B 204 GLN HE21 . 34702 1 714 . 2 2 2 17 17 GLN HE22 H 1 7.105 0.02 . 2 . . . . B 204 GLN HE22 . 34702 1 715 . 2 2 2 17 17 GLN C C 13 179.156 0.2 . 1 . . . . B 204 GLN C . 34702 1 716 . 2 2 2 17 17 GLN CA C 13 59.068 0.2 . 1 . . . . B 204 GLN CA . 34702 1 717 . 2 2 2 17 17 GLN CB C 13 28.993 0.2 . 1 . . . . B 204 GLN CB . 34702 1 718 . 2 2 2 17 17 GLN CG C 13 36.399 0.2 . 1 . . . . B 204 GLN CG . 34702 1 719 . 2 2 2 17 17 GLN N N 15 121.045 0.2 . 1 . . . . B 204 GLN N . 34702 1 720 . 2 2 2 17 17 GLN NE2 N 15 108.833 0.2 . 1 . . . . B 204 GLN NE2 . 34702 1 721 . 2 2 2 18 18 LEU H H 1 8.377 0.02 . 1 . . . . B 205 LEU H . 34702 1 722 . 2 2 2 18 18 LEU HA H 1 3.906 0.02 . 1 . . . . B 205 LEU HA . 34702 1 723 . 2 2 2 18 18 LEU HB2 H 1 2.084 0.02 . 2 . . . . B 205 LEU HB2 . 34702 1 724 . 2 2 2 18 18 LEU HB3 H 1 0.735 0.02 . 2 . . . . B 205 LEU HB3 . 34702 1 725 . 2 2 2 18 18 LEU HG H 1 1.51 0.02 . 1 . . . . B 205 LEU HG . 34702 1 726 . 2 2 2 18 18 LEU HD11 H 1 0.357 0.02 . 2 . . . . B 205 LEU HD11 . 34702 1 727 . 2 2 2 18 18 LEU HD12 H 1 0.357 0.02 . 2 . . . . B 205 LEU HD12 . 34702 1 728 . 2 2 2 18 18 LEU HD13 H 1 0.357 0.02 . 2 . . . . B 205 LEU HD13 . 34702 1 729 . 2 2 2 18 18 LEU HD21 H 1 0.098 0.02 . 2 . . . . B 205 LEU HD21 . 34702 1 730 . 2 2 2 18 18 LEU HD22 H 1 0.098 0.02 . 2 . . . . B 205 LEU HD22 . 34702 1 731 . 2 2 2 18 18 LEU HD23 H 1 0.098 0.02 . 2 . . . . B 205 LEU HD23 . 34702 1 732 . 2 2 2 18 18 LEU C C 13 178.744 0.2 . 1 . . . . B 205 LEU C . 34702 1 733 . 2 2 2 18 18 LEU CA C 13 57.116 0.2 . 1 . . . . B 205 LEU CA . 34702 1 734 . 2 2 2 18 18 LEU CB C 13 41.276 0.2 . 1 . . . . B 205 LEU CB . 34702 1 735 . 2 2 2 18 18 LEU CG C 13 26.994 0.2 . 1 . . . . B 205 LEU CG . 34702 1 736 . 2 2 2 18 18 LEU CD1 C 13 26.823 0.2 . 2 . . . . B 205 LEU CD1 . 34702 1 737 . 2 2 2 18 18 LEU CD2 C 13 22.823 0.2 . 2 . . . . B 205 LEU CD2 . 34702 1 738 . 2 2 2 18 18 LEU N N 15 118.352 0.2 . 1 . . . . B 205 LEU N . 34702 1 739 . 2 2 2 19 19 PHE H H 1 9.142 0.02 . 1 . . . . B 206 PHE H . 34702 1 740 . 2 2 2 19 19 PHE HA H 1 4.75 0.02 . 1 . . . . B 206 PHE HA . 34702 1 741 . 2 2 2 19 19 PHE HB2 H 1 3.181 0.02 . 2 . . . . B 206 PHE HB2 . 34702 1 742 . 2 2 2 19 19 PHE HB3 H 1 2.959 0.02 . 2 . . . . B 206 PHE HB3 . 34702 1 743 . 2 2 2 19 19 PHE HD1 H 1 7.137 0.02 . 1 . . . . B 206 PHE HD1 . 34702 1 744 . 2 2 2 19 19 PHE HD2 H 1 7.137 0.02 . 1 . . . . B 206 PHE HD2 . 34702 1 745 . 2 2 2 19 19 PHE HE1 H 1 7.467 0.02 . 1 . . . . B 206 PHE HE1 . 34702 1 746 . 2 2 2 19 19 PHE HE2 H 1 7.467 0.02 . 1 . . . . B 206 PHE HE2 . 34702 1 747 . 2 2 2 19 19 PHE HZ H 1 7.328 0.02 . 1 . . . . B 206 PHE HZ . 34702 1 748 . 2 2 2 19 19 PHE C C 13 181.241 0.2 . 1 . . . . B 206 PHE C . 34702 1 749 . 2 2 2 19 19 PHE CA C 13 60.784 0.2 . 1 . . . . B 206 PHE CA . 34702 1 750 . 2 2 2 19 19 PHE CB C 13 39.769 0.2 . 1 . . . . B 206 PHE CB . 34702 1 751 . 2 2 2 19 19 PHE N N 15 122.82 0.2 . 1 . . . . B 206 PHE N . 34702 1 752 . 2 2 2 20 20 GLU H H 1 8.104 0.02 . 1 . . . . B 207 GLU H . 34702 1 753 . 2 2 2 20 20 GLU HA H 1 4.187 0.02 . 1 . . . . B 207 GLU HA . 34702 1 754 . 2 2 2 20 20 GLU HB2 H 1 2.338 0.02 . 1 . . . . B 207 GLU HB2 . 34702 1 755 . 2 2 2 20 20 GLU HB3 H 1 2.338 0.02 . 1 . . . . B 207 GLU HB3 . 34702 1 756 . 2 2 2 20 20 GLU HG2 H 1 2.431 0.02 . 2 . . . . B 207 GLU HG2 . 34702 1 757 . 2 2 2 20 20 GLU HG3 H 1 2.589 0.02 . 2 . . . . B 207 GLU HG3 . 34702 1 758 . 2 2 2 20 20 GLU C C 13 178.14 0.2 . 1 . . . . B 207 GLU C . 34702 1 759 . 2 2 2 20 20 GLU CA C 13 59.585 0.2 . 1 . . . . B 207 GLU CA . 34702 1 760 . 2 2 2 20 20 GLU CB C 13 29.821 0.2 . 1 . . . . B 207 GLU CB . 34702 1 761 . 2 2 2 20 20 GLU CG C 13 36.661 0.2 . 1 . . . . B 207 GLU CG . 34702 1 762 . 2 2 2 20 20 GLU N N 15 119.804 0.2 . 1 . . . . B 207 GLU N . 34702 1 763 . 2 2 2 21 21 VAL H H 1 7.34 0.02 . 1 . . . . B 208 VAL H . 34702 1 764 . 2 2 2 21 21 VAL HA H 1 4.486 0.02 . 1 . . . . B 208 VAL HA . 34702 1 765 . 2 2 2 21 21 VAL HB H 1 2.517 0.02 . 1 . . . . B 208 VAL HB . 34702 1 766 . 2 2 2 21 21 VAL HG11 H 1 0.949 0.02 . 2 . . . . B 208 VAL HG11 . 34702 1 767 . 2 2 2 21 21 VAL HG12 H 1 0.949 0.02 . 2 . . . . B 208 VAL HG12 . 34702 1 768 . 2 2 2 21 21 VAL HG13 H 1 0.949 0.02 . 2 . . . . B 208 VAL HG13 . 34702 1 769 . 2 2 2 21 21 VAL HG21 H 1 0.847 0.02 . 2 . . . . B 208 VAL HG21 . 34702 1 770 . 2 2 2 21 21 VAL HG22 H 1 0.847 0.02 . 2 . . . . B 208 VAL HG22 . 34702 1 771 . 2 2 2 21 21 VAL HG23 H 1 0.847 0.02 . 2 . . . . B 208 VAL HG23 . 34702 1 772 . 2 2 2 21 21 VAL C C 13 175.404 0.2 . 1 . . . . B 208 VAL C . 34702 1 773 . 2 2 2 21 21 VAL CA C 13 61.455 0.2 . 1 . . . . B 208 VAL CA . 34702 1 774 . 2 2 2 21 21 VAL CB C 13 30.964 0.2 . 1 . . . . B 208 VAL CB . 34702 1 775 . 2 2 2 21 21 VAL CG1 C 13 21.577 0.2 . 2 . . . . B 208 VAL CG1 . 34702 1 776 . 2 2 2 21 21 VAL CG2 C 13 19.843 0.2 . 2 . . . . B 208 VAL CG2 . 34702 1 777 . 2 2 2 21 21 VAL N N 15 110.573 0.2 . 1 . . . . B 208 VAL N . 34702 1 778 . 2 2 2 22 22 GLY H H 1 7.449 0.02 . 1 . . . . B 209 GLY H . 34702 1 779 . 2 2 2 22 22 GLY HA2 H 1 4.459 0.02 . 2 . . . . B 209 GLY HA2 . 34702 1 780 . 2 2 2 22 22 GLY HA3 H 1 3.358 0.02 . 2 . . . . B 209 GLY HA3 . 34702 1 781 . 2 2 2 22 22 GLY C C 13 173.635 0.2 . 1 . . . . B 209 GLY C . 34702 1 782 . 2 2 2 22 22 GLY CA C 13 44.819 0.2 . 1 . . . . B 209 GLY CA . 34702 1 783 . 2 2 2 22 22 GLY N N 15 106.353 0.2 . 1 . . . . B 209 GLY N . 34702 1 784 . 2 2 2 23 23 VAL H H 1 7.514 0.02 . 1 . . . . B 210 VAL H . 34702 1 785 . 2 2 2 23 23 VAL HA H 1 3.294 0.02 . 1 . . . . B 210 VAL HA . 34702 1 786 . 2 2 2 23 23 VAL HB H 1 1.191 0.02 . 1 . . . . B 210 VAL HB . 34702 1 787 . 2 2 2 23 23 VAL HG11 H 1 0.232 0.02 . 2 . . . . B 210 VAL HG11 . 34702 1 788 . 2 2 2 23 23 VAL HG12 H 1 0.232 0.02 . 2 . . . . B 210 VAL HG12 . 34702 1 789 . 2 2 2 23 23 VAL HG13 H 1 0.232 0.02 . 2 . . . . B 210 VAL HG13 . 34702 1 790 . 2 2 2 23 23 VAL HG21 H 1 -0.389 0.02 . 2 . . . . B 210 VAL HG21 . 34702 1 791 . 2 2 2 23 23 VAL HG22 H 1 -0.389 0.02 . 2 . . . . B 210 VAL HG22 . 34702 1 792 . 2 2 2 23 23 VAL HG23 H 1 -0.389 0.02 . 2 . . . . B 210 VAL HG23 . 34702 1 793 . 2 2 2 23 23 VAL C C 13 175.658 0.2 . 1 . . . . B 210 VAL C . 34702 1 794 . 2 2 2 23 23 VAL CA C 13 63.515 0.2 . 1 . . . . B 210 VAL CA . 34702 1 795 . 2 2 2 23 23 VAL CB C 13 30.222 0.2 . 1 . . . . B 210 VAL CB . 34702 1 796 . 2 2 2 23 23 VAL CG1 C 13 23.197 0.2 . 2 . . . . B 210 VAL CG1 . 34702 1 797 . 2 2 2 23 23 VAL CG2 C 13 20.049 0.2 . 2 . . . . B 210 VAL CG2 . 34702 1 798 . 2 2 2 23 23 VAL N N 15 123.686 0.2 . 1 . . . . B 210 VAL N . 34702 1 799 . 2 2 2 24 24 ARG H H 1 9.693 0.02 . 1 . . . . B 211 ARG H . 34702 1 800 . 2 2 2 24 24 ARG HA H 1 5.249 0.02 . 1 . . . . B 211 ARG HA . 34702 1 801 . 2 2 2 24 24 ARG HB2 H 1 1.945 0.02 . 2 . . . . B 211 ARG HB2 . 34702 1 802 . 2 2 2 24 24 ARG HB3 H 1 2.351 0.02 . 2 . . . . B 211 ARG HB3 . 34702 1 803 . 2 2 2 24 24 ARG HG2 H 1 1.507 0.02 . 1 . . . . B 211 ARG HG2 . 34702 1 804 . 2 2 2 24 24 ARG HG3 H 1 1.507 0.02 . 1 . . . . B 211 ARG HG3 . 34702 1 805 . 2 2 2 24 24 ARG HD2 H 1 3.366 0.02 . 2 . . . . B 211 ARG HD2 . 34702 1 806 . 2 2 2 24 24 ARG HD3 H 1 3.118 0.02 . 2 . . . . B 211 ARG HD3 . 34702 1 807 . 2 2 2 24 24 ARG C C 13 177.73 0.2 . 1 . . . . B 211 ARG C . 34702 1 808 . 2 2 2 24 24 ARG CA C 13 52.632 0.2 . 1 . . . . B 211 ARG CA . 34702 1 809 . 2 2 2 24 24 ARG CB C 13 32.062 0.2 . 1 . . . . B 211 ARG CB . 34702 1 810 . 2 2 2 24 24 ARG CG C 13 26.516 0.2 . 1 . . . . B 211 ARG CG . 34702 1 811 . 2 2 2 24 24 ARG CD C 13 42.481 0.2 . 1 . . . . B 211 ARG CD . 34702 1 812 . 2 2 2 24 24 ARG N N 15 128.407 0.2 . 1 . . . . B 211 ARG N . 34702 1 813 . 2 2 2 25 25 PHE H H 1 9.465 0.02 . 1 . . . . B 212 PHE H . 34702 1 814 . 2 2 2 25 25 PHE HA H 1 3.782 0.02 . 1 . . . . B 212 PHE HA . 34702 1 815 . 2 2 2 25 25 PHE HB2 H 1 3.02 0.02 . 2 . . . . B 212 PHE HB2 . 34702 1 816 . 2 2 2 25 25 PHE HB3 H 1 2.956 0.02 . 2 . . . . B 212 PHE HB3 . 34702 1 817 . 2 2 2 25 25 PHE HD1 H 1 6.417 0.02 . 1 . . . . B 212 PHE HD1 . 34702 1 818 . 2 2 2 25 25 PHE HD2 H 1 6.417 0.02 . 1 . . . . B 212 PHE HD2 . 34702 1 819 . 2 2 2 25 25 PHE HE1 H 1 6.891 0.02 . 1 . . . . B 212 PHE HE1 . 34702 1 820 . 2 2 2 25 25 PHE HE2 H 1 6.891 0.02 . 1 . . . . B 212 PHE HE2 . 34702 1 821 . 2 2 2 25 25 PHE HZ H 1 6.934 0.02 . 1 . . . . B 212 PHE HZ . 34702 1 822 . 2 2 2 25 25 PHE C C 13 177.678 0.2 . 1 . . . . B 212 PHE C . 34702 1 823 . 2 2 2 25 25 PHE CA C 13 63.903 0.2 . 1 . . . . B 212 PHE CA . 34702 1 824 . 2 2 2 25 25 PHE CB C 13 39.988 0.2 . 1 . . . . B 212 PHE CB . 34702 1 825 . 2 2 2 25 25 PHE N N 15 122.679 0.2 . 1 . . . . B 212 PHE N . 34702 1 826 . 2 2 2 26 26 ASN H H 1 9.447 0.02 . 1 . . . . B 213 ASN H . 34702 1 827 . 2 2 2 26 26 ASN HA H 1 4.398 0.02 . 1 . . . . B 213 ASN HA . 34702 1 828 . 2 2 2 26 26 ASN HB2 H 1 2.879 0.02 . 1 . . . . B 213 ASN HB2 . 34702 1 829 . 2 2 2 26 26 ASN HB3 H 1 2.879 0.02 . 1 . . . . B 213 ASN HB3 . 34702 1 830 . 2 2 2 26 26 ASN HD21 H 1 6.989 0.02 . 2 . . . . B 213 ASN HD21 . 34702 1 831 . 2 2 2 26 26 ASN HD22 H 1 7.716 0.02 . 2 . . . . B 213 ASN HD22 . 34702 1 832 . 2 2 2 26 26 ASN C C 13 177.992 0.2 . 1 . . . . B 213 ASN C . 34702 1 833 . 2 2 2 26 26 ASN CA C 13 55.987 0.2 . 1 . . . . B 213 ASN CA . 34702 1 834 . 2 2 2 26 26 ASN CB C 13 37.714 0.2 . 1 . . . . B 213 ASN CB . 34702 1 835 . 2 2 2 26 26 ASN N N 15 114.143 0.2 . 1 . . . . B 213 ASN N . 34702 1 836 . 2 2 2 26 26 ASN ND2 N 15 112.129 0.2 . 1 . . . . B 213 ASN ND2 . 34702 1 837 . 2 2 2 27 27 ASP H H 1 7.987 0.02 . 1 . . . . B 214 ASP H . 34702 1 838 . 2 2 2 27 27 ASP HA H 1 4.586 0.02 . 1 . . . . B 214 ASP HA . 34702 1 839 . 2 2 2 27 27 ASP HB2 H 1 2.715 0.02 . 2 . . . . B 214 ASP HB2 . 34702 1 840 . 2 2 2 27 27 ASP HB3 H 1 3.147 0.02 . 2 . . . . B 214 ASP HB3 . 34702 1 841 . 2 2 2 27 27 ASP C C 13 179.283 0.2 . 1 . . . . B 214 ASP C . 34702 1 842 . 2 2 2 27 27 ASP CA C 13 57.252 0.2 . 1 . . . . B 214 ASP CA . 34702 1 843 . 2 2 2 27 27 ASP CB C 13 41.99 0.2 . 1 . . . . B 214 ASP CB . 34702 1 844 . 2 2 2 27 27 ASP N N 15 119.873 0.2 . 1 . . . . B 214 ASP N . 34702 1 845 . 2 2 2 28 28 PHE H H 1 7.701 0.02 . 1 . . . . B 215 PHE H . 34702 1 846 . 2 2 2 28 28 PHE HA H 1 3.873 0.02 . 1 . . . . B 215 PHE HA . 34702 1 847 . 2 2 2 28 28 PHE HB2 H 1 2.641 0.02 . 2 . . . . B 215 PHE HB2 . 34702 1 848 . 2 2 2 28 28 PHE HB3 H 1 3.23 0.02 . 2 . . . . B 215 PHE HB3 . 34702 1 849 . 2 2 2 28 28 PHE HD1 H 1 7.477 0.02 . 1 . . . . B 215 PHE HD1 . 34702 1 850 . 2 2 2 28 28 PHE HE1 H 1 7.326 0.02 . 1 . . . . B 215 PHE HE1 . 34702 1 851 . 2 2 2 28 28 PHE HZ H 1 7.373 0.02 . 1 . . . . B 215 PHE HZ . 34702 1 852 . 2 2 2 28 28 PHE C C 13 177.757 0.2 . 1 . . . . B 215 PHE C . 34702 1 853 . 2 2 2 28 28 PHE CA C 13 62.141 0.2 . 1 . . . . B 215 PHE CA . 34702 1 854 . 2 2 2 28 28 PHE CB C 13 39.549 0.2 . 1 . . . . B 215 PHE CB . 34702 1 855 . 2 2 2 28 28 PHE N N 15 117.023 0.2 . 1 . . . . B 215 PHE N . 34702 1 856 . 2 2 2 29 29 ILE H H 1 7.08 0.02 . 1 . . . . B 216 ILE H . 34702 1 857 . 2 2 2 29 29 ILE HA H 1 3.919 0.02 . 1 . . . . B 216 ILE HA . 34702 1 858 . 2 2 2 29 29 ILE HB H 1 2.037 0.02 . 1 . . . . B 216 ILE HB . 34702 1 859 . 2 2 2 29 29 ILE HG12 H 1 1.318 0.02 . 2 . . . . B 216 ILE HG12 . 34702 1 860 . 2 2 2 29 29 ILE HG13 H 1 1.16 0.02 . 2 . . . . B 216 ILE HG13 . 34702 1 861 . 2 2 2 29 29 ILE HG21 H 1 0.907 0.02 . 1 . . . . B 216 ILE HG21 . 34702 1 862 . 2 2 2 29 29 ILE HG22 H 1 0.907 0.02 . 1 . . . . B 216 ILE HG22 . 34702 1 863 . 2 2 2 29 29 ILE HG23 H 1 0.907 0.02 . 1 . . . . B 216 ILE HG23 . 34702 1 864 . 2 2 2 29 29 ILE HD11 H 1 0.517 0.02 . 1 . . . . B 216 ILE HD11 . 34702 1 865 . 2 2 2 29 29 ILE HD12 H 1 0.517 0.02 . 1 . . . . B 216 ILE HD12 . 34702 1 866 . 2 2 2 29 29 ILE HD13 H 1 0.517 0.02 . 1 . . . . B 216 ILE HD13 . 34702 1 867 . 2 2 2 29 29 ILE C C 13 180.887 0.2 . 1 . . . . B 216 ILE C . 34702 1 868 . 2 2 2 29 29 ILE CA C 13 63.195 0.2 . 1 . . . . B 216 ILE CA . 34702 1 869 . 2 2 2 29 29 ILE CB C 13 36.151 0.2 . 1 . . . . B 216 ILE CB . 34702 1 870 . 2 2 2 29 29 ILE CG1 C 13 28.11 0.2 . 1 . . . . B 216 ILE CG1 . 34702 1 871 . 2 2 2 29 29 ILE CG2 C 13 17.609 0.2 . 1 . . . . B 216 ILE CG2 . 34702 1 872 . 2 2 2 29 29 ILE CD1 C 13 11.643 0.2 . 1 . . . . B 216 ILE CD1 . 34702 1 873 . 2 2 2 29 29 ILE N N 15 118.317 0.2 . 1 . . . . B 216 ILE N . 34702 1 874 . 2 2 2 30 30 ALA H H 1 7.997 0.02 . 1 . . . . B 217 ALA H . 34702 1 875 . 2 2 2 30 30 ALA HA H 1 4.163 0.02 . 1 . . . . B 217 ALA HA . 34702 1 876 . 2 2 2 30 30 ALA HB1 H 1 1.623 0.02 . 1 . . . . B 217 ALA HB1 . 34702 1 877 . 2 2 2 30 30 ALA HB2 H 1 1.623 0.02 . 1 . . . . B 217 ALA HB2 . 34702 1 878 . 2 2 2 30 30 ALA HB3 H 1 1.623 0.02 . 1 . . . . B 217 ALA HB3 . 34702 1 879 . 2 2 2 30 30 ALA C C 13 178.72 0.2 . 1 . . . . B 217 ALA C . 34702 1 880 . 2 2 2 30 30 ALA CA C 13 54.734 0.2 . 1 . . . . B 217 ALA CA . 34702 1 881 . 2 2 2 30 30 ALA CB C 13 18.202 0.2 . 1 . . . . B 217 ALA CB . 34702 1 882 . 2 2 2 30 30 ALA N N 15 124.773 0.2 . 1 . . . . B 217 ALA N . 34702 1 883 . 2 2 2 31 31 GLU H H 1 7.061 0.02 . 1 . . . . B 218 GLU H . 34702 1 884 . 2 2 2 31 31 GLU HA H 1 4.022 0.02 . 1 . . . . B 218 GLU HA . 34702 1 885 . 2 2 2 31 31 GLU HB2 H 1 1.744 0.02 . 2 . . . . B 218 GLU HB2 . 34702 1 886 . 2 2 2 31 31 GLU HB3 H 1 1.457 0.02 . 2 . . . . B 218 GLU HB3 . 34702 1 887 . 2 2 2 31 31 GLU HG2 H 1 1.076 0.02 . 2 . . . . B 218 GLU HG2 . 34702 1 888 . 2 2 2 31 31 GLU HG3 H 1 1.336 0.02 . 2 . . . . B 218 GLU HG3 . 34702 1 889 . 2 2 2 31 31 GLU C C 13 176.655 0.2 . 1 . . . . B 218 GLU C . 34702 1 890 . 2 2 2 31 31 GLU CA C 13 55.694 0.2 . 1 . . . . B 218 GLU CA . 34702 1 891 . 2 2 2 31 31 GLU CB C 13 29.364 0.2 . 1 . . . . B 218 GLU CB . 34702 1 892 . 2 2 2 31 31 GLU CG C 13 33.929 0.2 . 1 . . . . B 218 GLU CG . 34702 1 893 . 2 2 2 31 31 GLU N N 15 116.621 0.2 . 1 . . . . B 218 GLU N . 34702 1 894 . 2 2 2 32 32 GLY H H 1 7.944 0.02 . 1 . . . . B 219 GLY H . 34702 1 895 . 2 2 2 32 32 GLY HA2 H 1 4.212 0.02 . 2 . . . . B 219 GLY HA2 . 34702 1 896 . 2 2 2 32 32 GLY HA3 H 1 3.73 0.02 . 2 . . . . B 219 GLY HA3 . 34702 1 897 . 2 2 2 32 32 GLY C C 13 174.153 0.2 . 1 . . . . B 219 GLY C . 34702 1 898 . 2 2 2 32 32 GLY CA C 13 45.145 0.2 . 1 . . . . B 219 GLY CA . 34702 1 899 . 2 2 2 32 32 GLY N N 15 106.146 0.2 . 1 . . . . B 219 GLY N . 34702 1 900 . 2 2 2 33 33 ILE H H 1 7.157 0.02 . 1 . . . . B 220 ILE H . 34702 1 901 . 2 2 2 33 33 ILE HA H 1 4.12 0.02 . 1 . . . . B 220 ILE HA . 34702 1 902 . 2 2 2 33 33 ILE HB H 1 1.409 0.02 . 1 . . . . B 220 ILE HB . 34702 1 903 . 2 2 2 33 33 ILE HG12 H 1 1.174 0.02 . 2 . . . . B 220 ILE HG12 . 34702 1 904 . 2 2 2 33 33 ILE HG13 H 1 1.496 0.02 . 2 . . . . B 220 ILE HG13 . 34702 1 905 . 2 2 2 33 33 ILE HG21 H 1 1.071 0.02 . 1 . . . . B 220 ILE HG21 . 34702 1 906 . 2 2 2 33 33 ILE HG22 H 1 1.071 0.02 . 1 . . . . B 220 ILE HG22 . 34702 1 907 . 2 2 2 33 33 ILE HG23 H 1 1.071 0.02 . 1 . . . . B 220 ILE HG23 . 34702 1 908 . 2 2 2 33 33 ILE HD11 H 1 0.949 0.02 . 1 . . . . B 220 ILE HD11 . 34702 1 909 . 2 2 2 33 33 ILE HD12 H 1 0.949 0.02 . 1 . . . . B 220 ILE HD12 . 34702 1 910 . 2 2 2 33 33 ILE HD13 H 1 0.949 0.02 . 1 . . . . B 220 ILE HD13 . 34702 1 911 . 2 2 2 33 33 ILE C C 13 175.077 0.2 . 1 . . . . B 220 ILE C . 34702 1 912 . 2 2 2 33 33 ILE CA C 13 60.523 0.2 . 1 . . . . B 220 ILE CA . 34702 1 913 . 2 2 2 33 33 ILE CB C 13 37.582 0.2 . 1 . . . . B 220 ILE CB . 34702 1 914 . 2 2 2 33 33 ILE CG1 C 13 29.663 0.2 . 1 . . . . B 220 ILE CG1 . 34702 1 915 . 2 2 2 33 33 ILE CG2 C 13 18.863 0.2 . 1 . . . . B 220 ILE CG2 . 34702 1 916 . 2 2 2 33 33 ILE CD1 C 13 14.146 0.2 . 1 . . . . B 220 ILE CD1 . 34702 1 917 . 2 2 2 33 33 ILE N N 15 122.193 0.2 . 1 . . . . B 220 ILE N . 34702 1 918 . 2 2 2 34 34 GLU H H 1 8.744 0.02 . 1 . . . . B 221 GLU H . 34702 1 919 . 2 2 2 34 34 GLU HA H 1 4.326 0.02 . 1 . . . . B 221 GLU HA . 34702 1 920 . 2 2 2 34 34 GLU HB2 H 1 1.942 0.02 . 1 . . . . B 221 GLU HB2 . 34702 1 921 . 2 2 2 34 34 GLU HB3 H 1 1.942 0.02 . 1 . . . . B 221 GLU HB3 . 34702 1 922 . 2 2 2 34 34 GLU HG2 H 1 2.374 0.02 . 1 . . . . B 221 GLU HG2 . 34702 1 923 . 2 2 2 34 34 GLU HG3 H 1 2.374 0.02 . 1 . . . . B 221 GLU HG3 . 34702 1 924 . 2 2 2 34 34 GLU C C 13 176.234 0.2 . 1 . . . . B 221 GLU C . 34702 1 925 . 2 2 2 34 34 GLU CA C 13 54.86 0.2 . 1 . . . . B 221 GLU CA . 34702 1 926 . 2 2 2 34 34 GLU CB C 13 30.35 0.2 . 1 . . . . B 221 GLU CB . 34702 1 927 . 2 2 2 34 34 GLU CG C 13 35.807 0.2 . 1 . . . . B 221 GLU CG . 34702 1 928 . 2 2 2 34 34 GLU N N 15 131.625 0.2 . 1 . . . . B 221 GLU N . 34702 1 929 . 2 2 2 35 35 PRO HA H 1 3.921 0.02 . 1 . . . . B 222 PRO HA . 34702 1 930 . 2 2 2 35 35 PRO HB2 H 1 1.935 0.02 . 2 . . . . B 222 PRO HB2 . 34702 1 931 . 2 2 2 35 35 PRO HB3 H 1 2.38 0.02 . 2 . . . . B 222 PRO HB3 . 34702 1 932 . 2 2 2 35 35 PRO HG2 H 1 2.219 0.02 . 1 . . . . B 222 PRO HG2 . 34702 1 933 . 2 2 2 35 35 PRO HG3 H 1 2.219 0.02 . 1 . . . . B 222 PRO HG3 . 34702 1 934 . 2 2 2 35 35 PRO HD2 H 1 3.932 0.02 . 1 . . . . B 222 PRO HD2 . 34702 1 935 . 2 2 2 35 35 PRO HD3 H 1 3.932 0.02 . 1 . . . . B 222 PRO HD3 . 34702 1 936 . 2 2 2 35 35 PRO CA C 13 65.595 0.2 . 1 . . . . B 222 PRO CA . 34702 1 937 . 2 2 2 35 35 PRO CB C 13 32.301 0.2 . 1 . . . . B 222 PRO CB . 34702 1 938 . 2 2 2 35 35 PRO CG C 13 27.428 0.2 . 1 . . . . B 222 PRO CG . 34702 1 939 . 2 2 2 35 35 PRO CD C 13 51.393 0.2 . 1 . . . . B 222 PRO CD . 34702 1 940 . 2 2 2 36 36 SER H H 1 8.946 0.02 . 1 . . . . B 223 SER H . 34702 1 941 . 2 2 2 36 36 SER HA H 1 4.288 0.02 . 1 . . . . B 223 SER HA . 34702 1 942 . 2 2 2 36 36 SER HB2 H 1 4.009 0.02 . 1 . . . . B 223 SER HB2 . 34702 1 943 . 2 2 2 36 36 SER HB3 H 1 4.009 0.02 . 1 . . . . B 223 SER HB3 . 34702 1 944 . 2 2 2 36 36 SER C C 13 177.473 0.2 . 1 . . . . B 223 SER C . 34702 1 945 . 2 2 2 36 36 SER CA C 13 61.943 0.2 . 1 . . . . B 223 SER CA . 34702 1 946 . 2 2 2 36 36 SER N N 15 112.781 0.2 . 1 . . . . B 223 SER N . 34702 1 947 . 2 2 2 37 37 VAL H H 1 7.21 0.02 . 1 . . . . B 224 VAL H . 34702 1 948 . 2 2 2 37 37 VAL HA H 1 3.876 0.02 . 1 . . . . B 224 VAL HA . 34702 1 949 . 2 2 2 37 37 VAL HB H 1 2.139 0.02 . 1 . . . . B 224 VAL HB . 34702 1 950 . 2 2 2 37 37 VAL HG11 H 1 0.999 0.02 . 2 . . . . B 224 VAL HG11 . 34702 1 951 . 2 2 2 37 37 VAL HG12 H 1 0.999 0.02 . 2 . . . . B 224 VAL HG12 . 34702 1 952 . 2 2 2 37 37 VAL HG13 H 1 0.999 0.02 . 2 . . . . B 224 VAL HG13 . 34702 1 953 . 2 2 2 37 37 VAL HG21 H 1 0.945 0.02 . 2 . . . . B 224 VAL HG21 . 34702 1 954 . 2 2 2 37 37 VAL HG22 H 1 0.945 0.02 . 2 . . . . B 224 VAL HG22 . 34702 1 955 . 2 2 2 37 37 VAL HG23 H 1 0.945 0.02 . 2 . . . . B 224 VAL HG23 . 34702 1 956 . 2 2 2 37 37 VAL C C 13 177.689 0.2 . 1 . . . . B 224 VAL C . 34702 1 957 . 2 2 2 37 37 VAL CA C 13 65.712 0.2 . 1 . . . . B 224 VAL CA . 34702 1 958 . 2 2 2 37 37 VAL CB C 13 31.957 0.2 . 1 . . . . B 224 VAL CB . 34702 1 959 . 2 2 2 37 37 VAL CG1 C 13 23.171 0.2 . 2 . . . . B 224 VAL CG1 . 34702 1 960 . 2 2 2 37 37 VAL CG2 C 13 21.063 0.2 . 2 . . . . B 224 VAL CG2 . 34702 1 961 . 2 2 2 37 37 VAL N N 15 123.707 0.2 . 1 . . . . B 224 VAL N . 34702 1 962 . 2 2 2 38 38 VAL H H 1 7.328 0.02 . 1 . . . . B 225 VAL H . 34702 1 963 . 2 2 2 38 38 VAL HA H 1 3.27 0.02 . 1 . . . . B 225 VAL HA . 34702 1 964 . 2 2 2 38 38 VAL HB H 1 1.74 0.02 . 1 . . . . B 225 VAL HB . 34702 1 965 . 2 2 2 38 38 VAL HG11 H 1 0.656 0.02 . 2 . . . . B 225 VAL HG11 . 34702 1 966 . 2 2 2 38 38 VAL HG12 H 1 0.656 0.02 . 2 . . . . B 225 VAL HG12 . 34702 1 967 . 2 2 2 38 38 VAL HG13 H 1 0.656 0.02 . 2 . . . . B 225 VAL HG13 . 34702 1 968 . 2 2 2 38 38 VAL HG21 H 1 0.661 0.02 . 2 . . . . B 225 VAL HG21 . 34702 1 969 . 2 2 2 38 38 VAL HG22 H 1 0.661 0.02 . 2 . . . . B 225 VAL HG22 . 34702 1 970 . 2 2 2 38 38 VAL HG23 H 1 0.661 0.02 . 2 . . . . B 225 VAL HG23 . 34702 1 971 . 2 2 2 38 38 VAL C C 13 177.688 0.2 . 1 . . . . B 225 VAL C . 34702 1 972 . 2 2 2 38 38 VAL CA C 13 67.045 0.2 . 1 . . . . B 225 VAL CA . 34702 1 973 . 2 2 2 38 38 VAL CB C 13 31.109 0.2 . 1 . . . . B 225 VAL CB . 34702 1 974 . 2 2 2 38 38 VAL CG1 C 13 23.455 0.2 . 2 . . . . B 225 VAL CG1 . 34702 1 975 . 2 2 2 38 38 VAL CG2 C 13 23.394 0.2 . 2 . . . . B 225 VAL CG2 . 34702 1 976 . 2 2 2 38 38 VAL N N 15 119.055 0.2 . 1 . . . . B 225 VAL N . 34702 1 977 . 2 2 2 39 39 HIS H H 1 9.109 0.02 . 1 . . . . B 226 HIS H . 34702 1 978 . 2 2 2 39 39 HIS HA H 1 4.249 0.02 . 1 . . . . B 226 HIS HA . 34702 1 979 . 2 2 2 39 39 HIS HB2 H 1 2.775 0.02 . 1 . . . . B 226 HIS HB2 . 34702 1 980 . 2 2 2 39 39 HIS HB3 H 1 2.775 0.02 . 1 . . . . B 226 HIS HB3 . 34702 1 981 . 2 2 2 39 39 HIS HD2 H 1 7.019 0.02 . 1 . . . . B 226 HIS HD2 . 34702 1 982 . 2 2 2 39 39 HIS HE1 H 1 7.828 0.02 . 1 . . . . B 226 HIS HE1 . 34702 1 983 . 2 2 2 39 39 HIS C C 13 177.21 0.2 . 1 . . . . B 226 HIS C . 34702 1 984 . 2 2 2 39 39 HIS CA C 13 60.985 0.2 . 1 . . . . B 226 HIS CA . 34702 1 985 . 2 2 2 39 39 HIS CB C 13 30.747 0.2 . 1 . . . . B 226 HIS CB . 34702 1 986 . 2 2 2 39 39 HIS CD2 C 13 120.067 0.2 . 1 . . . . B 226 HIS CD2 . 34702 1 987 . 2 2 2 39 39 HIS CE1 C 13 138.464 0.2 . 1 . . . . B 226 HIS CE1 . 34702 1 988 . 2 2 2 39 39 HIS N N 15 118.766 0.2 . 1 . . . . B 226 HIS N . 34702 1 989 . 2 2 2 40 40 THR H H 1 7.933 0.02 . 1 . . . . B 227 THR H . 34702 1 990 . 2 2 2 40 40 THR HA H 1 3.855 0.02 . 1 . . . . B 227 THR HA . 34702 1 991 . 2 2 2 40 40 THR HB H 1 4.426 0.02 . 1 . . . . B 227 THR HB . 34702 1 992 . 2 2 2 40 40 THR HG21 H 1 1.339 0.02 . 1 . . . . B 227 THR HG21 . 34702 1 993 . 2 2 2 40 40 THR HG22 H 1 1.339 0.02 . 1 . . . . B 227 THR HG22 . 34702 1 994 . 2 2 2 40 40 THR HG23 H 1 1.339 0.02 . 1 . . . . B 227 THR HG23 . 34702 1 995 . 2 2 2 40 40 THR C C 13 176.95 0.2 . 1 . . . . B 227 THR C . 34702 1 996 . 2 2 2 40 40 THR CA C 13 67.261 0.2 . 1 . . . . B 227 THR CA . 34702 1 997 . 2 2 2 40 40 THR CB C 13 68.922 0.2 . 1 . . . . B 227 THR CB . 34702 1 998 . 2 2 2 40 40 THR CG2 C 13 21.737 0.2 . 1 . . . . B 227 THR CG2 . 34702 1 999 . 2 2 2 40 40 THR N N 15 114.237 0.2 . 1 . . . . B 227 THR N . 34702 1 1000 . 2 2 2 41 41 LEU H H 1 7.861 0.02 . 1 . . . . B 228 LEU H . 34702 1 1001 . 2 2 2 41 41 LEU HA H 1 4.115 0.02 . 1 . . . . B 228 LEU HA . 34702 1 1002 . 2 2 2 41 41 LEU HB2 H 1 1.261 0.02 . 1 . . . . B 228 LEU HB2 . 34702 1 1003 . 2 2 2 41 41 LEU HB3 H 1 2.102 0.02 . 1 . . . . B 228 LEU HB3 . 34702 1 1004 . 2 2 2 41 41 LEU HD11 H 1 0.855 0.02 . 2 . . . . B 228 LEU HD11 . 34702 1 1005 . 2 2 2 41 41 LEU HD12 H 1 0.855 0.02 . 2 . . . . B 228 LEU HD12 . 34702 1 1006 . 2 2 2 41 41 LEU HD13 H 1 0.855 0.02 . 2 . . . . B 228 LEU HD13 . 34702 1 1007 . 2 2 2 41 41 LEU HD21 H 1 0.862 0.02 . 2 . . . . B 228 LEU HD21 . 34702 1 1008 . 2 2 2 41 41 LEU HD22 H 1 0.862 0.02 . 2 . . . . B 228 LEU HD22 . 34702 1 1009 . 2 2 2 41 41 LEU HD23 H 1 0.862 0.02 . 2 . . . . B 228 LEU HD23 . 34702 1 1010 . 2 2 2 41 41 LEU C C 13 177.897 0.2 . 1 . . . . B 228 LEU C . 34702 1 1011 . 2 2 2 41 41 LEU CA C 13 58.234 0.2 . 1 . . . . B 228 LEU CA . 34702 1 1012 . 2 2 2 41 41 LEU CB C 13 41.848 0.2 . 1 . . . . B 228 LEU CB . 34702 1 1013 . 2 2 2 41 41 LEU CD1 C 13 27.097 0.2 . 2 . . . . B 228 LEU CD1 . 34702 1 1014 . 2 2 2 41 41 LEU CD2 C 13 23.441 0.2 . 2 . . . . B 228 LEU CD2 . 34702 1 1015 . 2 2 2 41 41 LEU N N 15 121.5 0.2 . 1 . . . . B 228 LEU N . 34702 1 1016 . 2 2 2 42 42 PHE H H 1 9.036 0.02 . 1 . . . . B 229 PHE H . 34702 1 1017 . 2 2 2 42 42 PHE HA H 1 3.808 0.02 . 1 . . . . B 229 PHE HA . 34702 1 1018 . 2 2 2 42 42 PHE HB2 H 1 3.492 0.02 . 2 . . . . B 229 PHE HB2 . 34702 1 1019 . 2 2 2 42 42 PHE HB3 H 1 2.88 0.02 . 2 . . . . B 229 PHE HB3 . 34702 1 1020 . 2 2 2 42 42 PHE HD1 H 1 7.159 0.02 . 1 . . . . B 229 PHE HD1 . 34702 1 1021 . 2 2 2 42 42 PHE HD2 H 1 7.159 0.02 . 1 . . . . B 229 PHE HD2 . 34702 1 1022 . 2 2 2 42 42 PHE C C 13 178.676 0.2 . 1 . . . . B 229 PHE C . 34702 1 1023 . 2 2 2 42 42 PHE CA C 13 62.339 0.2 . 1 . . . . B 229 PHE CA . 34702 1 1024 . 2 2 2 42 42 PHE CB C 13 37.815 0.2 . 1 . . . . B 229 PHE CB . 34702 1 1025 . 2 2 2 42 42 PHE N N 15 120.98 0.2 . 1 . . . . B 229 PHE N . 34702 1 1026 . 2 2 2 43 43 LEU H H 1 8.244 0.02 . 1 . . . . B 230 LEU H . 34702 1 1027 . 2 2 2 43 43 LEU HA H 1 4.107 0.02 . 1 . . . . B 230 LEU HA . 34702 1 1028 . 2 2 2 43 43 LEU HB2 H 1 1.507 0.02 . 1 . . . . B 230 LEU HB2 . 34702 1 1029 . 2 2 2 43 43 LEU HB3 H 1 1.683 0.02 . 1 . . . . B 230 LEU HB3 . 34702 1 1030 . 2 2 2 43 43 LEU HG H 1 1.49 0.02 . 1 . . . . B 230 LEU HG . 34702 1 1031 . 2 2 2 43 43 LEU HD11 H 1 0.727 0.02 . 2 . . . . B 230 LEU HD11 . 34702 1 1032 . 2 2 2 43 43 LEU HD12 H 1 0.727 0.02 . 2 . . . . B 230 LEU HD12 . 34702 1 1033 . 2 2 2 43 43 LEU HD13 H 1 0.727 0.02 . 2 . . . . B 230 LEU HD13 . 34702 1 1034 . 2 2 2 43 43 LEU HD21 H 1 0.814 0.02 . 2 . . . . B 230 LEU HD21 . 34702 1 1035 . 2 2 2 43 43 LEU HD22 H 1 0.814 0.02 . 2 . . . . B 230 LEU HD22 . 34702 1 1036 . 2 2 2 43 43 LEU HD23 H 1 0.814 0.02 . 2 . . . . B 230 LEU HD23 . 34702 1 1037 . 2 2 2 43 43 LEU C C 13 180.813 0.2 . 1 . . . . B 230 LEU C . 34702 1 1038 . 2 2 2 43 43 LEU CA C 13 57.879 0.2 . 1 . . . . B 230 LEU CA . 34702 1 1039 . 2 2 2 43 43 LEU CB C 13 41.879 0.2 . 1 . . . . B 230 LEU CB . 34702 1 1040 . 2 2 2 43 43 LEU CG C 13 26.805 0.2 . 1 . . . . B 230 LEU CG . 34702 1 1041 . 2 2 2 43 43 LEU CD1 C 13 24.539 0.2 . 2 . . . . B 230 LEU CD1 . 34702 1 1042 . 2 2 2 43 43 LEU CD2 C 13 23.665 0.2 . 2 . . . . B 230 LEU CD2 . 34702 1 1043 . 2 2 2 43 43 LEU N N 15 118.343 0.2 . 1 . . . . B 230 LEU N . 34702 1 1044 . 2 2 2 44 44 LYS H H 1 7.922 0.02 . 1 . . . . B 231 LYS H . 34702 1 1045 . 2 2 2 44 44 LYS HA H 1 3.975 0.02 . 1 . . . . B 231 LYS HA . 34702 1 1046 . 2 2 2 44 44 LYS HB2 H 1 1.874 0.02 . 2 . . . . B 231 LYS HB2 . 34702 1 1047 . 2 2 2 44 44 LYS HB3 H 1 1.982 0.02 . 2 . . . . B 231 LYS HB3 . 34702 1 1048 . 2 2 2 44 44 LYS HG2 H 1 1.427 0.02 . 1 . . . . B 231 LYS HG2 . 34702 1 1049 . 2 2 2 44 44 LYS HG3 H 1 1.427 0.02 . 1 . . . . B 231 LYS HG3 . 34702 1 1050 . 2 2 2 44 44 LYS HD2 H 1 1.534 0.02 . 1 . . . . B 231 LYS HD2 . 34702 1 1051 . 2 2 2 44 44 LYS HD3 H 1 1.534 0.02 . 1 . . . . B 231 LYS HD3 . 34702 1 1052 . 2 2 2 44 44 LYS HE2 H 1 2.918 0.02 . 1 . . . . B 231 LYS HE2 . 34702 1 1053 . 2 2 2 44 44 LYS HE3 H 1 2.918 0.02 . 1 . . . . B 231 LYS HE3 . 34702 1 1054 . 2 2 2 44 44 LYS C C 13 178.469 0.2 . 1 . . . . B 231 LYS C . 34702 1 1055 . 2 2 2 44 44 LYS CA C 13 59.08 0.2 . 1 . . . . B 231 LYS CA . 34702 1 1056 . 2 2 2 44 44 LYS CB C 13 32.406 0.2 . 1 . . . . B 231 LYS CB . 34702 1 1057 . 2 2 2 44 44 LYS CG C 13 24.814 0.2 . 1 . . . . B 231 LYS CG . 34702 1 1058 . 2 2 2 44 44 LYS CD C 13 28.861 0.2 . 1 . . . . B 231 LYS CD . 34702 1 1059 . 2 2 2 44 44 LYS CE C 13 41.942 0.2 . 1 . . . . B 231 LYS CE . 34702 1 1060 . 2 2 2 44 44 LYS N N 15 120.849 0.2 . 1 . . . . B 231 LYS N . 34702 1 1061 . 2 2 2 45 45 LEU H H 1 7.708 0.02 . 1 . . . . B 232 LEU H . 34702 1 1062 . 2 2 2 45 45 LEU HA H 1 4.14 0.02 . 1 . . . . B 232 LEU HA . 34702 1 1063 . 2 2 2 45 45 LEU HB2 H 1 1.49 0.02 . 2 . . . . B 232 LEU HB2 . 34702 1 1064 . 2 2 2 45 45 LEU HB3 H 1 1.327 0.02 . 2 . . . . B 232 LEU HB3 . 34702 1 1065 . 2 2 2 45 45 LEU HG H 1 1.653 0.02 . 1 . . . . B 232 LEU HG . 34702 1 1066 . 2 2 2 45 45 LEU HD11 H 1 0.762 0.02 . 2 . . . . B 232 LEU HD11 . 34702 1 1067 . 2 2 2 45 45 LEU HD12 H 1 0.762 0.02 . 2 . . . . B 232 LEU HD12 . 34702 1 1068 . 2 2 2 45 45 LEU HD13 H 1 0.762 0.02 . 2 . . . . B 232 LEU HD13 . 34702 1 1069 . 2 2 2 45 45 LEU HD21 H 1 0.726 0.02 . 2 . . . . B 232 LEU HD21 . 34702 1 1070 . 2 2 2 45 45 LEU HD22 H 1 0.726 0.02 . 2 . . . . B 232 LEU HD22 . 34702 1 1071 . 2 2 2 45 45 LEU HD23 H 1 0.726 0.02 . 2 . . . . B 232 LEU HD23 . 34702 1 1072 . 2 2 2 45 45 LEU C C 13 176.916 0.2 . 1 . . . . B 232 LEU C . 34702 1 1073 . 2 2 2 45 45 LEU CA C 13 54.671 0.2 . 1 . . . . B 232 LEU CA . 34702 1 1074 . 2 2 2 45 45 LEU CB C 13 43.123 0.2 . 1 . . . . B 232 LEU CB . 34702 1 1075 . 2 2 2 45 45 LEU CG C 13 27.225 0.2 . 1 . . . . B 232 LEU CG . 34702 1 1076 . 2 2 2 45 45 LEU CD1 C 13 22.306 0.2 . 2 . . . . B 232 LEU CD1 . 34702 1 1077 . 2 2 2 45 45 LEU CD2 C 13 25.545 0.2 . 2 . . . . B 232 LEU CD2 . 34702 1 1078 . 2 2 2 45 45 LEU N N 15 116.67 0.2 . 1 . . . . B 232 LEU N . 34702 1 1079 . 2 2 2 46 46 GLY H H 1 7.739 0.02 . 1 . . . . B 233 GLY H . 34702 1 1080 . 2 2 2 46 46 GLY HA2 H 1 3.858 0.02 . 1 . . . . B 233 GLY HA2 . 34702 1 1081 . 2 2 2 46 46 GLY HA3 H 1 3.858 0.02 . 1 . . . . B 233 GLY HA3 . 34702 1 1082 . 2 2 2 46 46 GLY C C 13 174.71 0.2 . 1 . . . . B 233 GLY C . 34702 1 1083 . 2 2 2 46 46 GLY CA C 13 46.507 0.2 . 1 . . . . B 233 GLY CA . 34702 1 1084 . 2 2 2 46 46 GLY N N 15 109.518 0.2 . 1 . . . . B 233 GLY N . 34702 1 1085 . 2 2 2 47 47 LEU H H 1 7.941 0.02 . 1 . . . . B 234 LEU H . 34702 1 1086 . 2 2 2 47 47 LEU HA H 1 4.012 0.02 . 1 . . . . B 234 LEU HA . 34702 1 1087 . 2 2 2 47 47 LEU HB2 H 1 0.354 0.02 . 2 . . . . B 234 LEU HB2 . 34702 1 1088 . 2 2 2 47 47 LEU HB3 H 1 0.861 0.02 . 2 . . . . B 234 LEU HB3 . 34702 1 1089 . 2 2 2 47 47 LEU HG H 1 0.913 0.02 . 1 . . . . B 234 LEU HG . 34702 1 1090 . 2 2 2 47 47 LEU HD11 H 1 -0.276 0.02 . 2 . . . . B 234 LEU HD11 . 34702 1 1091 . 2 2 2 47 47 LEU HD12 H 1 -0.276 0.02 . 2 . . . . B 234 LEU HD12 . 34702 1 1092 . 2 2 2 47 47 LEU HD13 H 1 -0.276 0.02 . 2 . . . . B 234 LEU HD13 . 34702 1 1093 . 2 2 2 47 47 LEU HD21 H 1 -0.193 0.02 . 2 . . . . B 234 LEU HD21 . 34702 1 1094 . 2 2 2 47 47 LEU HD22 H 1 -0.193 0.02 . 2 . . . . B 234 LEU HD22 . 34702 1 1095 . 2 2 2 47 47 LEU HD23 H 1 -0.193 0.02 . 2 . . . . B 234 LEU HD23 . 34702 1 1096 . 2 2 2 47 47 LEU C C 13 176.337 0.2 . 1 . . . . B 234 LEU C . 34702 1 1097 . 2 2 2 47 47 LEU CA C 13 53.538 0.2 . 1 . . . . B 234 LEU CA . 34702 1 1098 . 2 2 2 47 47 LEU CB C 13 42.509 0.2 . 1 . . . . B 234 LEU CB . 34702 1 1099 . 2 2 2 47 47 LEU CG C 13 24.985 0.2 . 1 . . . . B 234 LEU CG . 34702 1 1100 . 2 2 2 47 47 LEU CD1 C 13 24.343 0.2 . 2 . . . . B 234 LEU CD1 . 34702 1 1101 . 2 2 2 47 47 LEU CD2 C 13 20.255 0.2 . 2 . . . . B 234 LEU CD2 . 34702 1 1102 . 2 2 2 47 47 LEU N N 15 119.683 0.2 . 1 . . . . B 234 LEU N . 34702 1 1103 . 2 2 2 48 48 ASP H H 1 8.143 0.02 . 1 . . . . B 235 ASP H . 34702 1 1104 . 2 2 2 48 48 ASP HA H 1 4.66 0.02 . 1 . . . . B 235 ASP HA . 34702 1 1105 . 2 2 2 48 48 ASP HB2 H 1 2.651 0.02 . 2 . . . . B 235 ASP HB2 . 34702 1 1106 . 2 2 2 48 48 ASP HB3 H 1 2.749 0.02 . 2 . . . . B 235 ASP HB3 . 34702 1 1107 . 2 2 2 48 48 ASP C C 13 174.904 0.2 . 1 . . . . B 235 ASP C . 34702 1 1108 . 2 2 2 48 48 ASP CA C 13 54.746 0.2 . 1 . . . . B 235 ASP CA . 34702 1 1109 . 2 2 2 48 48 ASP CB C 13 42.034 0.2 . 1 . . . . B 235 ASP CB . 34702 1 1110 . 2 2 2 48 48 ASP N N 15 121.116 0.2 . 1 . . . . B 235 ASP N . 34702 1 1111 . 2 2 2 49 49 SER H H 1 7.925 0.02 . 1 . . . . B 236 SER H . 34702 1 1112 . 2 2 2 49 49 SER HA H 1 4.318 0.02 . 1 . . . . B 236 SER HA . 34702 1 1113 . 2 2 2 49 49 SER HB2 H 1 3.558 0.02 . 2 . . . . B 236 SER HB2 . 34702 1 1114 . 2 2 2 49 49 SER HB3 H 1 3.629 0.02 . 2 . . . . B 236 SER HB3 . 34702 1 1115 . 2 2 2 49 49 SER CA C 13 59.724 0.2 . 1 . . . . B 236 SER CA . 34702 1 1116 . 2 2 2 49 49 SER CB C 13 65.239 0.2 . 1 . . . . B 236 SER CB . 34702 1 1117 . 2 2 2 49 49 SER N N 15 121.005 0.2 . 1 . . . . B 236 SER N . 34702 1 stop_ save_