data_34216 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34216 _Entry.Title ; PH domain from TgAPH ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-12-13 _Entry.Accession_date 2017-12-13 _Entry.Last_release_date 2019-01-22 _Entry.Original_release_date 2019-01-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34216 stop_ 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 N. Darvill N. . . . 34216 2 B. Liu B. . . . 34216 3 S. Matthews S. . . . 34216 4 D. Soldati-Favre D. . . . 34216 5 S. Rouse S. . . . 34216 6 S. Benjamin S. . . . 34216 7 T. Blake T. . . . 34216 8 D. Dubois D. J. . . 34216 9 P. Hammoudi P. M. . . 34216 10 P. Pino P. . . . 34216 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'LIPID BINDING PROTEIN' . 34216 'PH domain' . 34216 'membrane association' . 34216 'phosphatidic acid binding' . 34216 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34216 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 538 34216 '15N chemical shifts' 126 34216 '1H chemical shifts' 846 34216 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 . . 2019-01-28 . original BMRB . 34216 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6F8E . 34216 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34216 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1016/j.str.2018.05.001 _Citation.PubMed_ID 29910186 _Citation.Full_citation . _Citation.Title ; Structural Basis of Phosphatidic Acid Sensing by APH in Apicomplexan Parasites. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 26 _Citation.Journal_issue . _Citation.Journal_ASTM STRUE6 _Citation.Journal_ISSN 1878-4186 _Citation.Journal_CSD 2005 _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 1059 _Citation.Page_last 1071 _Citation.Year 2018 _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 N. Darvill N. . . . 34216 1 2 D. Dubois D. J. . . 34216 1 3 S. Rouse S. L. . . 34216 1 4 P. Hammoudi P. M. . . 34216 1 5 T. Blake T. . . . 34216 1 6 S. Benjamin S. . . . 34216 1 7 B. Liu B. . . . 34216 1 8 D. Soldati-Favre D. . . . 34216 1 9 S. Matthews S. . . . 34216 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34216 _Assembly.ID 1 _Assembly.Name 'Uncharacterized protein' _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 entity_1 1 $entity_1 A A yes . . . . . . 34216 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34216 _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 ; SASDIRMKKVMQYRRALTKV VKLKTHLFSETVKVTCSKDG EEVQWFKGKSTAGAQDRKKP SGGFPVDKITSVKSQADNTK VLVITVNNPQPTTYNFTFKS PGERESWQEQIQSLMKFMSM K ; _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 121 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13759.891 _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 11 SER . 34216 1 2 12 ALA . 34216 1 3 13 SER . 34216 1 4 14 ASP . 34216 1 5 15 ILE . 34216 1 6 16 ARG . 34216 1 7 17 MET . 34216 1 8 18 LYS . 34216 1 9 19 LYS . 34216 1 10 20 VAL . 34216 1 11 21 MET . 34216 1 12 22 GLN . 34216 1 13 23 TYR . 34216 1 14 24 ARG . 34216 1 15 25 ARG . 34216 1 16 26 ALA . 34216 1 17 27 LEU . 34216 1 18 28 THR . 34216 1 19 29 LYS . 34216 1 20 30 VAL . 34216 1 21 31 VAL . 34216 1 22 32 LYS . 34216 1 23 33 LEU . 34216 1 24 34 LYS . 34216 1 25 35 THR . 34216 1 26 36 HIS . 34216 1 27 37 LEU . 34216 1 28 38 PHE . 34216 1 29 39 SER . 34216 1 30 40 GLU . 34216 1 31 41 THR . 34216 1 32 42 VAL . 34216 1 33 43 LYS . 34216 1 34 44 VAL . 34216 1 35 45 THR . 34216 1 36 46 CYS . 34216 1 37 47 SER . 34216 1 38 48 LYS . 34216 1 39 49 ASP . 34216 1 40 50 GLY . 34216 1 41 51 GLU . 34216 1 42 52 GLU . 34216 1 43 53 VAL . 34216 1 44 54 GLN . 34216 1 45 55 TRP . 34216 1 46 56 PHE . 34216 1 47 57 LYS . 34216 1 48 58 GLY . 34216 1 49 59 LYS . 34216 1 50 60 SER . 34216 1 51 61 THR . 34216 1 52 62 ALA . 34216 1 53 63 GLY . 34216 1 54 64 ALA . 34216 1 55 65 GLN . 34216 1 56 66 ASP . 34216 1 57 67 ARG . 34216 1 58 68 LYS . 34216 1 59 69 LYS . 34216 1 60 70 PRO . 34216 1 61 71 SER . 34216 1 62 72 GLY . 34216 1 63 73 GLY . 34216 1 64 74 PHE . 34216 1 65 75 PRO . 34216 1 66 76 VAL . 34216 1 67 77 ASP . 34216 1 68 78 LYS . 34216 1 69 79 ILE . 34216 1 70 80 THR . 34216 1 71 81 SER . 34216 1 72 82 VAL . 34216 1 73 83 LYS . 34216 1 74 84 SER . 34216 1 75 85 GLN . 34216 1 76 86 ALA . 34216 1 77 87 ASP . 34216 1 78 88 ASN . 34216 1 79 89 THR . 34216 1 80 90 LYS . 34216 1 81 91 VAL . 34216 1 82 92 LEU . 34216 1 83 93 VAL . 34216 1 84 94 ILE . 34216 1 85 95 THR . 34216 1 86 96 VAL . 34216 1 87 97 ASN . 34216 1 88 98 ASN . 34216 1 89 99 PRO . 34216 1 90 100 GLN . 34216 1 91 101 PRO . 34216 1 92 102 THR . 34216 1 93 103 THR . 34216 1 94 104 TYR . 34216 1 95 105 ASN . 34216 1 96 106 PHE . 34216 1 97 107 THR . 34216 1 98 108 PHE . 34216 1 99 109 LYS . 34216 1 100 110 SER . 34216 1 101 111 PRO . 34216 1 102 112 GLY . 34216 1 103 113 GLU . 34216 1 104 114 ARG . 34216 1 105 115 GLU . 34216 1 106 116 SER . 34216 1 107 117 TRP . 34216 1 108 118 GLN . 34216 1 109 119 GLU . 34216 1 110 120 GLN . 34216 1 111 121 ILE . 34216 1 112 122 GLN . 34216 1 113 123 SER . 34216 1 114 124 LEU . 34216 1 115 125 MET . 34216 1 116 126 LYS . 34216 1 117 127 PHE . 34216 1 118 128 MET . 34216 1 119 129 SER . 34216 1 120 130 MET . 34216 1 121 131 LYS . 34216 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 34216 1 . ALA 2 2 34216 1 . SER 3 3 34216 1 . ASP 4 4 34216 1 . ILE 5 5 34216 1 . ARG 6 6 34216 1 . MET 7 7 34216 1 . LYS 8 8 34216 1 . LYS 9 9 34216 1 . VAL 10 10 34216 1 . MET 11 11 34216 1 . GLN 12 12 34216 1 . TYR 13 13 34216 1 . ARG 14 14 34216 1 . ARG 15 15 34216 1 . ALA 16 16 34216 1 . LEU 17 17 34216 1 . THR 18 18 34216 1 . LYS 19 19 34216 1 . VAL 20 20 34216 1 . VAL 21 21 34216 1 . LYS 22 22 34216 1 . LEU 23 23 34216 1 . LYS 24 24 34216 1 . THR 25 25 34216 1 . HIS 26 26 34216 1 . LEU 27 27 34216 1 . PHE 28 28 34216 1 . SER 29 29 34216 1 . GLU 30 30 34216 1 . THR 31 31 34216 1 . VAL 32 32 34216 1 . LYS 33 33 34216 1 . VAL 34 34 34216 1 . THR 35 35 34216 1 . CYS 36 36 34216 1 . SER 37 37 34216 1 . LYS 38 38 34216 1 . ASP 39 39 34216 1 . GLY 40 40 34216 1 . GLU 41 41 34216 1 . GLU 42 42 34216 1 . VAL 43 43 34216 1 . GLN 44 44 34216 1 . TRP 45 45 34216 1 . PHE 46 46 34216 1 . LYS 47 47 34216 1 . GLY 48 48 34216 1 . LYS 49 49 34216 1 . SER 50 50 34216 1 . THR 51 51 34216 1 . ALA 52 52 34216 1 . GLY 53 53 34216 1 . ALA 54 54 34216 1 . GLN 55 55 34216 1 . ASP 56 56 34216 1 . ARG 57 57 34216 1 . LYS 58 58 34216 1 . LYS 59 59 34216 1 . PRO 60 60 34216 1 . SER 61 61 34216 1 . GLY 62 62 34216 1 . GLY 63 63 34216 1 . PHE 64 64 34216 1 . PRO 65 65 34216 1 . VAL 66 66 34216 1 . ASP 67 67 34216 1 . LYS 68 68 34216 1 . ILE 69 69 34216 1 . THR 70 70 34216 1 . SER 71 71 34216 1 . VAL 72 72 34216 1 . LYS 73 73 34216 1 . SER 74 74 34216 1 . GLN 75 75 34216 1 . ALA 76 76 34216 1 . ASP 77 77 34216 1 . ASN 78 78 34216 1 . THR 79 79 34216 1 . LYS 80 80 34216 1 . VAL 81 81 34216 1 . LEU 82 82 34216 1 . VAL 83 83 34216 1 . ILE 84 84 34216 1 . THR 85 85 34216 1 . VAL 86 86 34216 1 . ASN 87 87 34216 1 . ASN 88 88 34216 1 . PRO 89 89 34216 1 . GLN 90 90 34216 1 . PRO 91 91 34216 1 . THR 92 92 34216 1 . THR 93 93 34216 1 . TYR 94 94 34216 1 . ASN 95 95 34216 1 . PHE 96 96 34216 1 . THR 97 97 34216 1 . PHE 98 98 34216 1 . LYS 99 99 34216 1 . SER 100 100 34216 1 . PRO 101 101 34216 1 . GLY 102 102 34216 1 . GLU 103 103 34216 1 . ARG 104 104 34216 1 . GLU 105 105 34216 1 . SER 106 106 34216 1 . TRP 107 107 34216 1 . GLN 108 108 34216 1 . GLU 109 109 34216 1 . GLN 110 110 34216 1 . ILE 111 111 34216 1 . GLN 112 112 34216 1 . SER 113 113 34216 1 . LEU 114 114 34216 1 . MET 115 115 34216 1 . LYS 116 116 34216 1 . PHE 117 117 34216 1 . MET 118 118 34216 1 . SER 119 119 34216 1 . MET 120 120 34216 1 . LYS 121 121 34216 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34216 _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 . 508771 organism . 'Toxoplasma gondii (strain ATCC 50611 / Me49)' 'Toxoplasma gondii' . . Eukaryota . Toxoplasma gondii 'ATCC 50611 / Me49' . . . . . . . . . . TGME49_249970 . 34216 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 34216 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34216 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34216 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '730 uM [U-100% 15N]; [U-100% 13C] C-terminal PH domain from TgAPH, 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 'C-terminal PH domain from TgAPH' '[U-100% 15N]; [U-100% 13C]' . . 1 $entity_1 . . 730 . . uM . . . . 34216 1 2 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 34216 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34216 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 34216 1 pH 7 . pH 34216 1 pressure 1 . atm 34216 1 temperature 298 . K 34216 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34216 _Software.ID 1 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger A. T. et.al.' . . 34216 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 34216 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34216 _Software.ID 2 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 34216 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 34216 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34216 _Software.ID 3 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 34216 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 34216 3 'peak picking' 34216 3 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 34216 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 34216 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DRX . 800 . . . 34216 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 34216 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34216 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 34216 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.78 internal indirect 0.25144953 . . . . . 34216 1 H 1 water protons . . . . ppm 4.78 internal direct 1.0 . . . . . 34216 1 N 15 water protons . . . . ppm 4.78 internal indirect 0.10132912 . . . . . 34216 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 34216 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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' . . . 34216 1 2 '3D CBCA(CO)NH' . . . 34216 1 3 '3D HNCACB' . . . 34216 1 4 '3D HNCO' . . . 34216 1 5 '3D HN(CO)CA' . . . 34216 1 6 '3D HBHA(CO)NH' . . . 34216 1 7 '3D C(CO)NH' . . . 34216 1 8 '3D H(CCO)NH' . . . 34216 1 9 '3D 1H-15N NOESY' . . . 34216 1 10 '3D 1H-13C NOESY' . . . 34216 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER H H 1 8.474 . . . . . . . A 11 SER H1 . 34216 1 2 . 1 1 1 1 SER HA H 1 4.453 . . . . . . . A 11 SER HA . 34216 1 3 . 1 1 1 1 SER HB2 H 1 4.083 . . . . . . . A 11 SER HB2 . 34216 1 4 . 1 1 1 1 SER HB3 H 1 3.913 . . . . . . . A 11 SER HB3 . 34216 1 5 . 1 1 1 1 SER C C 13 175.021 . . . . . . . A 11 SER C . 34216 1 6 . 1 1 1 1 SER CA C 13 58.469 . . . . . . . A 11 SER CA . 34216 1 7 . 1 1 1 1 SER CB C 13 63.974 . . . . . . . A 11 SER CB . 34216 1 8 . 1 1 1 1 SER N N 15 119.182 . . . . . . . A 11 SER N . 34216 1 9 . 1 1 2 2 ALA H H 1 8.495 . . . . . . . A 12 ALA H . 34216 1 10 . 1 1 2 2 ALA HA H 1 4.216 . . . . . . . A 12 ALA HA . 34216 1 11 . 1 1 2 2 ALA HB1 H 1 1.467 . . . . . . . A 12 ALA HB1 . 34216 1 12 . 1 1 2 2 ALA HB2 H 1 1.467 . . . . . . . A 12 ALA HB2 . 34216 1 13 . 1 1 2 2 ALA HB3 H 1 1.467 . . . . . . . A 12 ALA HB3 . 34216 1 14 . 1 1 2 2 ALA C C 13 179.519 . . . . . . . A 12 ALA C . 34216 1 15 . 1 1 2 2 ALA CA C 13 54.306 . . . . . . . A 12 ALA CA . 34216 1 16 . 1 1 2 2 ALA CB C 13 18.700 . . . . . . . A 12 ALA CB . 34216 1 17 . 1 1 2 2 ALA N N 15 125.101 . . . . . . . A 12 ALA N . 34216 1 18 . 1 1 3 3 SER H H 1 8.287 . . . . . . . A 13 SER H . 34216 1 19 . 1 1 3 3 SER HA H 1 4.307 . . . . . . . A 13 SER HA . 34216 1 20 . 1 1 3 3 SER HB2 H 1 3.954 . . . . . . . A 13 SER HB2 . 34216 1 21 . 1 1 3 3 SER HB3 H 1 3.901 . . . . . . . A 13 SER HB3 . 34216 1 22 . 1 1 3 3 SER C C 13 179.541 . . . . . . . A 13 SER C . 34216 1 23 . 1 1 3 3 SER CA C 13 60.221 . . . . . . . A 13 SER CA . 34216 1 24 . 1 1 3 3 SER CB C 13 63.069 . . . . . . . A 13 SER CB . 34216 1 25 . 1 1 3 3 SER N N 15 113.806 . . . . . . . A 13 SER N . 34216 1 26 . 1 1 4 4 ASP H H 1 8.026 . . . . . . . A 14 ASP H . 34216 1 27 . 1 1 4 4 ASP HA H 1 4.538 . . . . . . . A 14 ASP HA . 34216 1 28 . 1 1 4 4 ASP HB2 H 1 2.824 . . . . . . . A 14 ASP HB2 . 34216 1 29 . 1 1 4 4 ASP HB3 H 1 2.725 . . . . . . . A 14 ASP HB3 . 34216 1 30 . 1 1 4 4 ASP C C 13 177.970 . . . . . . . A 14 ASP C . 34216 1 31 . 1 1 4 4 ASP CA C 13 56.278 . . . . . . . A 14 ASP CA . 34216 1 32 . 1 1 4 4 ASP CB C 13 41.089 . . . . . . . A 14 ASP CB . 34216 1 33 . 1 1 4 4 ASP N N 15 123.362 . . . . . . . A 14 ASP N . 34216 1 34 . 1 1 5 5 ILE H H 1 8.064 . . . . . . . A 15 ILE H . 34216 1 35 . 1 1 5 5 ILE HA H 1 3.763 . . . . . . . A 15 ILE HA . 34216 1 36 . 1 1 5 5 ILE HB H 1 1.962 . . . . . . . A 15 ILE HB . 34216 1 37 . 1 1 5 5 ILE HG12 H 1 1.636 . . . . . . . A 15 ILE HG12 . 34216 1 38 . 1 1 5 5 ILE HG13 H 1 1.245 . . . . . . . A 15 ILE HG13 . 34216 1 39 . 1 1 5 5 ILE HG21 H 1 0.983 . . . . . . . A 15 ILE HG21 . 34216 1 40 . 1 1 5 5 ILE HG22 H 1 0.983 . . . . . . . A 15 ILE HG22 . 34216 1 41 . 1 1 5 5 ILE HG23 H 1 0.983 . . . . . . . A 15 ILE HG23 . 34216 1 42 . 1 1 5 5 ILE HD11 H 1 0.866 . . . . . . . A 15 ILE HD11 . 34216 1 43 . 1 1 5 5 ILE HD12 H 1 0.866 . . . . . . . A 15 ILE HD12 . 34216 1 44 . 1 1 5 5 ILE HD13 H 1 0.866 . . . . . . . A 15 ILE HD13 . 34216 1 45 . 1 1 5 5 ILE C C 13 178.268 . . . . . . . A 15 ILE C . 34216 1 46 . 1 1 5 5 ILE CA C 13 64.384 . . . . . . . A 15 ILE CA . 34216 1 47 . 1 1 5 5 ILE CB C 13 38.021 . . . . . . . A 15 ILE CB . 34216 1 48 . 1 1 5 5 ILE CG1 C 13 28.776 . . . . . . . A 15 ILE CG1 . 34216 1 49 . 1 1 5 5 ILE CG2 C 13 17.379 . . . . . . . A 15 ILE CG2 . 34216 1 50 . 1 1 5 5 ILE CD1 C 13 13.041 . . . . . . . A 15 ILE CD1 . 34216 1 51 . 1 1 5 5 ILE N N 15 121.174 . . . . . . . A 15 ILE N . 34216 1 52 . 1 1 6 6 ARG H H 1 8.081 . . . . . . . A 16 ARG H . 34216 1 53 . 1 1 6 6 ARG HA H 1 4.218 . . . . . . . A 16 ARG HA . 34216 1 54 . 1 1 6 6 ARG HB2 H 1 2.030 . . . . . . . A 16 ARG HB2 . 34216 1 55 . 1 1 6 6 ARG HB3 H 1 2.038 . . . . . . . A 16 ARG HB3 . 34216 1 56 . 1 1 6 6 ARG HG2 H 1 1.707 . . . . . . . A 16 ARG HG2 . 34216 1 57 . 1 1 6 6 ARG HG3 H 1 1.707 . . . . . . . A 16 ARG HG3 . 34216 1 58 . 1 1 6 6 ARG HD2 H 1 3.228 . . . . . . . A 16 ARG HD2 . 34216 1 59 . 1 1 6 6 ARG HD3 H 1 3.184 . . . . . . . A 16 ARG HD3 . 34216 1 60 . 1 1 6 6 ARG C C 13 178.268 . . . . . . . A 16 ARG C . 34216 1 61 . 1 1 6 6 ARG CA C 13 60.222 . . . . . . . A 16 ARG CA . 34216 1 62 . 1 1 6 6 ARG CB C 13 29.915 . . . . . . . A 16 ARG CB . 34216 1 63 . 1 1 6 6 ARG CG C 13 28.470 . . . . . . . A 16 ARG CG . 34216 1 64 . 1 1 6 6 ARG CD C 13 43.236 . . . . . . . A 16 ARG CD . 34216 1 65 . 1 1 6 6 ARG N N 15 121.132 . . . . . . . A 16 ARG N . 34216 1 66 . 1 1 7 7 MET H H 1 8.205 . . . . . . . A 17 MET H . 34216 1 67 . 1 1 7 7 MET HA H 1 4.329 . . . . . . . A 17 MET HA . 34216 1 68 . 1 1 7 7 MET HB2 H 1 2.661 . . . . . . . A 17 MET HB2 . 34216 1 69 . 1 1 7 7 MET HB3 H 1 2.260 . . . . . . . A 17 MET HB3 . 34216 1 70 . 1 1 7 7 MET HG2 H 1 2.797 . . . . . . . A 17 MET HG2 . 34216 1 71 . 1 1 7 7 MET HG3 H 1 2.261 . . . . . . . A 17 MET HG3 . 34216 1 72 . 1 1 7 7 MET C C 13 179.180 . . . . . . . A 17 MET C . 34216 1 73 . 1 1 7 7 MET CA C 13 58.177 . . . . . . . A 17 MET CA . 34216 1 74 . 1 1 7 7 MET CB C 13 32.207 . . . . . . . A 17 MET CB . 34216 1 75 . 1 1 7 7 MET CG C 13 32.454 . . . . . . . A 17 MET CG . 34216 1 76 . 1 1 7 7 MET N N 15 117.294 . . . . . . . A 17 MET N . 34216 1 77 . 1 1 8 8 LYS H H 1 8.069 . . . . . . . A 18 LYS H . 34216 1 78 . 1 1 8 8 LYS HA H 1 4.013 . . . . . . . A 18 LYS HA . 34216 1 79 . 1 1 8 8 LYS HB2 H 1 1.914 . . . . . . . A 18 LYS HB2 . 34216 1 80 . 1 1 8 8 LYS HB3 H 1 1.864 . . . . . . . A 18 LYS HB3 . 34216 1 81 . 1 1 8 8 LYS HG2 H 1 1.384 . . . . . . . A 18 LYS HG2 . 34216 1 82 . 1 1 8 8 LYS HG3 H 1 1.384 . . . . . . . A 18 LYS HG3 . 34216 1 83 . 1 1 8 8 LYS HD2 H 1 1.633 . . . . . . . A 18 LYS HD2 . 34216 1 84 . 1 1 8 8 LYS HD3 H 1 1.633 . . . . . . . A 18 LYS HD3 . 34216 1 85 . 1 1 8 8 LYS HE2 H 1 2.966 . . . . . . . A 18 LYS HE2 . 34216 1 86 . 1 1 8 8 LYS HE3 H 1 2.966 . . . . . . . A 18 LYS HE3 . 34216 1 87 . 1 1 8 8 LYS C C 13 179.498 . . . . . . . A 18 LYS C . 34216 1 88 . 1 1 8 8 LYS CA C 13 59.783 . . . . . . . A 18 LYS CA . 34216 1 89 . 1 1 8 8 LYS CB C 13 32.252 . . . . . . . A 18 LYS CB . 34216 1 90 . 1 1 8 8 LYS CG C 13 25.714 . . . . . . . A 18 LYS CG . 34216 1 91 . 1 1 8 8 LYS CD C 13 29.409 . . . . . . . A 18 LYS CD . 34216 1 92 . 1 1 8 8 LYS CE C 13 42.131 . . . . . . . A 18 LYS CE . 34216 1 93 . 1 1 8 8 LYS N N 15 120.168 . . . . . . . A 18 LYS N . 34216 1 94 . 1 1 9 9 LYS H H 1 7.863 . . . . . . . A 19 LYS H . 34216 1 95 . 1 1 9 9 LYS HA H 1 3.844 . . . . . . . A 19 LYS HA . 34216 1 96 . 1 1 9 9 LYS HB2 H 1 1.864 . . . . . . . A 19 LYS HB2 . 34216 1 97 . 1 1 9 9 LYS HB3 H 1 1.469 . . . . . . . A 19 LYS HB3 . 34216 1 98 . 1 1 9 9 LYS HG2 H 1 1.052 . . . . . . . A 19 LYS HG2 . 34216 1 99 . 1 1 9 9 LYS HG3 H 1 1.052 . . . . . . . A 19 LYS HG3 . 34216 1 100 . 1 1 9 9 LYS HD2 H 1 1.410 . . . . . . . A 19 LYS HD2 . 34216 1 101 . 1 1 9 9 LYS HD3 H 1 1.410 . . . . . . . A 19 LYS HD3 . 34216 1 102 . 1 1 9 9 LYS HE2 H 1 2.691 . . . . . . . A 19 LYS HE2 . 34216 1 103 . 1 1 9 9 LYS HE3 H 1 2.691 . . . . . . . A 19 LYS HE3 . 34216 1 104 . 1 1 9 9 LYS C C 13 179.138 . . . . . . . A 19 LYS C . 34216 1 105 . 1 1 9 9 LYS CA C 13 58.907 . . . . . . . A 19 LYS CA . 34216 1 106 . 1 1 9 9 LYS CB C 13 31.814 . . . . . . . A 19 LYS CB . 34216 1 107 . 1 1 9 9 LYS CG C 13 24.864 . . . . . . . A 19 LYS CG . 34216 1 108 . 1 1 9 9 LYS CD C 13 28.726 . . . . . . . A 19 LYS CD . 34216 1 109 . 1 1 9 9 LYS CE C 13 42.046 . . . . . . . A 19 LYS CE . 34216 1 110 . 1 1 9 9 LYS N N 15 120.294 . . . . . . . A 19 LYS N . 34216 1 111 . 1 1 10 10 VAL H H 1 8.420 . . . . . . . A 20 VAL H . 34216 1 112 . 1 1 10 10 VAL HA H 1 3.693 . . . . . . . A 20 VAL HA . 34216 1 113 . 1 1 10 10 VAL HB H 1 2.231 . . . . . . . A 20 VAL HB . 34216 1 114 . 1 1 10 10 VAL HG11 H 1 1.139 . . . . . . . A 20 VAL HG11 . 34216 1 115 . 1 1 10 10 VAL HG12 H 1 1.139 . . . . . . . A 20 VAL HG12 . 34216 1 116 . 1 1 10 10 VAL HG13 H 1 1.139 . . . . . . . A 20 VAL HG13 . 34216 1 117 . 1 1 10 10 VAL HG21 H 1 0.853 . . . . . . . A 20 VAL HG21 . 34216 1 118 . 1 1 10 10 VAL HG22 H 1 0.853 . . . . . . . A 20 VAL HG22 . 34216 1 119 . 1 1 10 10 VAL HG23 H 1 0.853 . . . . . . . A 20 VAL HG23 . 34216 1 120 . 1 1 10 10 VAL C C 13 177.695 . . . . . . . A 20 VAL C . 34216 1 121 . 1 1 10 10 VAL CA C 13 67.743 . . . . . . . A 20 VAL CA . 34216 1 122 . 1 1 10 10 VAL CB C 13 31.230 . . . . . . . A 20 VAL CB . 34216 1 123 . 1 1 10 10 VAL CG1 C 13 23.758 . . . . . . . A 20 VAL CG1 . 34216 1 124 . 1 1 10 10 VAL CG2 C 13 22.057 . . . . . . . A 20 VAL CG2 . 34216 1 125 . 1 1 10 10 VAL N N 15 119.561 . . . . . . . A 20 VAL N . 34216 1 126 . 1 1 11 11 MET H H 1 8.120 . . . . . . . A 21 MET H . 34216 1 127 . 1 1 11 11 MET HA H 1 4.187 . . . . . . . A 21 MET HA . 34216 1 128 . 1 1 11 11 MET HB2 H 1 2.246 . . . . . . . A 21 MET HB2 . 34216 1 129 . 1 1 11 11 MET HB3 H 1 2.114 . . . . . . . A 21 MET HB3 . 34216 1 130 . 1 1 11 11 MET HG2 H 1 2.701 . . . . . . . A 21 MET HG2 . 34216 1 131 . 1 1 11 11 MET HG3 H 1 2.798 . . . . . . . A 21 MET HG3 . 34216 1 132 . 1 1 11 11 MET C C 13 178.904 . . . . . . . A 21 MET C . 34216 1 133 . 1 1 11 11 MET CA C 13 58.469 . . . . . . . A 21 MET CA . 34216 1 134 . 1 1 11 11 MET CB C 13 31.595 . . . . . . . A 21 MET CB . 34216 1 135 . 1 1 11 11 MET CG C 13 32.398 . . . . . . . A 21 MET CG . 34216 1 136 . 1 1 11 11 MET N N 15 118.347 . . . . . . . A 21 MET N . 34216 1 137 . 1 1 12 12 GLN H H 1 7.522 . . . . . . . A 22 GLN H . 34216 1 138 . 1 1 12 12 GLN HA H 1 4.029 . . . . . . . A 22 GLN HA . 34216 1 139 . 1 1 12 12 GLN HB2 H 1 2.032 . . . . . . . A 22 GLN HB2 . 34216 1 140 . 1 1 12 12 GLN HB3 H 1 1.908 . . . . . . . A 22 GLN HB3 . 34216 1 141 . 1 1 12 12 GLN HG2 H 1 2.348 . . . . . . . A 22 GLN HG2 . 34216 1 142 . 1 1 12 12 GLN HG3 H 1 2.229 . . . . . . . A 22 GLN HG3 . 34216 1 143 . 1 1 12 12 GLN HE21 H 1 7.313 . . . . . . . A 22 GLN HE21 . 34216 1 144 . 1 1 12 12 GLN HE22 H 1 6.786 . . . . . . . A 22 GLN HE22 . 34216 1 145 . 1 1 12 12 GLN C C 13 179.413 . . . . . . . A 22 GLN C . 34216 1 146 . 1 1 12 12 GLN CA C 13 59.471 . . . . . . . A 22 GLN CA . 34216 1 147 . 1 1 12 12 GLN CB C 13 27.798 . . . . . . . A 22 GLN CB . 34216 1 148 . 1 1 12 12 GLN CG C 13 33.593 . . . . . . . A 22 GLN CG . 34216 1 149 . 1 1 12 12 GLN N N 15 119.414 . . . . . . . A 22 GLN N . 34216 1 150 . 1 1 12 12 GLN NE2 N 15 111.860 . . . . . . . A 22 GLN NE2 . 34216 1 151 . 1 1 13 13 TYR H H 1 7.924 . . . . . . . A 23 TYR H . 34216 1 152 . 1 1 13 13 TYR HA H 1 4.251 . . . . . . . A 23 TYR HA . 34216 1 153 . 1 1 13 13 TYR HB2 H 1 3.019 . . . . . . . A 23 TYR HB2 . 34216 1 154 . 1 1 13 13 TYR HB3 H 1 2.863 . . . . . . . A 23 TYR HB3 . 34216 1 155 . 1 1 13 13 TYR HD1 H 1 6.918 . . . . . . . A 23 TYR HD1 . 34216 1 156 . 1 1 13 13 TYR HD2 H 1 6.918 . . . . . . . A 23 TYR HD2 . 34216 1 157 . 1 1 13 13 TYR HE1 H 1 6.159 . . . . . . . A 23 TYR HE1 . 34216 1 158 . 1 1 13 13 TYR HE2 H 1 6.159 . . . . . . . A 23 TYR HE2 . 34216 1 159 . 1 1 13 13 TYR C C 13 177.376 . . . . . . . A 23 TYR C . 34216 1 160 . 1 1 13 13 TYR CA C 13 62.047 . . . . . . . A 23 TYR CA . 34216 1 161 . 1 1 13 13 TYR CB C 13 37.802 . . . . . . . A 23 TYR CB . 34216 1 162 . 1 1 13 13 TYR CD1 C 13 133.601 . . . . . . . A 23 TYR CD1 . 34216 1 163 . 1 1 13 13 TYR CD2 C 13 133.601 . . . . . . . A 23 TYR CD2 . 34216 1 164 . 1 1 13 13 TYR CE1 C 13 149.609 . . . . . . . A 23 TYR CE1 . 34216 1 165 . 1 1 13 13 TYR CE2 C 13 149.609 . . . . . . . A 23 TYR CE2 . 34216 1 166 . 1 1 13 13 TYR N N 15 120.454 . . . . . . . A 23 TYR N . 34216 1 167 . 1 1 14 14 ARG H H 1 8.819 . . . . . . . A 24 ARG H . 34216 1 168 . 1 1 14 14 ARG HA H 1 4.082 . . . . . . . A 24 ARG HA . 34216 1 169 . 1 1 14 14 ARG HB2 H 1 1.979 . . . . . . . A 24 ARG HB2 . 34216 1 170 . 1 1 14 14 ARG HB3 H 1 1.566 . . . . . . . A 24 ARG HB3 . 34216 1 171 . 1 1 14 14 ARG HG2 H 1 1.473 . . . . . . . A 24 ARG HG2 . 34216 1 172 . 1 1 14 14 ARG HG3 H 1 1.473 . . . . . . . A 24 ARG HG3 . 34216 1 173 . 1 1 14 14 ARG HD2 H 1 3.031 . . . . . . . A 24 ARG HD2 . 34216 1 174 . 1 1 14 14 ARG HD3 H 1 3.144 . . . . . . . A 24 ARG HD3 . 34216 1 175 . 1 1 14 14 ARG C C 13 179.380 . . . . . . . A 24 ARG C . 34216 1 176 . 1 1 14 14 ARG CA C 13 59.972 . . . . . . . A 24 ARG CA . 34216 1 177 . 1 1 14 14 ARG CB C 13 30.499 . . . . . . . A 24 ARG CB . 34216 1 178 . 1 1 14 14 ARG CG C 13 27.702 . . . . . . . A 24 ARG CG . 34216 1 179 . 1 1 14 14 ARG CD C 13 44.464 . . . . . . . A 24 ARG CD . 34216 1 180 . 1 1 14 14 ARG N N 15 118.980 . . . . . . . A 24 ARG N . 34216 1 181 . 1 1 15 15 ARG H H 1 7.957 . . . . . . . A 25 ARG H . 34216 1 182 . 1 1 15 15 ARG HA H 1 4.092 . . . . . . . A 25 ARG HA . 34216 1 183 . 1 1 15 15 ARG HB2 H 1 1.932 . . . . . . . A 25 ARG HB2 . 34216 1 184 . 1 1 15 15 ARG HB3 H 1 1.932 . . . . . . . A 25 ARG HB3 . 34216 1 185 . 1 1 15 15 ARG HG2 H 1 1.848 . . . . . . . A 25 ARG HG2 . 34216 1 186 . 1 1 15 15 ARG HG3 H 1 1.651 . . . . . . . A 25 ARG HG3 . 34216 1 187 . 1 1 15 15 ARG HD2 H 1 3.224 . . . . . . . A 25 ARG HD2 . 34216 1 188 . 1 1 15 15 ARG HD3 H 1 3.224 . . . . . . . A 25 ARG HD3 . 34216 1 189 . 1 1 15 15 ARG C C 13 178.904 . . . . . . . A 25 ARG C . 34216 1 190 . 1 1 15 15 ARG CA C 13 59.929 . . . . . . . A 25 ARG CA . 34216 1 191 . 1 1 15 15 ARG CB C 13 30.281 . . . . . . . A 25 ARG CB . 34216 1 192 . 1 1 15 15 ARG CG C 13 27.702 . . . . . . . A 25 ARG CG . 34216 1 193 . 1 1 15 15 ARG CD C 13 43.463 . . . . . . . A 25 ARG CD . 34216 1 194 . 1 1 15 15 ARG N N 15 119.517 . . . . . . . A 25 ARG N . 34216 1 195 . 1 1 16 16 ALA H H 1 7.754 . . . . . . . A 26 ALA H . 34216 1 196 . 1 1 16 16 ALA HA H 1 4.198 . . . . . . . A 26 ALA HA . 34216 1 197 . 1 1 16 16 ALA HB1 H 1 1.427 . . . . . . . A 26 ALA HB1 . 34216 1 198 . 1 1 16 16 ALA HB2 H 1 1.427 . . . . . . . A 26 ALA HB2 . 34216 1 199 . 1 1 16 16 ALA HB3 H 1 1.427 . . . . . . . A 26 ALA HB3 . 34216 1 200 . 1 1 16 16 ALA C C 13 179.541 . . . . . . . A 26 ALA C . 34216 1 201 . 1 1 16 16 ALA CA C 13 54.671 . . . . . . . A 26 ALA CA . 34216 1 202 . 1 1 16 16 ALA CB C 13 18.889 . . . . . . . A 26 ALA CB . 34216 1 203 . 1 1 16 16 ALA N N 15 121.268 . . . . . . . A 26 ALA N . 34216 1 204 . 1 1 17 17 LEU H H 1 8.411 . . . . . . . A 27 LEU H . 34216 1 205 . 1 1 17 17 LEU HA H 1 4.346 . . . . . . . A 27 LEU HA . 34216 1 206 . 1 1 17 17 LEU HB2 H 1 1.793 . . . . . . . A 27 LEU HB2 . 34216 1 207 . 1 1 17 17 LEU HB3 H 1 1.369 . . . . . . . A 27 LEU HB3 . 34216 1 208 . 1 1 17 17 LEU HG H 1 1.497 . . . . . . . A 27 LEU HG . 34216 1 209 . 1 1 17 17 LEU HD11 H 1 -0.479 . . . . . . . A 27 LEU HD11 . 34216 1 210 . 1 1 17 17 LEU HD12 H 1 -0.479 . . . . . . . A 27 LEU HD12 . 34216 1 211 . 1 1 17 17 LEU HD13 H 1 -0.479 . . . . . . . A 27 LEU HD13 . 34216 1 212 . 1 1 17 17 LEU HD21 H 1 0.392 . . . . . . . A 27 LEU HD21 . 34216 1 213 . 1 1 17 17 LEU HD22 H 1 0.392 . . . . . . . A 27 LEU HD22 . 34216 1 214 . 1 1 17 17 LEU HD23 H 1 0.392 . . . . . . . A 27 LEU HD23 . 34216 1 215 . 1 1 17 17 LEU C C 13 177.928 . . . . . . . A 27 LEU C . 34216 1 216 . 1 1 17 17 LEU CA C 13 54.817 . . . . . . . A 27 LEU CA . 34216 1 217 . 1 1 17 17 LEU CB C 13 43.279 . . . . . . . A 27 LEU CB . 34216 1 218 . 1 1 17 17 LEU CG C 13 26.905 . . . . . . . A 27 LEU CG . 34216 1 219 . 1 1 17 17 LEU CD1 C 13 21.717 . . . . . . . A 27 LEU CD1 . 34216 1 220 . 1 1 17 17 LEU CD2 C 13 26.933 . . . . . . . A 27 LEU CD2 . 34216 1 221 . 1 1 17 17 LEU N N 15 115.432 . . . . . . . A 27 LEU N . 34216 1 222 . 1 1 18 18 THR H H 1 7.342 . . . . . . . A 28 THR H . 34216 1 223 . 1 1 18 18 THR HA H 1 5.872 . . . . . . . A 28 THR HA . 34216 1 224 . 1 1 18 18 THR HB H 1 4.400 . . . . . . . A 28 THR HB . 34216 1 225 . 1 1 18 18 THR HG21 H 1 1.297 . . . . . . . A 28 THR HG21 . 34216 1 226 . 1 1 18 18 THR HG22 H 1 1.297 . . . . . . . A 28 THR HG22 . 34216 1 227 . 1 1 18 18 THR HG23 H 1 1.297 . . . . . . . A 28 THR HG23 . 34216 1 228 . 1 1 18 18 THR C C 13 175.076 . . . . . . . A 28 THR C . 34216 1 229 . 1 1 18 18 THR CA C 13 63.215 . . . . . . . A 28 THR CA . 34216 1 230 . 1 1 18 18 THR CB C 13 68.985 . . . . . . . A 28 THR CB . 34216 1 231 . 1 1 18 18 THR CG2 C 13 20.701 . . . . . . . A 28 THR CG2 . 34216 1 232 . 1 1 18 18 THR N N 15 116.530 . . . . . . . A 28 THR N . 34216 1 233 . 1 1 19 19 LYS H H 1 8.774 . . . . . . . A 29 LYS H . 34216 1 234 . 1 1 19 19 LYS HA H 1 4.887 . . . . . . . A 29 LYS HA . 34216 1 235 . 1 1 19 19 LYS HB2 H 1 1.878 . . . . . . . A 29 LYS HB2 . 34216 1 236 . 1 1 19 19 LYS HB3 H 1 1.651 . . . . . . . A 29 LYS HB3 . 34216 1 237 . 1 1 19 19 LYS HG2 H 1 1.661 . . . . . . . A 29 LYS HG2 . 34216 1 238 . 1 1 19 19 LYS HG3 H 1 1.601 . . . . . . . A 29 LYS HG3 . 34216 1 239 . 1 1 19 19 LYS HD2 H 1 2.164 . . . . . . . A 29 LYS HD2 . 34216 1 240 . 1 1 19 19 LYS HD3 H 1 2.164 . . . . . . . A 29 LYS HD3 . 34216 1 241 . 1 1 19 19 LYS HE2 H 1 3.344 . . . . . . . A 29 LYS HE2 . 34216 1 242 . 1 1 19 19 LYS HE3 H 1 3.269 . . . . . . . A 29 LYS HE3 . 34216 1 243 . 1 1 19 19 LYS C C 13 173.977 . . . . . . . A 29 LYS C . 34216 1 244 . 1 1 19 19 LYS CA C 13 54.219 . . . . . . . A 29 LYS CA . 34216 1 245 . 1 1 19 19 LYS CB C 13 38.096 . . . . . . . A 29 LYS CB . 34216 1 246 . 1 1 19 19 LYS CG C 13 25.704 . . . . . . . A 29 LYS CG . 34216 1 247 . 1 1 19 19 LYS CD C 13 28.455 . . . . . . . A 29 LYS CD . 34216 1 248 . 1 1 19 19 LYS CE C 13 42.387 . . . . . . . A 29 LYS CE . 34216 1 249 . 1 1 19 19 LYS N N 15 129.980 . . . . . . . A 29 LYS N . 34216 1 250 . 1 1 20 20 VAL H H 1 8.555 . . . . . . . A 30 VAL H . 34216 1 251 . 1 1 20 20 VAL HA H 1 4.903 . . . . . . . A 30 VAL HA . 34216 1 252 . 1 1 20 20 VAL HB H 1 1.930 . . . . . . . A 30 VAL HB . 34216 1 253 . 1 1 20 20 VAL HG11 H 1 0.985 . . . . . . . A 30 VAL HG11 . 34216 1 254 . 1 1 20 20 VAL HG12 H 1 0.985 . . . . . . . A 30 VAL HG12 . 34216 1 255 . 1 1 20 20 VAL HG13 H 1 0.985 . . . . . . . A 30 VAL HG13 . 34216 1 256 . 1 1 20 20 VAL HG21 H 1 0.814 . . . . . . . A 30 VAL HG21 . 34216 1 257 . 1 1 20 20 VAL HG22 H 1 0.814 . . . . . . . A 30 VAL HG22 . 34216 1 258 . 1 1 20 20 VAL HG23 H 1 0.814 . . . . . . . A 30 VAL HG23 . 34216 1 259 . 1 1 20 20 VAL C C 13 176.011 . . . . . . . A 30 VAL C . 34216 1 260 . 1 1 20 20 VAL CA C 13 63.019 . . . . . . . A 30 VAL CA . 34216 1 261 . 1 1 20 20 VAL CB C 13 31.632 . . . . . . . A 30 VAL CB . 34216 1 262 . 1 1 20 20 VAL CG1 C 13 21.702 . . . . . . . A 30 VAL CG1 . 34216 1 263 . 1 1 20 20 VAL CG2 C 13 21.383 . . . . . . . A 30 VAL CG2 . 34216 1 264 . 1 1 20 20 VAL N N 15 123.539 . . . . . . . A 30 VAL N . 34216 1 265 . 1 1 21 21 VAL H H 1 9.076 . . . . . . . A 31 VAL H . 34216 1 266 . 1 1 21 21 VAL HA H 1 4.512 . . . . . . . A 31 VAL HA . 34216 1 267 . 1 1 21 21 VAL HB H 1 1.420 . . . . . . . A 31 VAL HB . 34216 1 268 . 1 1 21 21 VAL HG11 H 1 0.217 . . . . . . . A 31 VAL HG11 . 34216 1 269 . 1 1 21 21 VAL HG12 H 1 0.217 . . . . . . . A 31 VAL HG12 . 34216 1 270 . 1 1 21 21 VAL HG13 H 1 0.217 . . . . . . . A 31 VAL HG13 . 34216 1 271 . 1 1 21 21 VAL HG21 H 1 0.005 . . . . . . . A 31 VAL HG21 . 34216 1 272 . 1 1 21 21 VAL HG22 H 1 0.005 . . . . . . . A 31 VAL HG22 . 34216 1 273 . 1 1 21 21 VAL HG23 H 1 0.005 . . . . . . . A 31 VAL HG23 . 34216 1 274 . 1 1 21 21 VAL C C 13 173.609 . . . . . . . A 31 VAL C . 34216 1 275 . 1 1 21 21 VAL CA C 13 58.887 . . . . . . . A 31 VAL CA . 34216 1 276 . 1 1 21 21 VAL CB C 13 36.164 . . . . . . . A 31 VAL CB . 34216 1 277 . 1 1 21 21 VAL CG1 C 13 19.200 . . . . . . . A 31 VAL CG1 . 34216 1 278 . 1 1 21 21 VAL CG2 C 13 22.397 . . . . . . . A 31 VAL CG2 . 34216 1 279 . 1 1 21 21 VAL N N 15 121.748 . . . . . . . A 31 VAL N . 34216 1 280 . 1 1 22 22 LYS H H 1 7.605 . . . . . . . A 32 LYS H . 34216 1 281 . 1 1 22 22 LYS HA H 1 4.716 . . . . . . . A 32 LYS HA . 34216 1 282 . 1 1 22 22 LYS HB2 H 1 1.664 . . . . . . . A 32 LYS HB2 . 34216 1 283 . 1 1 22 22 LYS HB3 H 1 1.540 . . . . . . . A 32 LYS HB3 . 34216 1 284 . 1 1 22 22 LYS HG2 H 1 1.220 . . . . . . . A 32 LYS HG2 . 34216 1 285 . 1 1 22 22 LYS HG3 H 1 1.220 . . . . . . . A 32 LYS HG3 . 34216 1 286 . 1 1 22 22 LYS HD2 H 1 1.464 . . . . . . . A 32 LYS HD2 . 34216 1 287 . 1 1 22 22 LYS HD3 H 1 1.464 . . . . . . . A 32 LYS HD3 . 34216 1 288 . 1 1 22 22 LYS HE2 H 1 2.787 . . . . . . . A 32 LYS HE2 . 34216 1 289 . 1 1 22 22 LYS HE3 H 1 2.787 . . . . . . . A 32 LYS HE3 . 34216 1 290 . 1 1 22 22 LYS C C 13 174.681 . . . . . . . A 32 LYS C . 34216 1 291 . 1 1 22 22 LYS CA C 13 55.767 . . . . . . . A 32 LYS CA . 34216 1 292 . 1 1 22 22 LYS CB C 13 33.056 . . . . . . . A 32 LYS CB . 34216 1 293 . 1 1 22 22 LYS CG C 13 24.954 . . . . . . . A 32 LYS CG . 34216 1 294 . 1 1 22 22 LYS CD C 13 29.206 . . . . . . . A 32 LYS CD . 34216 1 295 . 1 1 22 22 LYS CE C 13 41.875 . . . . . . . A 32 LYS CE . 34216 1 296 . 1 1 22 22 LYS N N 15 119.249 . . . . . . . A 32 LYS N . 34216 1 297 . 1 1 23 23 LEU H H 1 8.898 . . . . . . . A 33 LEU H . 34216 1 298 . 1 1 23 23 LEU HA H 1 4.765 . . . . . . . A 33 LEU HA . 34216 1 299 . 1 1 23 23 LEU HB2 H 1 1.439 . . . . . . . A 33 LEU HB2 . 34216 1 300 . 1 1 23 23 LEU HB3 H 1 0.551 . . . . . . . A 33 LEU HB3 . 34216 1 301 . 1 1 23 23 LEU HG H 1 0.799 . . . . . . . A 33 LEU HG . 34216 1 302 . 1 1 23 23 LEU HD11 H 1 -0.526 . . . . . . . A 33 LEU HD11 . 34216 1 303 . 1 1 23 23 LEU HD12 H 1 -0.526 . . . . . . . A 33 LEU HD12 . 34216 1 304 . 1 1 23 23 LEU HD13 H 1 -0.526 . . . . . . . A 33 LEU HD13 . 34216 1 305 . 1 1 23 23 LEU HD21 H 1 -0.338 . . . . . . . A 33 LEU HD21 . 34216 1 306 . 1 1 23 23 LEU HD22 H 1 -0.338 . . . . . . . A 33 LEU HD22 . 34216 1 307 . 1 1 23 23 LEU HD23 H 1 -0.338 . . . . . . . A 33 LEU HD23 . 34216 1 308 . 1 1 23 23 LEU C C 13 173.416 . . . . . . . A 33 LEU C . 34216 1 309 . 1 1 23 23 LEU CA C 13 53.402 . . . . . . . A 33 LEU CA . 34216 1 310 . 1 1 23 23 LEU CB C 13 45.626 . . . . . . . A 33 LEU CB . 34216 1 311 . 1 1 23 23 LEU CG C 13 27.455 . . . . . . . A 33 LEU CG . 34216 1 312 . 1 1 23 23 LEU CD1 C 13 24.779 . . . . . . . A 33 LEU CD1 . 34216 1 313 . 1 1 23 23 LEU CD2 C 13 21.887 . . . . . . . A 33 LEU CD2 . 34216 1 314 . 1 1 23 23 LEU N N 15 129.385 . . . . . . . A 33 LEU N . 34216 1 315 . 1 1 24 24 LYS H H 1 8.705 . . . . . . . A 34 LYS H . 34216 1 316 . 1 1 24 24 LYS HA H 1 5.173 . . . . . . . A 34 LYS HA . 34216 1 317 . 1 1 24 24 LYS HB2 H 1 1.612 . . . . . . . A 34 LYS HB2 . 34216 1 318 . 1 1 24 24 LYS HB3 H 1 1.612 . . . . . . . A 34 LYS HB3 . 34216 1 319 . 1 1 24 24 LYS HG2 H 1 1.323 . . . . . . . A 34 LYS HG2 . 34216 1 320 . 1 1 24 24 LYS HG3 H 1 1.181 . . . . . . . A 34 LYS HG3 . 34216 1 321 . 1 1 24 24 LYS HD2 H 1 1.558 . . . . . . . A 34 LYS HD2 . 34216 1 322 . 1 1 24 24 LYS HD3 H 1 1.558 . . . . . . . A 34 LYS HD3 . 34216 1 323 . 1 1 24 24 LYS HE2 H 1 2.787 . . . . . . . A 34 LYS HE2 . 34216 1 324 . 1 1 24 24 LYS HE3 H 1 2.787 . . . . . . . A 34 LYS HE3 . 34216 1 325 . 1 1 24 24 LYS C C 13 175.507 . . . . . . . A 34 LYS C . 34216 1 326 . 1 1 24 24 LYS CA C 13 54.956 . . . . . . . A 34 LYS CA . 34216 1 327 . 1 1 24 24 LYS CB C 13 36.030 . . . . . . . A 34 LYS CB . 34216 1 328 . 1 1 24 24 LYS CG C 13 25.034 . . . . . . . A 34 LYS CG . 34216 1 329 . 1 1 24 24 LYS CD C 13 29.457 . . . . . . . A 34 LYS CD . 34216 1 330 . 1 1 24 24 LYS CE C 13 41.962 . . . . . . . A 34 LYS CE . 34216 1 331 . 1 1 24 24 LYS N N 15 126.377 . . . . . . . A 34 LYS N . 34216 1 332 . 1 1 25 25 THR H H 1 8.828 . . . . . . . A 35 THR H . 34216 1 333 . 1 1 25 25 THR HA H 1 4.498 . . . . . . . A 35 THR HA . 34216 1 334 . 1 1 25 25 THR HB H 1 4.165 . . . . . . . A 35 THR HB . 34216 1 335 . 1 1 25 25 THR HG21 H 1 0.776 . . . . . . . A 35 THR HG21 . 34216 1 336 . 1 1 25 25 THR HG22 H 1 0.776 . . . . . . . A 35 THR HG22 . 34216 1 337 . 1 1 25 25 THR HG23 H 1 0.776 . . . . . . . A 35 THR HG23 . 34216 1 338 . 1 1 25 25 THR C C 13 173.609 . . . . . . . A 35 THR C . 34216 1 339 . 1 1 25 25 THR CA C 13 59.471 . . . . . . . A 35 THR CA . 34216 1 340 . 1 1 25 25 THR CB C 13 70.727 . . . . . . . A 35 THR CB . 34216 1 341 . 1 1 25 25 THR CG2 C 13 20.951 . . . . . . . A 35 THR CG2 . 34216 1 342 . 1 1 25 25 THR N N 15 119.846 . . . . . . . A 35 THR N . 34216 1 343 . 1 1 26 26 HIS HA H 1 5.293 . . . . . . . A 36 HIS HA . 34216 1 344 . 1 1 26 26 HIS C C 13 175.615 . . . . . . . A 36 HIS C . 34216 1 345 . 1 1 26 26 HIS CA C 13 58.177 . . . . . . . A 36 HIS CA . 34216 1 346 . 1 1 26 26 HIS CB C 13 29.696 . . . . . . . A 36 HIS CB . 34216 1 347 . 1 1 27 27 LEU H H 1 7.922 . . . . . . . A 37 LEU H . 34216 1 348 . 1 1 27 27 LEU HA H 1 4.212 . . . . . . . A 37 LEU HA . 34216 1 349 . 1 1 27 27 LEU HB2 H 1 1.532 . . . . . . . A 37 LEU HB2 . 34216 1 350 . 1 1 27 27 LEU HB3 H 1 1.532 . . . . . . . A 37 LEU HB3 . 34216 1 351 . 1 1 27 27 LEU HG H 1 0.903 . . . . . . . A 37 LEU HG . 34216 1 352 . 1 1 27 27 LEU HD11 H 1 0.874 . . . . . . . A 37 LEU HD11 . 34216 1 353 . 1 1 27 27 LEU HD12 H 1 0.874 . . . . . . . A 37 LEU HD12 . 34216 1 354 . 1 1 27 27 LEU HD13 H 1 0.874 . . . . . . . A 37 LEU HD13 . 34216 1 355 . 1 1 27 27 LEU HD21 H 1 0.757 . . . . . . . A 37 LEU HD21 . 34216 1 356 . 1 1 27 27 LEU HD22 H 1 0.757 . . . . . . . A 37 LEU HD22 . 34216 1 357 . 1 1 27 27 LEU HD23 H 1 0.757 . . . . . . . A 37 LEU HD23 . 34216 1 358 . 1 1 27 27 LEU C C 13 176.506 . . . . . . . A 37 LEU C . 34216 1 359 . 1 1 27 27 LEU CA C 13 55.402 . . . . . . . A 37 LEU CA . 34216 1 360 . 1 1 27 27 LEU CB C 13 42.963 . . . . . . . A 37 LEU CB . 34216 1 361 . 1 1 27 27 LEU CG C 13 26.480 . . . . . . . A 37 LEU CG . 34216 1 362 . 1 1 27 27 LEU CD1 C 13 25.204 . . . . . . . A 37 LEU CD1 . 34216 1 363 . 1 1 27 27 LEU CD2 C 13 22.652 . . . . . . . A 37 LEU CD2 . 34216 1 364 . 1 1 27 27 LEU N N 15 118.088 . . . . . . . A 37 LEU N . 34216 1 365 . 1 1 28 28 PHE H H 1 7.399 . . . . . . . A 38 PHE H . 34216 1 366 . 1 1 28 28 PHE HA H 1 4.811 . . . . . . . A 38 PHE HA . 34216 1 367 . 1 1 28 28 PHE HB2 H 1 3.020 . . . . . . . A 38 PHE HB2 . 34216 1 368 . 1 1 28 28 PHE HB3 H 1 3.020 . . . . . . . A 38 PHE HB3 . 34216 1 369 . 1 1 28 28 PHE HD1 H 1 7.043 . . . . . . . A 38 PHE HD1 . 34216 1 370 . 1 1 28 28 PHE HD2 H 1 7.043 . . . . . . . A 38 PHE HD2 . 34216 1 371 . 1 1 28 28 PHE HE1 H 1 7.166 . . . . . . . A 38 PHE HE1 . 34216 1 372 . 1 1 28 28 PHE HE2 H 1 7.166 . . . . . . . A 38 PHE HE2 . 34216 1 373 . 1 1 28 28 PHE C C 13 173.111 . . . . . . . A 38 PHE C . 34216 1 374 . 1 1 28 28 PHE CA C 13 57.300 . . . . . . . A 38 PHE CA . 34216 1 375 . 1 1 28 28 PHE CB C 13 41.462 . . . . . . . A 38 PHE CB . 34216 1 376 . 1 1 28 28 PHE CD1 C 13 132.851 . . . . . . . A 38 PHE CD1 . 34216 1 377 . 1 1 28 28 PHE CD2 C 13 132.851 . . . . . . . A 38 PHE CD2 . 34216 1 378 . 1 1 28 28 PHE CE1 C 13 131.850 . . . . . . . A 38 PHE CE1 . 34216 1 379 . 1 1 28 28 PHE CE2 C 13 131.850 . . . . . . . A 38 PHE CE2 . 34216 1 380 . 1 1 28 28 PHE N N 15 117.502 . . . . . . . A 38 PHE N . 34216 1 381 . 1 1 29 29 SER H H 1 8.499 . . . . . . . A 39 SER H . 34216 1 382 . 1 1 29 29 SER HA H 1 5.319 . . . . . . . A 39 SER HA . 34216 1 383 . 1 1 29 29 SER HB2 H 1 3.688 . . . . . . . A 39 SER HB2 . 34216 1 384 . 1 1 29 29 SER HB3 H 1 3.592 . . . . . . . A 39 SER HB3 . 34216 1 385 . 1 1 29 29 SER C C 13 173.811 . . . . . . . A 39 SER C . 34216 1 386 . 1 1 29 29 SER CA C 13 56.789 . . . . . . . A 39 SER CA . 34216 1 387 . 1 1 29 29 SER CB C 13 63.800 . . . . . . . A 39 SER CB . 34216 1 388 . 1 1 29 29 SER N N 15 117.502 . . . . . . . A 39 SER N . 34216 1 389 . 1 1 30 30 GLU H H 1 8.628 . . . . . . . A 40 GLU H . 34216 1 390 . 1 1 30 30 GLU HA H 1 4.720 . . . . . . . A 40 GLU HA . 34216 1 391 . 1 1 30 30 GLU HB2 H 1 2.017 . . . . . . . A 40 GLU HB2 . 34216 1 392 . 1 1 30 30 GLU HB3 H 1 1.652 . . . . . . . A 40 GLU HB3 . 34216 1 393 . 1 1 30 30 GLU HG2 H 1 2.012 . . . . . . . A 40 GLU HG2 . 34216 1 394 . 1 1 30 30 GLU HG3 H 1 2.060 . . . . . . . A 40 GLU HG3 . 34216 1 395 . 1 1 30 30 GLU C C 13 174.984 . . . . . . . A 40 GLU C . 34216 1 396 . 1 1 30 30 GLU CA C 13 54.964 . . . . . . . A 40 GLU CA . 34216 1 397 . 1 1 30 30 GLU CB C 13 34.459 . . . . . . . A 40 GLU CB . 34216 1 398 . 1 1 30 30 GLU CG C 13 35.709 . . . . . . . A 40 GLU CG . 34216 1 399 . 1 1 30 30 GLU N N 15 123.443 . . . . . . . A 40 GLU N . 34216 1 400 . 1 1 31 31 THR H H 1 8.910 . . . . . . . A 41 THR H . 34216 1 401 . 1 1 31 31 THR HA H 1 4.808 . . . . . . . A 41 THR HA . 34216 1 402 . 1 1 31 31 THR HB H 1 3.988 . . . . . . . A 41 THR HB . 34216 1 403 . 1 1 31 31 THR HG21 H 1 1.062 . . . . . . . A 41 THR HG21 . 34216 1 404 . 1 1 31 31 THR HG22 H 1 1.062 . . . . . . . A 41 THR HG22 . 34216 1 405 . 1 1 31 31 THR HG23 H 1 1.062 . . . . . . . A 41 THR HG23 . 34216 1 406 . 1 1 31 31 THR C C 13 174.481 . . . . . . . A 41 THR C . 34216 1 407 . 1 1 31 31 THR CA C 13 64.224 . . . . . . . A 41 THR CA . 34216 1 408 . 1 1 31 31 THR CB C 13 68.816 . . . . . . . A 41 THR CB . 34216 1 409 . 1 1 31 31 THR CG2 C 13 21.952 . . . . . . . A 41 THR CG2 . 34216 1 410 . 1 1 31 31 THR N N 15 121.002 . . . . . . . A 41 THR N . 34216 1 411 . 1 1 32 32 VAL H H 1 9.285 . . . . . . . A 42 VAL H . 34216 1 412 . 1 1 32 32 VAL HA H 1 5.046 . . . . . . . A 42 VAL HA . 34216 1 413 . 1 1 32 32 VAL HB H 1 2.197 . . . . . . . A 42 VAL HB . 34216 1 414 . 1 1 32 32 VAL HG11 H 1 0.804 . . . . . . . A 42 VAL HG11 . 34216 1 415 . 1 1 32 32 VAL HG12 H 1 0.804 . . . . . . . A 42 VAL HG12 . 34216 1 416 . 1 1 32 32 VAL HG13 H 1 0.804 . . . . . . . A 42 VAL HG13 . 34216 1 417 . 1 1 32 32 VAL HG21 H 1 0.498 . . . . . . . A 42 VAL HG21 . 34216 1 418 . 1 1 32 32 VAL HG22 H 1 0.498 . . . . . . . A 42 VAL HG22 . 34216 1 419 . 1 1 32 32 VAL HG23 H 1 0.498 . . . . . . . A 42 VAL HG23 . 34216 1 420 . 1 1 32 32 VAL C C 13 173.145 . . . . . . . A 42 VAL C . 34216 1 421 . 1 1 32 32 VAL CA C 13 58.471 . . . . . . . A 42 VAL CA . 34216 1 422 . 1 1 32 32 VAL CB C 13 36.430 . . . . . . . A 42 VAL CB . 34216 1 423 . 1 1 32 32 VAL CG1 C 13 21.972 . . . . . . . A 42 VAL CG1 . 34216 1 424 . 1 1 32 32 VAL CG2 C 13 19.165 . . . . . . . A 42 VAL CG2 . 34216 1 425 . 1 1 32 32 VAL N N 15 120.514 . . . . . . . A 42 VAL N . 34216 1 426 . 1 1 33 33 LYS H H 1 8.522 . . . . . . . A 43 LYS H . 34216 1 427 . 1 1 33 33 LYS HA H 1 5.133 . . . . . . . A 43 LYS HA . 34216 1 428 . 1 1 33 33 LYS HB2 H 1 1.757 . . . . . . . A 43 LYS HB2 . 34216 1 429 . 1 1 33 33 LYS HB3 H 1 1.953 . . . . . . . A 43 LYS HB3 . 34216 1 430 . 1 1 33 33 LYS HG2 H 1 1.345 . . . . . . . A 43 LYS HG2 . 34216 1 431 . 1 1 33 33 LYS HG3 H 1 1.345 . . . . . . . A 43 LYS HG3 . 34216 1 432 . 1 1 33 33 LYS HD2 H 1 1.563 . . . . . . . A 43 LYS HD2 . 34216 1 433 . 1 1 33 33 LYS HD3 H 1 1.563 . . . . . . . A 43 LYS HD3 . 34216 1 434 . 1 1 33 33 LYS HE2 H 1 2.716 . . . . . . . A 43 LYS HE2 . 34216 1 435 . 1 1 33 33 LYS HE3 H 1 2.715 . . . . . . . A 43 LYS HE3 . 34216 1 436 . 1 1 33 33 LYS C C 13 176.167 . . . . . . . A 43 LYS C . 34216 1 437 . 1 1 33 33 LYS CA C 13 55.329 . . . . . . . A 43 LYS CA . 34216 1 438 . 1 1 33 33 LYS CB C 13 34.151 . . . . . . . A 43 LYS CB . 34216 1 439 . 1 1 33 33 LYS CG C 13 24.942 . . . . . . . A 43 LYS CG . 34216 1 440 . 1 1 33 33 LYS CD C 13 29.372 . . . . . . . A 43 LYS CD . 34216 1 441 . 1 1 33 33 LYS CE C 13 41.712 . . . . . . . A 43 LYS CE . 34216 1 442 . 1 1 33 33 LYS N N 15 120.981 . . . . . . . A 43 LYS N . 34216 1 443 . 1 1 34 34 VAL H H 1 9.410 . . . . . . . A 44 VAL H . 34216 1 444 . 1 1 34 34 VAL HA H 1 5.588 . . . . . . . A 44 VAL HA . 34216 1 445 . 1 1 34 34 VAL HB H 1 2.003 . . . . . . . A 44 VAL HB . 34216 1 446 . 1 1 34 34 VAL HG11 H 1 1.356 . . . . . . . A 44 VAL HG11 . 34216 1 447 . 1 1 34 34 VAL HG12 H 1 1.356 . . . . . . . A 44 VAL HG12 . 34216 1 448 . 1 1 34 34 VAL HG13 H 1 1.356 . . . . . . . A 44 VAL HG13 . 34216 1 449 . 1 1 34 34 VAL HG21 H 1 1.101 . . . . . . . A 44 VAL HG21 . 34216 1 450 . 1 1 34 34 VAL HG22 H 1 1.101 . . . . . . . A 44 VAL HG22 . 34216 1 451 . 1 1 34 34 VAL HG23 H 1 1.101 . . . . . . . A 44 VAL HG23 . 34216 1 452 . 1 1 34 34 VAL C C 13 172.525 . . . . . . . A 44 VAL C . 34216 1 453 . 1 1 34 34 VAL CA C 13 59.491 . . . . . . . A 44 VAL CA . 34216 1 454 . 1 1 34 34 VAL CB C 13 35.164 . . . . . . . A 44 VAL CB . 34216 1 455 . 1 1 34 34 VAL CG1 C 13 22.992 . . . . . . . A 44 VAL CG1 . 34216 1 456 . 1 1 34 34 VAL CG2 C 13 20.701 . . . . . . . A 44 VAL CG2 . 34216 1 457 . 1 1 34 34 VAL N N 15 127.314 . . . . . . . A 44 VAL N . 34216 1 458 . 1 1 35 35 THR H H 1 8.978 . . . . . . . A 45 THR H . 34216 1 459 . 1 1 35 35 THR HA H 1 4.528 . . . . . . . A 45 THR HA . 34216 1 460 . 1 1 35 35 THR HB H 1 4.616 . . . . . . . A 45 THR HB . 34216 1 461 . 1 1 35 35 THR HG21 H 1 1.185 . . . . . . . A 45 THR HG21 . 34216 1 462 . 1 1 35 35 THR HG22 H 1 1.185 . . . . . . . A 45 THR HG22 . 34216 1 463 . 1 1 35 35 THR HG23 H 1 1.185 . . . . . . . A 45 THR HG23 . 34216 1 464 . 1 1 35 35 THR C C 13 173.609 . . . . . . . A 45 THR C . 34216 1 465 . 1 1 35 35 THR CA C 13 60.972 . . . . . . . A 45 THR CA . 34216 1 466 . 1 1 35 35 THR CB C 13 67.684 . . . . . . . A 45 THR CB . 34216 1 467 . 1 1 35 35 THR CG2 C 13 17.700 . . . . . . . A 45 THR CG2 . 34216 1 468 . 1 1 35 35 THR N N 15 117.105 . . . . . . . A 45 THR N . 34216 1 469 . 1 1 36 36 CYS H H 1 8.635 . . . . . . . A 46 CYS H . 34216 1 470 . 1 1 36 36 CYS HA H 1 5.863 . . . . . . . A 46 CYS HA . 34216 1 471 . 1 1 36 36 CYS HB2 H 1 3.139 . . . . . . . A 46 CYS HB2 . 34216 1 472 . 1 1 36 36 CYS HB3 H 1 2.171 . . . . . . . A 46 CYS HB3 . 34216 1 473 . 1 1 36 36 CYS C C 13 172.990 . . . . . . . A 46 CYS C . 34216 1 474 . 1 1 36 36 CYS CA C 13 54.719 . . . . . . . A 46 CYS CA . 34216 1 475 . 1 1 36 36 CYS CB C 13 31.707 . . . . . . . A 46 CYS CB . 34216 1 476 . 1 1 36 36 CYS N N 15 114.386 . . . . . . . A 46 CYS N . 34216 1 477 . 1 1 37 37 SER H H 1 8.960 . . . . . . . A 47 SER H . 34216 1 478 . 1 1 37 37 SER HA H 1 4.209 . . . . . . . A 47 SER HA . 34216 1 479 . 1 1 37 37 SER HB2 H 1 3.813 . . . . . . . A 47 SER HB2 . 34216 1 480 . 1 1 37 37 SER HB3 H 1 3.813 . . . . . . . A 47 SER HB3 . 34216 1 481 . 1 1 37 37 SER C C 13 176.103 . . . . . . . A 47 SER C . 34216 1 482 . 1 1 37 37 SER CA C 13 58.554 . . . . . . . A 47 SER CA . 34216 1 483 . 1 1 37 37 SER CB C 13 64.418 . . . . . . . A 47 SER CB . 34216 1 484 . 1 1 37 37 SER N N 15 115.557 . . . . . . . A 47 SER N . 34216 1 485 . 1 1 38 38 LYS H H 1 8.902 . . . . . . . A 48 LYS H . 34216 1 486 . 1 1 38 38 LYS HA H 1 3.797 . . . . . . . A 48 LYS HA . 34216 1 487 . 1 1 38 38 LYS HB2 H 1 1.846 . . . . . . . A 48 LYS HB2 . 34216 1 488 . 1 1 38 38 LYS HB3 H 1 1.846 . . . . . . . A 48 LYS HB3 . 34216 1 489 . 1 1 38 38 LYS HG2 H 1 1.349 . . . . . . . A 48 LYS HG2 . 34216 1 490 . 1 1 38 38 LYS HG3 H 1 1.486 . . . . . . . A 48 LYS HG3 . 34216 1 491 . 1 1 38 38 LYS HD2 H 1 1.683 . . . . . . . A 48 LYS HD2 . 34216 1 492 . 1 1 38 38 LYS HD3 H 1 1.683 . . . . . . . A 48 LYS HD3 . 34216 1 493 . 1 1 38 38 LYS HE2 H 1 2.964 . . . . . . . A 48 LYS HE2 . 34216 1 494 . 1 1 38 38 LYS HE3 H 1 2.964 . . . . . . . A 48 LYS HE3 . 34216 1 495 . 1 1 38 38 LYS C C 13 175.178 . . . . . . . A 48 LYS C . 34216 1 496 . 1 1 38 38 LYS CA C 13 59.820 . . . . . . . A 48 LYS CA . 34216 1 497 . 1 1 38 38 LYS CB C 13 32.165 . . . . . . . A 48 LYS CB . 34216 1 498 . 1 1 38 38 LYS CG C 13 25.719 . . . . . . . A 48 LYS CG . 34216 1 499 . 1 1 38 38 LYS CD C 13 29.449 . . . . . . . A 48 LYS CD . 34216 1 500 . 1 1 38 38 LYS CE C 13 42.213 . . . . . . . A 48 LYS CE . 34216 1 501 . 1 1 38 38 LYS N N 15 119.512 . . . . . . . A 48 LYS N . 34216 1 502 . 1 1 39 39 ASP H H 1 7.489 . . . . . . . A 49 ASP H . 34216 1 503 . 1 1 39 39 ASP HA H 1 4.607 . . . . . . . A 49 ASP HA . 34216 1 504 . 1 1 39 39 ASP HB2 H 1 3.114 . . . . . . . A 49 ASP HB2 . 34216 1 505 . 1 1 39 39 ASP HB3 H 1 2.578 . . . . . . . A 49 ASP HB3 . 34216 1 506 . 1 1 39 39 ASP C C 13 176.761 . . . . . . . A 49 ASP C . 34216 1 507 . 1 1 39 39 ASP CA C 13 52.468 . . . . . . . A 49 ASP CA . 34216 1 508 . 1 1 39 39 ASP CB C 13 41.235 . . . . . . . A 49 ASP CB . 34216 1 509 . 1 1 39 39 ASP N N 15 112.227 . . . . . . . A 49 ASP N . 34216 1 510 . 1 1 40 40 GLY H H 1 7.941 . . . . . . . A 50 GLY H . 34216 1 511 . 1 1 40 40 GLY HA2 H 1 4.276 . . . . . . . A 50 GLY HA2 . 34216 1 512 . 1 1 40 40 GLY HA3 H 1 3.448 . . . . . . . A 50 GLY HA3 . 34216 1 513 . 1 1 40 40 GLY C C 13 171.435 . . . . . . . A 50 GLY C . 34216 1 514 . 1 1 40 40 GLY CA C 13 45.964 . . . . . . . A 50 GLY CA . 34216 1 515 . 1 1 40 40 GLY N N 15 109.802 . . . . . . . A 50 GLY N . 34216 1 516 . 1 1 41 41 GLU H H 1 7.322 . . . . . . . A 51 GLU H . 34216 1 517 . 1 1 41 41 GLU HA H 1 4.058 . . . . . . . A 51 GLU HA . 34216 1 518 . 1 1 41 41 GLU HB2 H 1 2.084 . . . . . . . A 51 GLU HB2 . 34216 1 519 . 1 1 41 41 GLU HB3 H 1 1.852 . . . . . . . A 51 GLU HB3 . 34216 1 520 . 1 1 41 41 GLU HG2 H 1 2.182 . . . . . . . A 51 GLU HG2 . 34216 1 521 . 1 1 41 41 GLU HG3 H 1 2.182 . . . . . . . A 51 GLU HG3 . 34216 1 522 . 1 1 41 41 GLU C C 13 178.268 . . . . . . . A 51 GLU C . 34216 1 523 . 1 1 41 41 GLU CA C 13 57.971 . . . . . . . A 51 GLU CA . 34216 1 524 . 1 1 41 41 GLU CB C 13 30.206 . . . . . . . A 51 GLU CB . 34216 1 525 . 1 1 41 41 GLU CG C 13 35.959 . . . . . . . A 51 GLU CG . 34216 1 526 . 1 1 41 41 GLU N N 15 111.253 . . . . . . . A 51 GLU N . 34216 1 527 . 1 1 42 42 GLU H H 1 8.199 . . . . . . . A 52 GLU H . 34216 1 528 . 1 1 42 42 GLU HA H 1 5.030 . . . . . . . A 52 GLU HA . 34216 1 529 . 1 1 42 42 GLU HB2 H 1 1.803 . . . . . . . A 52 GLU HB2 . 34216 1 530 . 1 1 42 42 GLU HB3 H 1 1.530 . . . . . . . A 52 GLU HB3 . 34216 1 531 . 1 1 42 42 GLU HG2 H 1 1.889 . . . . . . . A 52 GLU HG2 . 34216 1 532 . 1 1 42 42 GLU HG3 H 1 2.002 . . . . . . . A 52 GLU HG3 . 34216 1 533 . 1 1 42 42 GLU C C 13 176.167 . . . . . . . A 52 GLU C . 34216 1 534 . 1 1 42 42 GLU CA C 13 55.037 . . . . . . . A 52 GLU CA . 34216 1 535 . 1 1 42 42 GLU CB C 13 33.708 . . . . . . . A 52 GLU CB . 34216 1 536 . 1 1 42 42 GLU CG C 13 35.959 . . . . . . . A 52 GLU CG . 34216 1 537 . 1 1 42 42 GLU N N 15 118.577 . . . . . . . A 52 GLU N . 34216 1 538 . 1 1 43 43 VAL H H 1 8.489 . . . . . . . A 53 VAL H . 34216 1 539 . 1 1 43 43 VAL HA H 1 4.142 . . . . . . . A 53 VAL HA . 34216 1 540 . 1 1 43 43 VAL HB H 1 0.733 . . . . . . . A 53 VAL HB . 34216 1 541 . 1 1 43 43 VAL HG11 H 1 0.943 . . . . . . . A 53 VAL HG11 . 34216 1 542 . 1 1 43 43 VAL HG12 H 1 0.943 . . . . . . . A 53 VAL HG12 . 34216 1 543 . 1 1 43 43 VAL HG13 H 1 0.943 . . . . . . . A 53 VAL HG13 . 34216 1 544 . 1 1 43 43 VAL HG21 H 1 0.893 . . . . . . . A 53 VAL HG21 . 34216 1 545 . 1 1 43 43 VAL HG22 H 1 0.893 . . . . . . . A 53 VAL HG22 . 34216 1 546 . 1 1 43 43 VAL HG23 H 1 0.893 . . . . . . . A 53 VAL HG23 . 34216 1 547 . 1 1 43 43 VAL C C 13 174.321 . . . . . . . A 53 VAL C . 34216 1 548 . 1 1 43 43 VAL CA C 13 62.723 . . . . . . . A 53 VAL CA . 34216 1 549 . 1 1 43 43 VAL CB C 13 31.449 . . . . . . . A 53 VAL CB . 34216 1 550 . 1 1 43 43 VAL CG1 C 13 20.951 . . . . . . . A 53 VAL CG1 . 34216 1 551 . 1 1 43 43 VAL CG2 C 13 22.822 . . . . . . . A 53 VAL CG2 . 34216 1 552 . 1 1 43 43 VAL N N 15 124.703 . . . . . . . A 53 VAL N . 34216 1 553 . 1 1 44 44 GLN H H 1 8.360 . . . . . . . A 54 GLN H . 34216 1 554 . 1 1 44 44 GLN HA H 1 4.815 . . . . . . . A 54 GLN HA . 34216 1 555 . 1 1 44 44 GLN HB2 H 1 1.421 . . . . . . . A 54 GLN HB2 . 34216 1 556 . 1 1 44 44 GLN HB3 H 1 1.421 . . . . . . . A 54 GLN HB3 . 34216 1 557 . 1 1 44 44 GLN HG2 H 1 1.955 . . . . . . . A 54 GLN HG2 . 34216 1 558 . 1 1 44 44 GLN HG3 H 1 1.955 . . . . . . . A 54 GLN HG3 . 34216 1 559 . 1 1 44 44 GLN HE21 H 1 6.573 . . . . . . . A 54 GLN HE21 . 34216 1 560 . 1 1 44 44 GLN HE22 H 1 7.553 . . . . . . . A 54 GLN HE22 . 34216 1 561 . 1 1 44 44 GLN C C 13 174.278 . . . . . . . A 54 GLN C . 34216 1 562 . 1 1 44 44 GLN CA C 13 53.718 . . . . . . . A 54 GLN CA . 34216 1 563 . 1 1 44 44 GLN CB C 13 33.724 . . . . . . . A 54 GLN CB . 34216 1 564 . 1 1 44 44 GLN CG C 13 34.035 . . . . . . . A 54 GLN CG . 34216 1 565 . 1 1 44 44 GLN N N 15 122.524 . . . . . . . A 54 GLN N . 34216 1 566 . 1 1 44 44 GLN NE2 N 15 110.472 . . . . . . . A 54 GLN NE2 . 34216 1 567 . 1 1 45 45 TRP H H 1 7.451 . . . . . . . A 55 TRP H . 34216 1 568 . 1 1 45 45 TRP HA H 1 6.083 . . . . . . . A 55 TRP HA . 34216 1 569 . 1 1 45 45 TRP HB2 H 1 3.240 . . . . . . . A 55 TRP HB2 . 34216 1 570 . 1 1 45 45 TRP HB3 H 1 2.795 . . . . . . . A 55 TRP HB3 . 34216 1 571 . 1 1 45 45 TRP HD1 H 1 6.077 . . . . . . . A 55 TRP HD1 . 34216 1 572 . 1 1 45 45 TRP HE1 H 1 9.450 . . . . . . . A 55 TRP HE1 . 34216 1 573 . 1 1 45 45 TRP HE3 H 1 6.933 . . . . . . . A 55 TRP HE3 . 34216 1 574 . 1 1 45 45 TRP HZ2 H 1 7.005 . . . . . . . A 55 TRP HZ2 . 34216 1 575 . 1 1 45 45 TRP HZ3 H 1 6.632 . . . . . . . A 55 TRP HZ3 . 34216 1 576 . 1 1 45 45 TRP HH2 H 1 6.769 . . . . . . . A 55 TRP HH2 . 34216 1 577 . 1 1 45 45 TRP C C 13 174.066 . . . . . . . A 55 TRP C . 34216 1 578 . 1 1 45 45 TRP CA C 13 55.548 . . . . . . . A 55 TRP CA . 34216 1 579 . 1 1 45 45 TRP CB C 13 31.960 . . . . . . . A 55 TRP CB . 34216 1 580 . 1 1 45 45 TRP CD1 C 13 183.141 . . . . . . . A 55 TRP CD1 . 34216 1 581 . 1 1 45 45 TRP CE3 C 13 151.610 . . . . . . . A 55 TRP CE3 . 34216 1 582 . 1 1 45 45 TRP CZ2 C 13 159.041 . . . . . . . A 55 TRP CZ2 . 34216 1 583 . 1 1 45 45 TRP CZ3 C 13 153.361 . . . . . . . A 55 TRP CZ3 . 34216 1 584 . 1 1 45 45 TRP CH2 C 13 129.599 . . . . . . . A 55 TRP CH2 . 34216 1 585 . 1 1 45 45 TRP N N 15 112.759 . . . . . . . A 55 TRP N . 34216 1 586 . 1 1 45 45 TRP NE1 N 15 128.400 . . . . . . . A 55 TRP NE1 . 34216 1 587 . 1 1 46 46 PHE H H 1 9.059 . . . . . . . A 56 PHE H . 34216 1 588 . 1 1 46 46 PHE HA H 1 4.782 . . . . . . . A 56 PHE HA . 34216 1 589 . 1 1 46 46 PHE HB2 H 1 3.150 . . . . . . . A 56 PHE HB2 . 34216 1 590 . 1 1 46 46 PHE HB3 H 1 2.872 . . . . . . . A 56 PHE HB3 . 34216 1 591 . 1 1 46 46 PHE HD1 H 1 7.169 . . . . . . . A 56 PHE HD1 . 34216 1 592 . 1 1 46 46 PHE HD2 H 1 7.169 . . . . . . . A 56 PHE HD2 . 34216 1 593 . 1 1 46 46 PHE HE1 H 1 7.027 . . . . . . . A 56 PHE HE1 . 34216 1 594 . 1 1 46 46 PHE HE2 H 1 7.027 . . . . . . . A 56 PHE HE2 . 34216 1 595 . 1 1 46 46 PHE C C 13 175.636 . . . . . . . A 56 PHE C . 34216 1 596 . 1 1 46 46 PHE CA C 13 56.883 . . . . . . . A 56 PHE CA . 34216 1 597 . 1 1 46 46 PHE CB C 13 42.228 . . . . . . . A 56 PHE CB . 34216 1 598 . 1 1 46 46 PHE CD1 C 13 131.850 . . . . . . . A 56 PHE CD1 . 34216 1 599 . 1 1 46 46 PHE CD2 C 13 131.850 . . . . . . . A 56 PHE CD2 . 34216 1 600 . 1 1 46 46 PHE CE1 C 13 132.601 . . . . . . . A 56 PHE CE1 . 34216 1 601 . 1 1 46 46 PHE CE2 C 13 132.601 . . . . . . . A 56 PHE CE2 . 34216 1 602 . 1 1 46 46 PHE N N 15 118.039 . . . . . . . A 56 PHE N . 34216 1 603 . 1 1 47 47 LYS H H 1 8.642 . . . . . . . A 57 LYS H . 34216 1 604 . 1 1 47 47 LYS HA H 1 4.607 . . . . . . . A 57 LYS HA . 34216 1 605 . 1 1 47 47 LYS HB2 H 1 1.963 . . . . . . . A 57 LYS HB2 . 34216 1 606 . 1 1 47 47 LYS HB3 H 1 1.818 . . . . . . . A 57 LYS HB3 . 34216 1 607 . 1 1 47 47 LYS HG2 H 1 1.485 . . . . . . . A 57 LYS HG2 . 34216 1 608 . 1 1 47 47 LYS HG3 H 1 1.485 . . . . . . . A 57 LYS HG3 . 34216 1 609 . 1 1 47 47 LYS HD2 H 1 1.662 . . . . . . . A 57 LYS HD2 . 34216 1 610 . 1 1 47 47 LYS HD3 H 1 1.670 . . . . . . . A 57 LYS HD3 . 34216 1 611 . 1 1 47 47 LYS HE2 H 1 2.963 . . . . . . . A 57 LYS HE2 . 34216 1 612 . 1 1 47 47 LYS HE3 H 1 2.963 . . . . . . . A 57 LYS HE3 . 34216 1 613 . 1 1 47 47 LYS C C 13 176.688 . . . . . . . A 57 LYS C . 34216 1 614 . 1 1 47 47 LYS CA C 13 56.716 . . . . . . . A 57 LYS CA . 34216 1 615 . 1 1 47 47 LYS CB C 13 34.098 . . . . . . . A 57 LYS CB . 34216 1 616 . 1 1 47 47 LYS CG C 13 25.253 . . . . . . . A 57 LYS CG . 34216 1 617 . 1 1 47 47 LYS CD C 13 29.206 . . . . . . . A 57 LYS CD . 34216 1 618 . 1 1 47 47 LYS CE C 13 42.212 . . . . . . . A 57 LYS CE . 34216 1 619 . 1 1 47 47 LYS N N 15 122.580 . . . . . . . A 57 LYS N . 34216 1 620 . 1 1 48 48 GLY H H 1 8.822 . . . . . . . A 58 GLY H . 34216 1 621 . 1 1 48 48 GLY HA2 H 1 4.052 . . . . . . . A 58 GLY HA2 . 34216 1 622 . 1 1 48 48 GLY HA3 H 1 3.966 . . . . . . . A 58 GLY HA3 . 34216 1 623 . 1 1 48 48 GLY C C 13 173.997 . . . . . . . A 58 GLY C . 34216 1 624 . 1 1 48 48 GLY CA C 13 45.214 . . . . . . . A 58 GLY CA . 34216 1 625 . 1 1 48 48 GLY N N 15 110.784 . . . . . . . A 58 GLY N . 34216 1 626 . 1 1 52 52 ALA H H 1 8.196 . . . . . . . A 62 ALA H . 34216 1 627 . 1 1 52 52 ALA HA H 1 4.245 . . . . . . . A 62 ALA HA . 34216 1 628 . 1 1 52 52 ALA HB1 H 1 1.369 . . . . . . . A 62 ALA HB1 . 34216 1 629 . 1 1 52 52 ALA HB2 H 1 1.369 . . . . . . . A 62 ALA HB2 . 34216 1 630 . 1 1 52 52 ALA HB3 H 1 1.369 . . . . . . . A 62 ALA HB3 . 34216 1 631 . 1 1 52 52 ALA C C 13 178.268 . . . . . . . A 62 ALA C . 34216 1 632 . 1 1 52 52 ALA CA C 13 52.718 . . . . . . . A 62 ALA CA . 34216 1 633 . 1 1 52 52 ALA CB C 13 19.035 . . . . . . . A 62 ALA CB . 34216 1 634 . 1 1 52 52 ALA N N 15 122.563 . . . . . . . A 62 ALA N . 34216 1 635 . 1 1 53 53 GLY H H 1 8.315 . . . . . . . A 63 GLY H . 34216 1 636 . 1 1 53 53 GLY HA2 H 1 3.960 . . . . . . . A 63 GLY HA2 . 34216 1 637 . 1 1 53 53 GLY HA3 H 1 3.882 . . . . . . . A 63 GLY HA3 . 34216 1 638 . 1 1 53 53 GLY C C 13 174.193 . . . . . . . A 63 GLY C . 34216 1 639 . 1 1 53 53 GLY CA C 13 45.251 . . . . . . . A 63 GLY CA . 34216 1 640 . 1 1 53 53 GLY N N 15 108.242 . . . . . . . A 63 GLY N . 34216 1 641 . 1 1 54 54 ALA H H 1 8.024 . . . . . . . A 64 ALA H . 34216 1 642 . 1 1 54 54 ALA HA H 1 4.281 . . . . . . . A 64 ALA HA . 34216 1 643 . 1 1 54 54 ALA HB1 H 1 1.378 . . . . . . . A 64 ALA HB1 . 34216 1 644 . 1 1 54 54 ALA HB2 H 1 1.378 . . . . . . . A 64 ALA HB2 . 34216 1 645 . 1 1 54 54 ALA HB3 H 1 1.378 . . . . . . . A 64 ALA HB3 . 34216 1 646 . 1 1 54 54 ALA C C 13 178.225 . . . . . . . A 64 ALA C . 34216 1 647 . 1 1 54 54 ALA CA C 13 52.919 . . . . . . . A 64 ALA CA . 34216 1 648 . 1 1 54 54 ALA CB C 13 19.108 . . . . . . . A 64 ALA CB . 34216 1 649 . 1 1 54 54 ALA N N 15 123.450 . . . . . . . A 64 ALA N . 34216 1 650 . 1 1 55 55 GLN H H 1 8.400 . . . . . . . A 65 GLN H . 34216 1 651 . 1 1 55 55 GLN HA H 1 4.155 . . . . . . . A 65 GLN HA . 34216 1 652 . 1 1 55 55 GLN HB2 H 1 2.015 . . . . . . . A 65 GLN HB2 . 34216 1 653 . 1 1 55 55 GLN HB3 H 1 1.898 . . . . . . . A 65 GLN HB3 . 34216 1 654 . 1 1 55 55 GLN HG2 H 1 2.270 . . . . . . . A 65 GLN HG2 . 34216 1 655 . 1 1 55 55 GLN HG3 H 1 2.270 . . . . . . . A 65 GLN HG3 . 34216 1 656 . 1 1 55 55 GLN HE21 H 1 7.450 . . . . . . . A 65 GLN HE21 . 34216 1 657 . 1 1 55 55 GLN HE22 H 1 6.816 . . . . . . . A 65 GLN HE22 . 34216 1 658 . 1 1 55 55 GLN C C 13 175.912 . . . . . . . A 65 GLN C . 34216 1 659 . 1 1 55 55 GLN CA C 13 56.220 . . . . . . . A 65 GLN CA . 34216 1 660 . 1 1 55 55 GLN CB C 13 28.966 . . . . . . . A 65 GLN CB . 34216 1 661 . 1 1 55 55 GLN CG C 13 33.958 . . . . . . . A 65 GLN CG . 34216 1 662 . 1 1 55 55 GLN N N 15 118.644 . . . . . . . A 65 GLN N . 34216 1 663 . 1 1 55 55 GLN NE2 N 15 112.425 . . . . . . . A 65 GLN NE2 . 34216 1 664 . 1 1 56 56 ASP H H 1 8.167 . . . . . . . A 66 ASP H . 34216 1 665 . 1 1 56 56 ASP HA H 1 4.492 . . . . . . . A 66 ASP HA . 34216 1 666 . 1 1 56 56 ASP HB2 H 1 2.652 . . . . . . . A 66 ASP HB2 . 34216 1 667 . 1 1 56 56 ASP HB3 H 1 2.652 . . . . . . . A 66 ASP HB3 . 34216 1 668 . 1 1 56 56 ASP C C 13 176.379 . . . . . . . A 66 ASP C . 34216 1 669 . 1 1 56 56 ASP CA C 13 54.817 . . . . . . . A 66 ASP CA . 34216 1 670 . 1 1 56 56 ASP CB C 13 41.162 . . . . . . . A 66 ASP CB . 34216 1 671 . 1 1 56 56 ASP N N 15 120.202 . . . . . . . A 66 ASP N . 34216 1 672 . 1 1 57 57 ARG H H 1 8.167 . . . . . . . A 67 ARG H . 34216 1 673 . 1 1 57 57 ARG HA H 1 4.311 . . . . . . . A 67 ARG HA . 34216 1 674 . 1 1 57 57 ARG HB2 H 1 1.755 . . . . . . . A 67 ARG HB2 . 34216 1 675 . 1 1 57 57 ARG HB3 H 1 1.913 . . . . . . . A 67 ARG HB3 . 34216 1 676 . 1 1 57 57 ARG HG2 H 1 1.639 . . . . . . . A 67 ARG HG2 . 34216 1 677 . 1 1 57 57 ARG HG3 H 1 1.639 . . . . . . . A 67 ARG HG3 . 34216 1 678 . 1 1 57 57 ARG HD2 H 1 3.182 . . . . . . . A 67 ARG HD2 . 34216 1 679 . 1 1 57 57 ARG HD3 H 1 3.182 . . . . . . . A 67 ARG HD3 . 34216 1 680 . 1 1 57 57 ARG C C 13 176.167 . . . . . . . A 67 ARG C . 34216 1 681 . 1 1 57 57 ARG CA C 13 56.278 . . . . . . . A 67 ARG CA . 34216 1 682 . 1 1 57 57 ARG CB C 13 30.206 . . . . . . . A 67 ARG CB . 34216 1 683 . 1 1 57 57 ARG CG C 13 27.429 . . . . . . . A 67 ARG CG . 34216 1 684 . 1 1 57 57 ARG CD C 13 43.236 . . . . . . . A 67 ARG CD . 34216 1 685 . 1 1 57 57 ARG N N 15 120.263 . . . . . . . A 67 ARG N . 34216 1 686 . 1 1 58 58 LYS H H 1 8.094 . . . . . . . A 68 LYS H . 34216 1 687 . 1 1 58 58 LYS HA H 1 4.317 . . . . . . . A 68 LYS HA . 34216 1 688 . 1 1 58 58 LYS HB2 H 1 1.876 . . . . . . . A 68 LYS HB2 . 34216 1 689 . 1 1 58 58 LYS HB3 H 1 1.876 . . . . . . . A 68 LYS HB3 . 34216 1 690 . 1 1 58 58 LYS HG2 H 1 1.449 . . . . . . . A 68 LYS HG2 . 34216 1 691 . 1 1 58 58 LYS HG3 H 1 1.449 . . . . . . . A 68 LYS HG3 . 34216 1 692 . 1 1 58 58 LYS HD2 H 1 1.667 . . . . . . . A 68 LYS HD2 . 34216 1 693 . 1 1 58 58 LYS HD3 H 1 1.667 . . . . . . . A 68 LYS HD3 . 34216 1 694 . 1 1 58 58 LYS HE2 H 1 2.968 . . . . . . . A 68 LYS HE2 . 34216 1 695 . 1 1 58 58 LYS HE3 H 1 2.968 . . . . . . . A 68 LYS HE3 . 34216 1 696 . 1 1 58 58 LYS C C 13 176.209 . . . . . . . A 68 LYS C . 34216 1 697 . 1 1 58 58 LYS CA C 13 56.351 . . . . . . . A 68 LYS CA . 34216 1 698 . 1 1 58 58 LYS CB C 13 33.275 . . . . . . . A 68 LYS CB . 34216 1 699 . 1 1 58 58 LYS CG C 13 24.786 . . . . . . . A 68 LYS CG . 34216 1 700 . 1 1 58 58 LYS CD C 13 29.294 . . . . . . . A 68 LYS CD . 34216 1 701 . 1 1 58 58 LYS CE C 13 42.195 . . . . . . . A 68 LYS CE . 34216 1 702 . 1 1 58 58 LYS N N 15 120.432 . . . . . . . A 68 LYS N . 34216 1 703 . 1 1 59 59 LYS H H 1 8.142 . . . . . . . A 69 LYS H . 34216 1 704 . 1 1 59 59 LYS HA H 1 4.649 . . . . . . . A 69 LYS HA . 34216 1 705 . 1 1 59 59 LYS HB2 H 1 1.769 . . . . . . . A 69 LYS HB2 . 34216 1 706 . 1 1 59 59 LYS HB3 H 1 1.683 . . . . . . . A 69 LYS HB3 . 34216 1 707 . 1 1 59 59 LYS HG2 H 1 1.416 . . . . . . . A 69 LYS HG2 . 34216 1 708 . 1 1 59 59 LYS HG3 H 1 1.416 . . . . . . . A 69 LYS HG3 . 34216 1 709 . 1 1 59 59 LYS HD2 H 1 1.661 . . . . . . . A 69 LYS HD2 . 34216 1 710 . 1 1 59 59 LYS HD3 H 1 1.661 . . . . . . . A 69 LYS HD3 . 34216 1 711 . 1 1 59 59 LYS HE2 H 1 2.969 . . . . . . . A 69 LYS HE2 . 34216 1 712 . 1 1 59 59 LYS HE3 H 1 2.969 . . . . . . . A 69 LYS HE3 . 34216 1 713 . 1 1 59 59 LYS C C 13 173.811 . . . . . . . A 69 LYS C . 34216 1 714 . 1 1 59 59 LYS CA C 13 53.718 . . . . . . . A 69 LYS CA . 34216 1 715 . 1 1 59 59 LYS CB C 13 32.910 . . . . . . . A 69 LYS CB . 34216 1 716 . 1 1 59 59 LYS CG C 13 24.609 . . . . . . . A 69 LYS CG . 34216 1 717 . 1 1 59 59 LYS CD C 13 29.117 . . . . . . . A 69 LYS CD . 34216 1 718 . 1 1 59 59 LYS CE C 13 42.131 . . . . . . . A 69 LYS CE . 34216 1 719 . 1 1 59 59 LYS N N 15 122.064 . . . . . . . A 69 LYS N . 34216 1 720 . 1 1 60 60 PRO HA H 1 3.313 . . . . . . . A 70 PRO HA . 34216 1 721 . 1 1 60 60 PRO HB2 H 1 1.349 . . . . . . . A 70 PRO HB2 . 34216 1 722 . 1 1 60 60 PRO HB3 H 1 1.349 . . . . . . . A 70 PRO HB3 . 34216 1 723 . 1 1 60 60 PRO HG2 H 1 1.529 . . . . . . . A 70 PRO HG2 . 34216 1 724 . 1 1 60 60 PRO HG3 H 1 1.641 . . . . . . . A 70 PRO HG3 . 34216 1 725 . 1 1 60 60 PRO HD2 H 1 3.488 . . . . . . . A 70 PRO HD2 . 34216 1 726 . 1 1 60 60 PRO HD3 H 1 3.488 . . . . . . . A 70 PRO HD3 . 34216 1 727 . 1 1 60 60 PRO C C 13 176.716 . . . . . . . A 70 PRO C . 34216 1 728 . 1 1 60 60 PRO CA C 13 62.619 . . . . . . . A 70 PRO CA . 34216 1 729 . 1 1 60 60 PRO CB C 13 31.707 . . . . . . . A 70 PRO CB . 34216 1 730 . 1 1 60 60 PRO CG C 13 26.652 . . . . . . . A 70 PRO CG . 34216 1 731 . 1 1 60 60 PRO CD C 13 50.467 . . . . . . . A 70 PRO CD . 34216 1 732 . 1 1 61 61 SER H H 1 8.565 . . . . . . . A 71 SER H . 34216 1 733 . 1 1 61 61 SER HA H 1 4.264 . . . . . . . A 71 SER HA . 34216 1 734 . 1 1 61 61 SER HB2 H 1 3.903 . . . . . . . A 71 SER HB2 . 34216 1 735 . 1 1 61 61 SER HB3 H 1 3.541 . . . . . . . A 71 SER HB3 . 34216 1 736 . 1 1 61 61 SER C C 13 173.702 . . . . . . . A 71 SER C . 34216 1 737 . 1 1 61 61 SER CA C 13 59.954 . . . . . . . A 71 SER CA . 34216 1 738 . 1 1 61 61 SER CB C 13 63.285 . . . . . . . A 71 SER CB . 34216 1 739 . 1 1 61 61 SER N N 15 117.773 . . . . . . . A 71 SER N . 34216 1 740 . 1 1 62 62 GLY H H 1 6.648 . . . . . . . A 72 GLY H . 34216 1 741 . 1 1 62 62 GLY HA2 H 1 3.526 . . . . . . . A 72 GLY HA2 . 34216 1 742 . 1 1 62 62 GLY HA3 H 1 3.034 . . . . . . . A 72 GLY HA3 . 34216 1 743 . 1 1 62 62 GLY C C 13 169.037 . . . . . . . A 72 GLY C . 34216 1 744 . 1 1 62 62 GLY CA C 13 43.963 . . . . . . . A 72 GLY CA . 34216 1 745 . 1 1 62 62 GLY N N 15 107.167 . . . . . . . A 72 GLY N . 34216 1 746 . 1 1 63 63 GLY H H 1 7.100 . . . . . . . A 73 GLY H . 34216 1 747 . 1 1 63 63 GLY HA2 H 1 3.822 . . . . . . . A 73 GLY HA2 . 34216 1 748 . 1 1 63 63 GLY HA3 H 1 3.428 . . . . . . . A 73 GLY HA3 . 34216 1 749 . 1 1 63 63 GLY C C 13 172.177 . . . . . . . A 73 GLY C . 34216 1 750 . 1 1 63 63 GLY CA C 13 46.565 . . . . . . . A 73 GLY CA . 34216 1 751 . 1 1 63 63 GLY N N 15 130.956 . . . . . . . A 73 GLY N . 34216 1 752 . 1 1 64 64 PHE H H 1 8.347 . . . . . . . A 74 PHE H . 34216 1 753 . 1 1 64 64 PHE HA H 1 5.205 . . . . . . . A 74 PHE HA . 34216 1 754 . 1 1 64 64 PHE HB2 H 1 3.226 . . . . . . . A 74 PHE HB2 . 34216 1 755 . 1 1 64 64 PHE HB3 H 1 2.960 . . . . . . . A 74 PHE HB3 . 34216 1 756 . 1 1 64 64 PHE HD1 H 1 6.730 . . . . . . . A 74 PHE HD1 . 34216 1 757 . 1 1 64 64 PHE HD2 H 1 6.730 . . . . . . . A 74 PHE HD2 . 34216 1 758 . 1 1 64 64 PHE HE1 H 1 7.001 . . . . . . . A 74 PHE HE1 . 34216 1 759 . 1 1 64 64 PHE HE2 H 1 7.001 . . . . . . . A 74 PHE HE2 . 34216 1 760 . 1 1 64 64 PHE C C 13 171.965 . . . . . . . A 74 PHE C . 34216 1 761 . 1 1 64 64 PHE CA C 13 54.525 . . . . . . . A 74 PHE CA . 34216 1 762 . 1 1 64 64 PHE CB C 13 39.190 . . . . . . . A 74 PHE CB . 34216 1 763 . 1 1 64 64 PHE CD1 C 13 134.131 . . . . . . . A 74 PHE CD1 . 34216 1 764 . 1 1 64 64 PHE CD2 C 13 134.131 . . . . . . . A 74 PHE CD2 . 34216 1 765 . 1 1 64 64 PHE CE1 C 13 127.098 . . . . . . . A 74 PHE CE1 . 34216 1 766 . 1 1 64 64 PHE CE2 C 13 127.098 . . . . . . . A 74 PHE CE2 . 34216 1 767 . 1 1 64 64 PHE N N 15 113.379 . . . . . . . A 74 PHE N . 34216 1 768 . 1 1 65 65 PRO HA H 1 4.970 . . . . . . . A 75 PRO HA . 34216 1 769 . 1 1 65 65 PRO HB2 H 1 2.493 . . . . . . . A 75 PRO HB2 . 34216 1 770 . 1 1 65 65 PRO HB3 H 1 2.111 . . . . . . . A 75 PRO HB3 . 34216 1 771 . 1 1 65 65 PRO HG2 H 1 2.089 . . . . . . . A 75 PRO HG2 . 34216 1 772 . 1 1 65 65 PRO HG3 H 1 2.089 . . . . . . . A 75 PRO HG3 . 34216 1 773 . 1 1 65 65 PRO HD2 H 1 4.038 . . . . . . . A 75 PRO HD2 . 34216 1 774 . 1 1 65 65 PRO HD3 H 1 3.518 . . . . . . . A 75 PRO HD3 . 34216 1 775 . 1 1 65 65 PRO C C 13 178.334 . . . . . . . A 75 PRO C . 34216 1 776 . 1 1 65 65 PRO CA C 13 62.019 . . . . . . . A 75 PRO CA . 34216 1 777 . 1 1 65 65 PRO CB C 13 31.899 . . . . . . . A 75 PRO CB . 34216 1 778 . 1 1 65 65 PRO CG C 13 28.205 . . . . . . . A 75 PRO CG . 34216 1 779 . 1 1 65 65 PRO CD C 13 51.467 . . . . . . . A 75 PRO CD . 34216 1 780 . 1 1 66 66 VAL H H 1 8.678 . . . . . . . A 76 VAL H . 34216 1 781 . 1 1 66 66 VAL HA H 1 3.702 . . . . . . . A 76 VAL HA . 34216 1 782 . 1 1 66 66 VAL HB H 1 1.913 . . . . . . . A 76 VAL HB . 34216 1 783 . 1 1 66 66 VAL HG11 H 1 0.822 . . . . . . . A 76 VAL HG11 . 34216 1 784 . 1 1 66 66 VAL HG12 H 1 0.822 . . . . . . . A 76 VAL HG12 . 34216 1 785 . 1 1 66 66 VAL HG13 H 1 0.822 . . . . . . . A 76 VAL HG13 . 34216 1 786 . 1 1 66 66 VAL HG21 H 1 0.822 . . . . . . . A 76 VAL HG21 . 34216 1 787 . 1 1 66 66 VAL HG22 H 1 0.822 . . . . . . . A 76 VAL HG22 . 34216 1 788 . 1 1 66 66 VAL HG23 H 1 0.822 . . . . . . . A 76 VAL HG23 . 34216 1 789 . 1 1 66 66 VAL C C 13 178.005 . . . . . . . A 76 VAL C . 34216 1 790 . 1 1 66 66 VAL CA C 13 65.551 . . . . . . . A 76 VAL CA . 34216 1 791 . 1 1 66 66 VAL CB C 13 32.165 . . . . . . . A 76 VAL CB . 34216 1 792 . 1 1 66 66 VAL CG1 C 13 21.702 . . . . . . . A 76 VAL CG1 . 34216 1 793 . 1 1 66 66 VAL CG2 C 13 21.702 . . . . . . . A 76 VAL CG2 . 34216 1 794 . 1 1 66 66 VAL N N 15 124.723 . . . . . . . A 76 VAL N . 34216 1 795 . 1 1 67 67 ASP H H 1 8.890 . . . . . . . A 77 ASP H . 34216 1 796 . 1 1 67 67 ASP HA H 1 4.394 . . . . . . . A 77 ASP HA . 34216 1 797 . 1 1 67 67 ASP HB2 H 1 2.952 . . . . . . . A 77 ASP HB2 . 34216 1 798 . 1 1 67 67 ASP HB3 H 1 2.621 . . . . . . . A 77 ASP HB3 . 34216 1 799 . 1 1 67 67 ASP C C 13 176.998 . . . . . . . A 77 ASP C . 34216 1 800 . 1 1 67 67 ASP CA C 13 54.969 . . . . . . . A 77 ASP CA . 34216 1 801 . 1 1 67 67 ASP CB C 13 40.029 . . . . . . . A 77 ASP CB . 34216 1 802 . 1 1 67 67 ASP N N 15 116.595 . . . . . . . A 77 ASP N . 34216 1 803 . 1 1 68 68 LYS H H 1 7.321 . . . . . . . A 78 LYS H . 34216 1 804 . 1 1 68 68 LYS HA H 1 4.651 . . . . . . . A 78 LYS HA . 34216 1 805 . 1 1 68 68 LYS HB2 H 1 1.686 . . . . . . . A 78 LYS HB2 . 34216 1 806 . 1 1 68 68 LYS HB3 H 1 1.686 . . . . . . . A 78 LYS HB3 . 34216 1 807 . 1 1 68 68 LYS HG2 H 1 1.443 . . . . . . . A 78 LYS HG2 . 34216 1 808 . 1 1 68 68 LYS HG3 H 1 1.443 . . . . . . . A 78 LYS HG3 . 34216 1 809 . 1 1 68 68 LYS HD2 H 1 1.667 . . . . . . . A 78 LYS HD2 . 34216 1 810 . 1 1 68 68 LYS HD3 H 1 1.667 . . . . . . . A 78 LYS HD3 . 34216 1 811 . 1 1 68 68 LYS HE2 H 1 2.964 . . . . . . . A 78 LYS HE2 . 34216 1 812 . 1 1 68 68 LYS HE3 H 1 2.964 . . . . . . . A 78 LYS HE3 . 34216 1 813 . 1 1 68 68 LYS C C 13 176.288 . . . . . . . A 78 LYS C . 34216 1 814 . 1 1 68 68 LYS CA C 13 53.722 . . . . . . . A 78 LYS CA . 34216 1 815 . 1 1 68 68 LYS CB C 13 32.252 . . . . . . . A 78 LYS CB . 34216 1 816 . 1 1 68 68 LYS CG C 13 24.553 . . . . . . . A 78 LYS CG . 34216 1 817 . 1 1 68 68 LYS CD C 13 29.206 . . . . . . . A 78 LYS CD . 34216 1 818 . 1 1 68 68 LYS CE C 13 42.117 . . . . . . . A 78 LYS CE . 34216 1 819 . 1 1 68 68 LYS N N 15 116.331 . . . . . . . A 78 LYS N . 34216 1 820 . 1 1 69 69 ILE H H 1 7.455 . . . . . . . A 79 ILE H . 34216 1 821 . 1 1 69 69 ILE HA H 1 4.071 . . . . . . . A 79 ILE HA . 34216 1 822 . 1 1 69 69 ILE HB H 1 1.927 . . . . . . . A 79 ILE HB . 34216 1 823 . 1 1 69 69 ILE HG12 H 1 0.842 . . . . . . . A 79 ILE HG12 . 34216 1 824 . 1 1 69 69 ILE HG13 H 1 0.842 . . . . . . . A 79 ILE HG13 . 34216 1 825 . 1 1 69 69 ILE HG21 H 1 0.943 . . . . . . . A 79 ILE HG21 . 34216 1 826 . 1 1 69 69 ILE HG22 H 1 0.943 . . . . . . . A 79 ILE HG22 . 34216 1 827 . 1 1 69 69 ILE HG23 H 1 0.943 . . . . . . . A 79 ILE HG23 . 34216 1 828 . 1 1 69 69 ILE HD11 H 1 1.179 . . . . . . . A 79 ILE HD11 . 34216 1 829 . 1 1 69 69 ILE HD12 H 1 1.179 . . . . . . . A 79 ILE HD12 . 34216 1 830 . 1 1 69 69 ILE HD13 H 1 1.179 . . . . . . . A 79 ILE HD13 . 34216 1 831 . 1 1 69 69 ILE C C 13 177.228 . . . . . . . A 79 ILE C . 34216 1 832 . 1 1 69 69 ILE CA C 13 63.581 . . . . . . . A 79 ILE CA . 34216 1 833 . 1 1 69 69 ILE CB C 13 39.044 . . . . . . . A 79 ILE CB . 34216 1 834 . 1 1 69 69 ILE CG1 C 13 28.128 . . . . . . . A 79 ILE CG1 . 34216 1 835 . 1 1 69 69 ILE CG2 C 13 18.229 . . . . . . . A 79 ILE CG2 . 34216 1 836 . 1 1 69 69 ILE CD1 C 13 14.742 . . . . . . . A 79 ILE CD1 . 34216 1 837 . 1 1 69 69 ILE N N 15 121.409 . . . . . . . A 79 ILE N . 34216 1 838 . 1 1 70 70 THR H H 1 9.333 . . . . . . . A 80 THR H . 34216 1 839 . 1 1 70 70 THR HA H 1 4.481 . . . . . . . A 80 THR HA . 34216 1 840 . 1 1 70 70 THR HB H 1 4.175 . . . . . . . A 80 THR HB . 34216 1 841 . 1 1 70 70 THR HG21 H 1 1.156 . . . . . . . A 80 THR HG21 . 34216 1 842 . 1 1 70 70 THR HG22 H 1 1.156 . . . . . . . A 80 THR HG22 . 34216 1 843 . 1 1 70 70 THR HG23 H 1 1.156 . . . . . . . A 80 THR HG23 . 34216 1 844 . 1 1 70 70 THR C C 13 175.352 . . . . . . . A 80 THR C . 34216 1 845 . 1 1 70 70 THR CA C 13 61.819 . . . . . . . A 80 THR CA . 34216 1 846 . 1 1 70 70 THR CB C 13 69.949 . . . . . . . A 80 THR CB . 34216 1 847 . 1 1 70 70 THR CG2 C 13 22.202 . . . . . . . A 80 THR CG2 . 34216 1 848 . 1 1 70 70 THR N N 15 120.041 . . . . . . . A 80 THR N . 34216 1 849 . 1 1 71 71 SER H H 1 7.541 . . . . . . . A 81 SER H . 34216 1 850 . 1 1 71 71 SER HA H 1 4.630 . . . . . . . A 81 SER HA . 34216 1 851 . 1 1 71 71 SER HB2 H 1 3.807 . . . . . . . A 81 SER HB2 . 34216 1 852 . 1 1 71 71 SER HB3 H 1 3.774 . . . . . . . A 81 SER HB3 . 34216 1 853 . 1 1 71 71 SER C C 13 172.114 . . . . . . . A 81 SER C . 34216 1 854 . 1 1 71 71 SER CA C 13 58.688 . . . . . . . A 81 SER CA . 34216 1 855 . 1 1 71 71 SER CB C 13 64.474 . . . . . . . A 81 SER CB . 34216 1 856 . 1 1 71 71 SER N N 15 114.943 . . . . . . . A 81 SER N . 34216 1 857 . 1 1 72 72 VAL H H 1 8.469 . . . . . . . A 82 VAL H . 34216 1 858 . 1 1 72 72 VAL HA H 1 4.604 . . . . . . . A 82 VAL HA . 34216 1 859 . 1 1 72 72 VAL HB H 1 2.129 . . . . . . . A 82 VAL HB . 34216 1 860 . 1 1 72 72 VAL HG11 H 1 0.994 . . . . . . . A 82 VAL HG11 . 34216 1 861 . 1 1 72 72 VAL HG12 H 1 0.994 . . . . . . . A 82 VAL HG12 . 34216 1 862 . 1 1 72 72 VAL HG13 H 1 0.994 . . . . . . . A 82 VAL HG13 . 34216 1 863 . 1 1 72 72 VAL HG21 H 1 0.994 . . . . . . . A 82 VAL HG21 . 34216 1 864 . 1 1 72 72 VAL HG22 H 1 0.994 . . . . . . . A 82 VAL HG22 . 34216 1 865 . 1 1 72 72 VAL HG23 H 1 0.994 . . . . . . . A 82 VAL HG23 . 34216 1 866 . 1 1 72 72 VAL C C 13 174.384 . . . . . . . A 82 VAL C . 34216 1 867 . 1 1 72 72 VAL CA C 13 62.120 . . . . . . . A 82 VAL CA . 34216 1 868 . 1 1 72 72 VAL CB C 13 34.370 . . . . . . . A 82 VAL CB . 34216 1 869 . 1 1 72 72 VAL CG1 C 13 21.452 . . . . . . . A 82 VAL CG1 . 34216 1 870 . 1 1 72 72 VAL CG2 C 13 21.452 . . . . . . . A 82 VAL CG2 . 34216 1 871 . 1 1 72 72 VAL N N 15 124.965 . . . . . . . A 82 VAL N . 34216 1 872 . 1 1 73 73 LYS H H 1 8.811 . . . . . . . A 83 LYS H . 34216 1 873 . 1 1 73 73 LYS HA H 1 4.840 . . . . . . . A 83 LYS HA . 34216 1 874 . 1 1 73 73 LYS HB2 H 1 1.889 . . . . . . . A 83 LYS HB2 . 34216 1 875 . 1 1 73 73 LYS HB3 H 1 1.690 . . . . . . . A 83 LYS HB3 . 34216 1 876 . 1 1 73 73 LYS HG2 H 1 1.442 . . . . . . . A 83 LYS HG2 . 34216 1 877 . 1 1 73 73 LYS HG3 H 1 1.368 . . . . . . . A 83 LYS HG3 . 34216 1 878 . 1 1 73 73 LYS HD2 H 1 1.678 . . . . . . . A 83 LYS HD2 . 34216 1 879 . 1 1 73 73 LYS HD3 H 1 1.678 . . . . . . . A 83 LYS HD3 . 34216 1 880 . 1 1 73 73 LYS HE2 H 1 2.961 . . . . . . . A 83 LYS HE2 . 34216 1 881 . 1 1 73 73 LYS HE3 H 1 2.965 . . . . . . . A 83 LYS HE3 . 34216 1 882 . 1 1 73 73 LYS C C 13 175.081 . . . . . . . A 83 LYS C . 34216 1 883 . 1 1 73 73 LYS CA C 13 55.022 . . . . . . . A 83 LYS CA . 34216 1 884 . 1 1 73 73 LYS CB C 13 36.697 . . . . . . . A 83 LYS CB . 34216 1 885 . 1 1 73 73 LYS CG C 13 24.453 . . . . . . . A 83 LYS CG . 34216 1 886 . 1 1 73 73 LYS CD C 13 29.206 . . . . . . . A 83 LYS CD . 34216 1 887 . 1 1 73 73 LYS CE C 13 42.195 . . . . . . . A 83 LYS CE . 34216 1 888 . 1 1 73 73 LYS N N 15 124.729 . . . . . . . A 83 LYS N . 34216 1 889 . 1 1 74 74 SER H H 1 8.721 . . . . . . . A 84 SER H . 34216 1 890 . 1 1 74 74 SER HA H 1 4.883 . . . . . . . A 84 SER HA . 34216 1 891 . 1 1 74 74 SER HB2 H 1 4.011 . . . . . . . A 84 SER HB2 . 34216 1 892 . 1 1 74 74 SER HB3 H 1 3.813 . . . . . . . A 84 SER HB3 . 34216 1 893 . 1 1 74 74 SER C C 13 174.094 . . . . . . . A 84 SER C . 34216 1 894 . 1 1 74 74 SER CA C 13 57.488 . . . . . . . A 84 SER CA . 34216 1 895 . 1 1 74 74 SER CB C 13 64.200 . . . . . . . A 84 SER CB . 34216 1 896 . 1 1 74 74 SER N N 15 118.855 . . . . . . . A 84 SER N . 34216 1 897 . 1 1 75 75 GLN H H 1 8.633 . . . . . . . A 85 GLN H . 34216 1 898 . 1 1 75 75 GLN HA H 1 4.375 . . . . . . . A 85 GLN HA . 34216 1 899 . 1 1 75 75 GLN HB2 H 1 2.307 . . . . . . . A 85 GLN HB2 . 34216 1 900 . 1 1 75 75 GLN HB3 H 1 2.307 . . . . . . . A 85 GLN HB3 . 34216 1 901 . 1 1 75 75 GLN HG2 H 1 2.295 . . . . . . . A 85 GLN HG2 . 34216 1 902 . 1 1 75 75 GLN HG3 H 1 2.295 . . . . . . . A 85 GLN HG3 . 34216 1 903 . 1 1 75 75 GLN HE21 H 1 6.691 . . . . . . . A 85 GLN HE21 . 34216 1 904 . 1 1 75 75 GLN HE22 H 1 7.647 . . . . . . . A 85 GLN HE22 . 34216 1 905 . 1 1 75 75 GLN C C 13 177.206 . . . . . . . A 85 GLN C . 34216 1 906 . 1 1 75 75 GLN CA C 13 55.986 . . . . . . . A 85 GLN CA . 34216 1 907 . 1 1 75 75 GLN CB C 13 29.915 . . . . . . . A 85 GLN CB . 34216 1 908 . 1 1 75 75 GLN CG C 13 34.135 . . . . . . . A 85 GLN CG . 34216 1 909 . 1 1 75 75 GLN N N 15 123.362 . . . . . . . A 85 GLN N . 34216 1 910 . 1 1 75 75 GLN NE2 N 15 112.229 . . . . . . . A 85 GLN NE2 . 34216 1 911 . 1 1 76 76 ALA H H 1 8.794 . . . . . . . A 86 ALA H . 34216 1 912 . 1 1 76 76 ALA HA H 1 4.001 . . . . . . . A 86 ALA HA . 34216 1 913 . 1 1 76 76 ALA HB1 H 1 1.403 . . . . . . . A 86 ALA HB1 . 34216 1 914 . 1 1 76 76 ALA HB2 H 1 1.403 . . . . . . . A 86 ALA HB2 . 34216 1 915 . 1 1 76 76 ALA HB3 H 1 1.403 . . . . . . . A 86 ALA HB3 . 34216 1 916 . 1 1 76 76 ALA C C 13 178.331 . . . . . . . A 86 ALA C . 34216 1 917 . 1 1 76 76 ALA CA C 13 55.037 . . . . . . . A 86 ALA CA . 34216 1 918 . 1 1 76 76 ALA CB C 13 18.596 . . . . . . . A 86 ALA CB . 34216 1 919 . 1 1 76 76 ALA N N 15 129.026 . . . . . . . A 86 ALA N . 34216 1 920 . 1 1 77 77 ASP H H 1 8.288 . . . . . . . A 87 ASP H . 34216 1 921 . 1 1 77 77 ASP HA H 1 4.553 . . . . . . . A 87 ASP HA . 34216 1 922 . 1 1 77 77 ASP HB2 H 1 2.830 . . . . . . . A 87 ASP HB2 . 34216 1 923 . 1 1 77 77 ASP HB3 H 1 2.613 . . . . . . . A 87 ASP HB3 . 34216 1 924 . 1 1 77 77 ASP C C 13 176.039 . . . . . . . A 87 ASP C . 34216 1 925 . 1 1 77 77 ASP CA C 13 53.576 . . . . . . . A 87 ASP CA . 34216 1 926 . 1 1 77 77 ASP CB C 13 40.211 . . . . . . . A 87 ASP CB . 34216 1 927 . 1 1 77 77 ASP N N 15 112.147 . . . . . . . A 87 ASP N . 34216 1 928 . 1 1 78 78 ASN H H 1 7.267 . . . . . . . A 88 ASN H . 34216 1 929 . 1 1 78 78 ASN HA H 1 4.814 . . . . . . . A 88 ASN HA . 34216 1 930 . 1 1 78 78 ASN HB2 H 1 2.888 . . . . . . . A 88 ASN HB2 . 34216 1 931 . 1 1 78 78 ASN HB3 H 1 2.669 . . . . . . . A 88 ASN HB3 . 34216 1 932 . 1 1 78 78 ASN HD21 H 1 7.609 . . . . . . . A 88 ASN HD21 . 34216 1 933 . 1 1 78 78 ASN HD22 H 1 6.893 . . . . . . . A 88 ASN HD22 . 34216 1 934 . 1 1 78 78 ASN C C 13 175.488 . . . . . . . A 88 ASN C . 34216 1 935 . 1 1 78 78 ASN CA C 13 53.357 . . . . . . . A 88 ASN CA . 34216 1 936 . 1 1 78 78 ASN CB C 13 38.167 . . . . . . . A 88 ASN CB . 34216 1 937 . 1 1 78 78 ASN N N 15 115.915 . . . . . . . A 88 ASN N . 34216 1 938 . 1 1 78 78 ASN ND2 N 15 112.760 . . . . . . . A 88 ASN ND2 . 34216 1 939 . 1 1 79 79 THR H H 1 8.560 . . . . . . . A 89 THR H . 34216 1 940 . 1 1 79 79 THR HA H 1 4.382 . . . . . . . A 89 THR HA . 34216 1 941 . 1 1 79 79 THR HB H 1 4.547 . . . . . . . A 89 THR HB . 34216 1 942 . 1 1 79 79 THR HG21 H 1 1.363 . . . . . . . A 89 THR HG21 . 34216 1 943 . 1 1 79 79 THR HG22 H 1 1.363 . . . . . . . A 89 THR HG22 . 34216 1 944 . 1 1 79 79 THR HG23 H 1 1.363 . . . . . . . A 89 THR HG23 . 34216 1 945 . 1 1 79 79 THR C C 13 175.964 . . . . . . . A 89 THR C . 34216 1 946 . 1 1 79 79 THR CA C 13 63.508 . . . . . . . A 89 THR CA . 34216 1 947 . 1 1 79 79 THR CB C 13 69.277 . . . . . . . A 89 THR CB . 34216 1 948 . 1 1 79 79 THR CG2 C 13 22.702 . . . . . . . A 89 THR CG2 . 34216 1 949 . 1 1 79 79 THR N N 15 113.500 . . . . . . . A 89 THR N . 34216 1 950 . 1 1 80 80 LYS H H 1 8.134 . . . . . . . A 90 LYS H . 34216 1 951 . 1 1 80 80 LYS HA H 1 4.194 . . . . . . . A 90 LYS HA . 34216 1 952 . 1 1 80 80 LYS HB2 H 1 2.348 . . . . . . . A 90 LYS HB2 . 34216 1 953 . 1 1 80 80 LYS HB3 H 1 1.755 . . . . . . . A 90 LYS HB3 . 34216 1 954 . 1 1 80 80 LYS HG2 H 1 1.535 . . . . . . . A 90 LYS HG2 . 34216 1 955 . 1 1 80 80 LYS HG3 H 1 1.535 . . . . . . . A 90 LYS HG3 . 34216 1 956 . 1 1 80 80 LYS HD2 H 1 1.783 . . . . . . . A 90 LYS HD2 . 34216 1 957 . 1 1 80 80 LYS HD3 H 1 1.783 . . . . . . . A 90 LYS HD3 . 34216 1 958 . 1 1 80 80 LYS HE2 H 1 3.065 . . . . . . . A 90 LYS HE2 . 34216 1 959 . 1 1 80 80 LYS HE3 H 1 3.066 . . . . . . . A 90 LYS HE3 . 34216 1 960 . 1 1 80 80 LYS C C 13 175.275 . . . . . . . A 90 LYS C . 34216 1 961 . 1 1 80 80 LYS CA C 13 57.958 . . . . . . . A 90 LYS CA . 34216 1 962 . 1 1 80 80 LYS CB C 13 32.106 . . . . . . . A 90 LYS CB . 34216 1 963 . 1 1 80 80 LYS CG C 13 26.263 . . . . . . . A 90 LYS CG . 34216 1 964 . 1 1 80 80 LYS CD C 13 29.216 . . . . . . . A 90 LYS CD . 34216 1 965 . 1 1 80 80 LYS CE C 13 42.117 . . . . . . . A 90 LYS CE . 34216 1 966 . 1 1 80 80 LYS N N 15 119.516 . . . . . . . A 90 LYS N . 34216 1 967 . 1 1 81 81 VAL H H 1 7.705 . . . . . . . A 91 VAL H . 34216 1 968 . 1 1 81 81 VAL HA H 1 5.225 . . . . . . . A 91 VAL HA . 34216 1 969 . 1 1 81 81 VAL HB H 1 2.032 . . . . . . . A 91 VAL HB . 34216 1 970 . 1 1 81 81 VAL HG11 H 1 0.917 . . . . . . . A 91 VAL HG11 . 34216 1 971 . 1 1 81 81 VAL HG12 H 1 0.917 . . . . . . . A 91 VAL HG12 . 34216 1 972 . 1 1 81 81 VAL HG13 H 1 0.917 . . . . . . . A 91 VAL HG13 . 34216 1 973 . 1 1 81 81 VAL HG21 H 1 0.917 . . . . . . . A 91 VAL HG21 . 34216 1 974 . 1 1 81 81 VAL HG22 H 1 0.917 . . . . . . . A 91 VAL HG22 . 34216 1 975 . 1 1 81 81 VAL HG23 H 1 0.917 . . . . . . . A 91 VAL HG23 . 34216 1 976 . 1 1 81 81 VAL C C 13 174.766 . . . . . . . A 91 VAL C . 34216 1 977 . 1 1 81 81 VAL CA C 13 61.609 . . . . . . . A 91 VAL CA . 34216 1 978 . 1 1 81 81 VAL CB C 13 34.208 . . . . . . . A 91 VAL CB . 34216 1 979 . 1 1 81 81 VAL CG1 C 13 21.632 . . . . . . . A 91 VAL CG1 . 34216 1 980 . 1 1 81 81 VAL CG2 C 13 21.632 . . . . . . . A 91 VAL CG2 . 34216 1 981 . 1 1 81 81 VAL N N 15 120.004 . . . . . . . A 91 VAL N . 34216 1 982 . 1 1 82 82 LEU H H 1 9.608 . . . . . . . A 92 LEU H . 34216 1 983 . 1 1 82 82 LEU HA H 1 4.872 . . . . . . . A 92 LEU HA . 34216 1 984 . 1 1 82 82 LEU HB2 H 1 2.172 . . . . . . . A 92 LEU HB2 . 34216 1 985 . 1 1 82 82 LEU HB3 H 1 1.391 . . . . . . . A 92 LEU HB3 . 34216 1 986 . 1 1 82 82 LEU HG H 1 1.603 . . . . . . . A 92 LEU HG . 34216 1 987 . 1 1 82 82 LEU HD11 H 1 0.841 . . . . . . . A 92 LEU HD11 . 34216 1 988 . 1 1 82 82 LEU HD12 H 1 0.841 . . . . . . . A 92 LEU HD12 . 34216 1 989 . 1 1 82 82 LEU HD13 H 1 0.841 . . . . . . . A 92 LEU HD13 . 34216 1 990 . 1 1 82 82 LEU HD21 H 1 0.841 . . . . . . . A 92 LEU HD21 . 34216 1 991 . 1 1 82 82 LEU HD22 H 1 0.841 . . . . . . . A 92 LEU HD22 . 34216 1 992 . 1 1 82 82 LEU HD23 H 1 0.841 . . . . . . . A 92 LEU HD23 . 34216 1 993 . 1 1 82 82 LEU C C 13 173.977 . . . . . . . A 92 LEU C . 34216 1 994 . 1 1 82 82 LEU CA C 13 52.968 . . . . . . . A 92 LEU CA . 34216 1 995 . 1 1 82 82 LEU CB C 13 48.492 . . . . . . . A 92 LEU CB . 34216 1 996 . 1 1 82 82 LEU CG C 13 27.245 . . . . . . . A 92 LEU CG . 34216 1 997 . 1 1 82 82 LEU CD1 C 13 24.013 . . . . . . . A 92 LEU CD1 . 34216 1 998 . 1 1 82 82 LEU CD2 C 13 24.009 . . . . . . . A 92 LEU CD2 . 34216 1 999 . 1 1 82 82 LEU N N 15 128.611 . . . . . . . A 92 LEU N . 34216 1 1000 . 1 1 83 83 VAL H H 1 9.338 . . . . . . . A 93 VAL H . 34216 1 1001 . 1 1 83 83 VAL HA H 1 4.860 . . . . . . . A 93 VAL HA . 34216 1 1002 . 1 1 83 83 VAL HB H 1 2.015 . . . . . . . A 93 VAL HB . 34216 1 1003 . 1 1 83 83 VAL HG11 H 1 0.889 . . . . . . . A 93 VAL HG11 . 34216 1 1004 . 1 1 83 83 VAL HG12 H 1 0.889 . . . . . . . A 93 VAL HG12 . 34216 1 1005 . 1 1 83 83 VAL HG13 H 1 0.889 . . . . . . . A 93 VAL HG13 . 34216 1 1006 . 1 1 83 83 VAL HG21 H 1 0.798 . . . . . . . A 93 VAL HG21 . 34216 1 1007 . 1 1 83 83 VAL HG22 H 1 0.798 . . . . . . . A 93 VAL HG22 . 34216 1 1008 . 1 1 83 83 VAL HG23 H 1 0.798 . . . . . . . A 93 VAL HG23 . 34216 1 1009 . 1 1 83 83 VAL C C 13 176.688 . . . . . . . A 93 VAL C . 34216 1 1010 . 1 1 83 83 VAL CA C 13 61.886 . . . . . . . A 93 VAL CA . 34216 1 1011 . 1 1 83 83 VAL CB C 13 32.965 . . . . . . . A 93 VAL CB . 34216 1 1012 . 1 1 83 83 VAL CG1 C 13 20.701 . . . . . . . A 93 VAL CG1 . 34216 1 1013 . 1 1 83 83 VAL CG2 C 13 21.202 . . . . . . . A 93 VAL CG2 . 34216 1 1014 . 1 1 83 83 VAL N N 15 126.846 . . . . . . . A 93 VAL N . 34216 1 1015 . 1 1 84 84 ILE H H 1 9.465 . . . . . . . A 94 ILE H . 34216 1 1016 . 1 1 84 84 ILE HA H 1 5.140 . . . . . . . A 94 ILE HA . 34216 1 1017 . 1 1 84 84 ILE HB H 1 2.001 . . . . . . . A 94 ILE HB . 34216 1 1018 . 1 1 84 84 ILE HG12 H 1 1.387 . . . . . . . A 94 ILE HG12 . 34216 1 1019 . 1 1 84 84 ILE HG13 H 1 1.880 . . . . . . . A 94 ILE HG13 . 34216 1 1020 . 1 1 84 84 ILE HG21 H 1 0.957 . . . . . . . A 94 ILE HG21 . 34216 1 1021 . 1 1 84 84 ILE HG22 H 1 0.957 . . . . . . . A 94 ILE HG22 . 34216 1 1022 . 1 1 84 84 ILE HG23 H 1 0.957 . . . . . . . A 94 ILE HG23 . 34216 1 1023 . 1 1 84 84 ILE HD11 H 1 1.130 . . . . . . . A 94 ILE HD11 . 34216 1 1024 . 1 1 84 84 ILE HD12 H 1 1.130 . . . . . . . A 94 ILE HD12 . 34216 1 1025 . 1 1 84 84 ILE HD13 H 1 1.130 . . . . . . . A 94 ILE HD13 . 34216 1 1026 . 1 1 84 84 ILE C C 13 175.217 . . . . . . . A 94 ILE C . 34216 1 1027 . 1 1 84 84 ILE CA C 13 60.220 . . . . . . . A 94 ILE CA . 34216 1 1028 . 1 1 84 84 ILE CB C 13 41.028 . . . . . . . A 94 ILE CB . 34216 1 1029 . 1 1 84 84 ILE CG1 C 13 28.672 . . . . . . . A 94 ILE CG1 . 34216 1 1030 . 1 1 84 84 ILE CG2 C 13 18.314 . . . . . . . A 94 ILE CG2 . 34216 1 1031 . 1 1 84 84 ILE CD1 C 13 13.976 . . . . . . . A 94 ILE CD1 . 34216 1 1032 . 1 1 84 84 ILE N N 15 130.854 . . . . . . . A 94 ILE N . 34216 1 1033 . 1 1 85 85 THR H H 1 8.863 . . . . . . . A 95 THR H . 34216 1 1034 . 1 1 85 85 THR HA H 1 5.183 . . . . . . . A 95 THR HA . 34216 1 1035 . 1 1 85 85 THR HB H 1 3.964 . . . . . . . A 95 THR HB . 34216 1 1036 . 1 1 85 85 THR HG21 H 1 1.062 . . . . . . . A 95 THR HG21 . 34216 1 1037 . 1 1 85 85 THR HG22 H 1 1.062 . . . . . . . A 95 THR HG22 . 34216 1 1038 . 1 1 85 85 THR HG23 H 1 1.062 . . . . . . . A 95 THR HG23 . 34216 1 1039 . 1 1 85 85 THR C C 13 173.242 . . . . . . . A 95 THR C . 34216 1 1040 . 1 1 85 85 THR CA C 13 61.686 . . . . . . . A 95 THR CA . 34216 1 1041 . 1 1 85 85 THR CB C 13 69.727 . . . . . . . A 95 THR CB . 34216 1 1042 . 1 1 85 85 THR CG2 C 13 20.951 . . . . . . . A 95 THR CG2 . 34216 1 1043 . 1 1 85 85 THR N N 15 123.362 . . . . . . . A 95 THR N . 34216 1 1044 . 1 1 86 86 VAL H H 1 8.931 . . . . . . . A 96 VAL H . 34216 1 1045 . 1 1 86 86 VAL HA H 1 4.652 . . . . . . . A 96 VAL HA . 34216 1 1046 . 1 1 86 86 VAL HB H 1 1.728 . . . . . . . A 96 VAL HB . 34216 1 1047 . 1 1 86 86 VAL HG11 H 1 0.178 . . . . . . . A 96 VAL HG11 . 34216 1 1048 . 1 1 86 86 VAL HG12 H 1 0.178 . . . . . . . A 96 VAL HG12 . 34216 1 1049 . 1 1 86 86 VAL HG13 H 1 0.178 . . . . . . . A 96 VAL HG13 . 34216 1 1050 . 1 1 86 86 VAL HG21 H 1 0.679 . . . . . . . A 96 VAL HG21 . 34216 1 1051 . 1 1 86 86 VAL HG22 H 1 0.679 . . . . . . . A 96 VAL HG22 . 34216 1 1052 . 1 1 86 86 VAL HG23 H 1 0.679 . . . . . . . A 96 VAL HG23 . 34216 1 1053 . 1 1 86 86 VAL C C 13 174.616 . . . . . . . A 96 VAL C . 34216 1 1054 . 1 1 86 86 VAL CA C 13 60.020 . . . . . . . A 96 VAL CA . 34216 1 1055 . 1 1 86 86 VAL CB C 13 36.030 . . . . . . . A 96 VAL CB . 34216 1 1056 . 1 1 86 86 VAL CG1 C 13 21.952 . . . . . . . A 96 VAL CG1 . 34216 1 1057 . 1 1 86 86 VAL CG2 C 13 21.547 . . . . . . . A 96 VAL CG2 . 34216 1 1058 . 1 1 86 86 VAL N N 15 126.681 . . . . . . . A 96 VAL N . 34216 1 1059 . 1 1 87 87 ASN H H 1 8.160 . . . . . . . A 97 ASN H . 34216 1 1060 . 1 1 87 87 ASN HA H 1 4.869 . . . . . . . A 97 ASN HA . 34216 1 1061 . 1 1 87 87 ASN HB2 H 1 2.639 . . . . . . . A 97 ASN HB2 . 34216 1 1062 . 1 1 87 87 ASN HB3 H 1 2.639 . . . . . . . A 97 ASN HB3 . 34216 1 1063 . 1 1 87 87 ASN HD21 H 1 7.451 . . . . . . . A 97 ASN HD21 . 34216 1 1064 . 1 1 87 87 ASN HD22 H 1 7.451 . . . . . . . A 97 ASN HD22 . 34216 1 1065 . 1 1 87 87 ASN C C 13 173.323 . . . . . . . A 97 ASN C . 34216 1 1066 . 1 1 87 87 ASN CA C 13 51.750 . . . . . . . A 97 ASN CA . 34216 1 1067 . 1 1 87 87 ASN CB C 13 37.710 . . . . . . . A 97 ASN CB . 34216 1 1068 . 1 1 87 87 ASN N N 15 125.966 . . . . . . . A 97 ASN N . 34216 1 1069 . 1 1 87 87 ASN ND2 N 15 112.760 . . . . . . . A 97 ASN ND2 . 34216 1 1070 . 1 1 88 88 ASN H H 1 7.985 . . . . . . . A 98 ASN H . 34216 1 1071 . 1 1 88 88 ASN HA H 1 5.338 . . . . . . . A 98 ASN HA . 34216 1 1072 . 1 1 88 88 ASN HB2 H 1 2.917 . . . . . . . A 98 ASN HB2 . 34216 1 1073 . 1 1 88 88 ASN HB3 H 1 2.182 . . . . . . . A 98 ASN HB3 . 34216 1 1074 . 1 1 88 88 ASN HD21 H 1 7.850 . . . . . . . A 98 ASN HD21 . 34216 1 1075 . 1 1 88 88 ASN HD22 H 1 7.137 . . . . . . . A 98 ASN HD22 . 34216 1 1076 . 1 1 88 88 ASN C C 13 173.281 . . . . . . . A 98 ASN C . 34216 1 1077 . 1 1 88 88 ASN CA C 13 51.823 . . . . . . . A 98 ASN CA . 34216 1 1078 . 1 1 88 88 ASN CB C 13 40.211 . . . . . . . A 98 ASN CB . 34216 1 1079 . 1 1 88 88 ASN N N 15 119.992 . . . . . . . A 98 ASN N . 34216 1 1080 . 1 1 88 88 ASN ND2 N 15 110.081 . . . . . . . A 98 ASN ND2 . 34216 1 1081 . 1 1 89 89 PRO HA H 1 4.270 . . . . . . . A 99 PRO HA . 34216 1 1082 . 1 1 89 89 PRO HB2 H 1 2.274 . . . . . . . A 99 PRO HB2 . 34216 1 1083 . 1 1 89 89 PRO HB3 H 1 2.089 . . . . . . . A 99 PRO HB3 . 34216 1 1084 . 1 1 89 89 PRO HG2 H 1 1.933 . . . . . . . A 99 PRO HG2 . 34216 1 1085 . 1 1 89 89 PRO HG3 H 1 1.933 . . . . . . . A 99 PRO HG3 . 34216 1 1086 . 1 1 89 89 PRO HD2 H 1 3.615 . . . . . . . A 99 PRO HD2 . 34216 1 1087 . 1 1 89 89 PRO HD3 H 1 3.784 . . . . . . . A 99 PRO HD3 . 34216 1 1088 . 1 1 89 89 PRO C C 13 175.785 . . . . . . . A 99 PRO C . 34216 1 1089 . 1 1 89 89 PRO CA C 13 62.996 . . . . . . . A 99 PRO CA . 34216 1 1090 . 1 1 89 89 PRO CB C 13 33.958 . . . . . . . A 99 PRO CB . 34216 1 1091 . 1 1 89 89 PRO CG C 13 24.553 . . . . . . . A 99 PRO CG . 34216 1 1092 . 1 1 89 89 PRO CD C 13 50.122 . . . . . . . A 99 PRO CD . 34216 1 1093 . 1 1 90 90 GLN H H 1 7.888 . . . . . . . A 100 GLN H . 34216 1 1094 . 1 1 90 90 GLN HA H 1 4.687 . . . . . . . A 100 GLN HA . 34216 1 1095 . 1 1 90 90 GLN HB2 H 1 2.129 . . . . . . . A 100 GLN HB2 . 34216 1 1096 . 1 1 90 90 GLN HB3 H 1 1.990 . . . . . . . A 100 GLN HB3 . 34216 1 1097 . 1 1 90 90 GLN HG2 H 1 2.336 . . . . . . . A 100 GLN HG2 . 34216 1 1098 . 1 1 90 90 GLN HG3 H 1 2.336 . . . . . . . A 100 GLN HG3 . 34216 1 1099 . 1 1 90 90 GLN C C 13 176.039 . . . . . . . A 100 GLN C . 34216 1 1100 . 1 1 90 90 GLN CA C 13 53.930 . . . . . . . A 100 GLN CA . 34216 1 1101 . 1 1 90 90 GLN CB C 13 27.584 . . . . . . . A 100 GLN CB . 34216 1 1102 . 1 1 90 90 GLN CG C 13 33.724 . . . . . . . A 100 GLN CG . 34216 1 1103 . 1 1 90 90 GLN N N 15 121.600 . . . . . . . A 100 GLN N . 34216 1 1104 . 1 1 91 91 PRO HA H 1 4.721 . . . . . . . A 101 PRO HA . 34216 1 1105 . 1 1 91 91 PRO HB2 H 1 2.072 . . . . . . . A 101 PRO HB2 . 34216 1 1106 . 1 1 91 91 PRO HB3 H 1 1.821 . . . . . . . A 101 PRO HB3 . 34216 1 1107 . 1 1 91 91 PRO HG2 H 1 2.114 . . . . . . . A 101 PRO HG2 . 34216 1 1108 . 1 1 91 91 PRO HG3 H 1 1.993 . . . . . . . A 101 PRO HG3 . 34216 1 1109 . 1 1 91 91 PRO HD2 H 1 3.642 . . . . . . . A 101 PRO HD2 . 34216 1 1110 . 1 1 91 91 PRO HD3 H 1 3.642 . . . . . . . A 101 PRO HD3 . 34216 1 1111 . 1 1 91 91 PRO C C 13 177.579 . . . . . . . A 101 PRO C . 34216 1 1112 . 1 1 91 91 PRO CA C 13 64.152 . . . . . . . A 101 PRO CA . 34216 1 1113 . 1 1 91 91 PRO CB C 13 31.432 . . . . . . . A 101 PRO CB . 34216 1 1114 . 1 1 91 91 PRO CG C 13 27.586 . . . . . . . A 101 PRO CG . 34216 1 1115 . 1 1 91 91 PRO CD C 13 50.551 . . . . . . . A 101 PRO CD . 34216 1 1116 . 1 1 92 92 THR H H 1 9.158 . . . . . . . A 102 THR H . 34216 1 1117 . 1 1 92 92 THR HA H 1 4.417 . . . . . . . A 102 THR HA . 34216 1 1118 . 1 1 92 92 THR HB H 1 3.967 . . . . . . . A 102 THR HB . 34216 1 1119 . 1 1 92 92 THR HG21 H 1 0.943 . . . . . . . A 102 THR HG21 . 34216 1 1120 . 1 1 92 92 THR HG22 H 1 0.943 . . . . . . . A 102 THR HG22 . 34216 1 1121 . 1 1 92 92 THR HG23 H 1 0.943 . . . . . . . A 102 THR HG23 . 34216 1 1122 . 1 1 92 92 THR C C 13 172.506 . . . . . . . A 102 THR C . 34216 1 1123 . 1 1 92 92 THR CA C 13 62.545 . . . . . . . A 102 THR CA . 34216 1 1124 . 1 1 92 92 THR CB C 13 71.815 . . . . . . . A 102 THR CB . 34216 1 1125 . 1 1 92 92 THR CG2 C 13 20.703 . . . . . . . A 102 THR CG2 . 34216 1 1126 . 1 1 92 92 THR N N 15 123.209 . . . . . . . A 102 THR N . 34216 1 1127 . 1 1 93 93 THR H H 1 8.178 . . . . . . . A 103 THR H . 34216 1 1128 . 1 1 93 93 THR HA H 1 4.949 . . . . . . . A 103 THR HA . 34216 1 1129 . 1 1 93 93 THR HB H 1 3.748 . . . . . . . A 103 THR HB . 34216 1 1130 . 1 1 93 93 THR HG21 H 1 1.021 . . . . . . . A 103 THR HG21 . 34216 1 1131 . 1 1 93 93 THR HG22 H 1 1.021 . . . . . . . A 103 THR HG22 . 34216 1 1132 . 1 1 93 93 THR HG23 H 1 1.021 . . . . . . . A 103 THR HG23 . 34216 1 1133 . 1 1 93 93 THR C C 13 173.281 . . . . . . . A 103 THR C . 34216 1 1134 . 1 1 93 93 THR CA C 13 61.755 . . . . . . . A 103 THR CA . 34216 1 1135 . 1 1 93 93 THR CB C 13 70.518 . . . . . . . A 103 THR CB . 34216 1 1136 . 1 1 93 93 THR CG2 C 13 22.452 . . . . . . . A 103 THR CG2 . 34216 1 1137 . 1 1 93 93 THR N N 15 119.065 . . . . . . . A 103 THR N . 34216 1 1138 . 1 1 94 94 TYR H H 1 9.306 . . . . . . . A 104 TYR H . 34216 1 1139 . 1 1 94 94 TYR HA H 1 4.247 . . . . . . . A 104 TYR HA . 34216 1 1140 . 1 1 94 94 TYR HB2 H 1 2.759 . . . . . . . A 104 TYR HB2 . 34216 1 1141 . 1 1 94 94 TYR HB3 H 1 2.393 . . . . . . . A 104 TYR HB3 . 34216 1 1142 . 1 1 94 94 TYR HD1 H 1 6.602 . . . . . . . A 104 TYR HD1 . 34216 1 1143 . 1 1 94 94 TYR HD2 H 1 6.602 . . . . . . . A 104 TYR HD2 . 34216 1 1144 . 1 1 94 94 TYR HE1 H 1 6.630 . . . . . . . A 104 TYR HE1 . 34216 1 1145 . 1 1 94 94 TYR HE2 H 1 6.630 . . . . . . . A 104 TYR HE2 . 34216 1 1146 . 1 1 94 94 TYR C C 13 173.222 . . . . . . . A 104 TYR C . 34216 1 1147 . 1 1 94 94 TYR CA C 13 57.488 . . . . . . . A 104 TYR CA . 34216 1 1148 . 1 1 94 94 TYR CB C 13 41.028 . . . . . . . A 104 TYR CB . 34216 1 1149 . 1 1 94 94 TYR CD1 C 13 133.101 . . . . . . . A 104 TYR CD1 . 34216 1 1150 . 1 1 94 94 TYR CD2 C 13 133.101 . . . . . . . A 104 TYR CD2 . 34216 1 1151 . 1 1 94 94 TYR CE1 C 13 150.360 . . . . . . . A 104 TYR CE1 . 34216 1 1152 . 1 1 94 94 TYR CE2 C 13 150.360 . . . . . . . A 104 TYR CE2 . 34216 1 1153 . 1 1 94 94 TYR N N 15 125.073 . . . . . . . A 104 TYR N . 34216 1 1154 . 1 1 95 95 ASN H H 1 8.262 . . . . . . . A 105 ASN H . 34216 1 1155 . 1 1 95 95 ASN HA H 1 5.353 . . . . . . . A 105 ASN HA . 34216 1 1156 . 1 1 95 95 ASN HB2 H 1 2.694 . . . . . . . A 105 ASN HB2 . 34216 1 1157 . 1 1 95 95 ASN HB3 H 1 2.410 . . . . . . . A 105 ASN HB3 . 34216 1 1158 . 1 1 95 95 ASN HD21 H 1 6.910 . . . . . . . A 105 ASN HD21 . 34216 1 1159 . 1 1 95 95 ASN HD22 H 1 6.453 . . . . . . . A 105 ASN HD22 . 34216 1 1160 . 1 1 95 95 ASN C C 13 173.833 . . . . . . . A 105 ASN C . 34216 1 1161 . 1 1 95 95 ASN CA C 13 52.189 . . . . . . . A 105 ASN CA . 34216 1 1162 . 1 1 95 95 ASN CB C 13 40.431 . . . . . . . A 105 ASN CB . 34216 1 1163 . 1 1 95 95 ASN N N 15 121.548 . . . . . . . A 105 ASN N . 34216 1 1164 . 1 1 95 95 ASN ND2 N 15 111.253 . . . . . . . A 105 ASN ND2 . 34216 1 1165 . 1 1 96 96 PHE H H 1 9.731 . . . . . . . A 106 PHE H . 34216 1 1166 . 1 1 96 96 PHE HA H 1 4.993 . . . . . . . A 106 PHE HA . 34216 1 1167 . 1 1 96 96 PHE HB2 H 1 3.021 . . . . . . . A 106 PHE HB2 . 34216 1 1168 . 1 1 96 96 PHE HB3 H 1 2.065 . . . . . . . A 106 PHE HB3 . 34216 1 1169 . 1 1 96 96 PHE HD1 H 1 6.736 . . . . . . . A 106 PHE HD1 . 34216 1 1170 . 1 1 96 96 PHE HD2 H 1 6.736 . . . . . . . A 106 PHE HD2 . 34216 1 1171 . 1 1 96 96 PHE HE1 H 1 6.869 . . . . . . . A 106 PHE HE1 . 34216 1 1172 . 1 1 96 96 PHE HE2 H 1 6.869 . . . . . . . A 106 PHE HE2 . 34216 1 1173 . 1 1 96 96 PHE C C 13 174.481 . . . . . . . A 106 PHE C . 34216 1 1174 . 1 1 96 96 PHE CA C 13 56.220 . . . . . . . A 106 PHE CA . 34216 1 1175 . 1 1 96 96 PHE CB C 13 42.000 . . . . . . . A 106 PHE CB . 34216 1 1176 . 1 1 96 96 PHE CD1 C 13 131.100 . . . . . . . A 106 PHE CD1 . 34216 1 1177 . 1 1 96 96 PHE CD2 C 13 131.100 . . . . . . . A 106 PHE CD2 . 34216 1 1178 . 1 1 96 96 PHE CE1 C 13 131.100 . . . . . . . A 106 PHE CE1 . 34216 1 1179 . 1 1 96 96 PHE CE2 C 13 131.100 . . . . . . . A 106 PHE CE2 . 34216 1 1180 . 1 1 96 96 PHE N N 15 126.578 . . . . . . . A 106 PHE N . 34216 1 1181 . 1 1 97 97 THR H H 1 9.154 . . . . . . . A 107 THR H . 34216 1 1182 . 1 1 97 97 THR HA H 1 4.720 . . . . . . . A 107 THR HA . 34216 1 1183 . 1 1 97 97 THR HB H 1 3.912 . . . . . . . A 107 THR HB . 34216 1 1184 . 1 1 97 97 THR HG21 H 1 1.065 . . . . . . . A 107 THR HG21 . 34216 1 1185 . 1 1 97 97 THR HG22 H 1 1.065 . . . . . . . A 107 THR HG22 . 34216 1 1186 . 1 1 97 97 THR HG23 H 1 1.065 . . . . . . . A 107 THR HG23 . 34216 1 1187 . 1 1 97 97 THR C C 13 174.616 . . . . . . . A 107 THR C . 34216 1 1188 . 1 1 97 97 THR CA C 13 63.973 . . . . . . . A 107 THR CA . 34216 1 1189 . 1 1 97 97 THR CB C 13 69.216 . . . . . . . A 107 THR CB . 34216 1 1190 . 1 1 97 97 THR CG2 C 13 20.951 . . . . . . . A 107 THR CG2 . 34216 1 1191 . 1 1 97 97 THR N N 15 118.445 . . . . . . . A 107 THR N . 34216 1 1192 . 1 1 98 98 PHE H H 1 9.010 . . . . . . . A 108 PHE H . 34216 1 1193 . 1 1 98 98 PHE HA H 1 4.569 . . . . . . . A 108 PHE HA . 34216 1 1194 . 1 1 98 98 PHE HB2 H 1 3.484 . . . . . . . A 108 PHE HB2 . 34216 1 1195 . 1 1 98 98 PHE HB3 H 1 3.013 . . . . . . . A 108 PHE HB3 . 34216 1 1196 . 1 1 98 98 PHE HD1 H 1 7.365 . . . . . . . A 108 PHE HD1 . 34216 1 1197 . 1 1 98 98 PHE HD2 H 1 7.365 . . . . . . . A 108 PHE HD2 . 34216 1 1198 . 1 1 98 98 PHE HE1 H 1 7.331 . . . . . . . A 108 PHE HE1 . 34216 1 1199 . 1 1 98 98 PHE HE2 H 1 7.331 . . . . . . . A 108 PHE HE2 . 34216 1 1200 . 1 1 98 98 PHE C C 13 175.720 . . . . . . . A 108 PHE C . 34216 1 1201 . 1 1 98 98 PHE CA C 13 57.555 . . . . . . . A 108 PHE CA . 34216 1 1202 . 1 1 98 98 PHE CB C 13 41.495 . . . . . . . A 108 PHE CB . 34216 1 1203 . 1 1 98 98 PHE CD1 C 13 132.100 . . . . . . . A 108 PHE CD1 . 34216 1 1204 . 1 1 98 98 PHE CD2 C 13 132.100 . . . . . . . A 108 PHE CD2 . 34216 1 1205 . 1 1 98 98 PHE CE1 C 13 132.850 . . . . . . . A 108 PHE CE1 . 34216 1 1206 . 1 1 98 98 PHE CE2 C 13 132.850 . . . . . . . A 108 PHE CE2 . 34216 1 1207 . 1 1 98 98 PHE N N 15 128.198 . . . . . . . A 108 PHE N . 34216 1 1208 . 1 1 99 99 LYS H H 1 9.434 . . . . . . . A 109 LYS H . 34216 1 1209 . 1 1 99 99 LYS HA H 1 4.111 . . . . . . . A 109 LYS HA . 34216 1 1210 . 1 1 99 99 LYS HB2 H 1 2.057 . . . . . . . A 109 LYS HB2 . 34216 1 1211 . 1 1 99 99 LYS HB3 H 1 1.964 . . . . . . . A 109 LYS HB3 . 34216 1 1212 . 1 1 99 99 LYS HG2 H 1 1.572 . . . . . . . A 109 LYS HG2 . 34216 1 1213 . 1 1 99 99 LYS HG3 H 1 1.657 . . . . . . . A 109 LYS HG3 . 34216 1 1214 . 1 1 99 99 LYS HD2 H 1 1.780 . . . . . . . A 109 LYS HD2 . 34216 1 1215 . 1 1 99 99 LYS HD3 H 1 1.787 . . . . . . . A 109 LYS HD3 . 34216 1 1216 . 1 1 99 99 LYS HE2 H 1 3.063 . . . . . . . A 109 LYS HE2 . 34216 1 1217 . 1 1 99 99 LYS HE3 H 1 3.063 . . . . . . . A 109 LYS HE3 . 34216 1 1218 . 1 1 99 99 LYS C C 13 176.475 . . . . . . . A 109 LYS C . 34216 1 1219 . 1 1 99 99 LYS CA C 13 58.421 . . . . . . . A 109 LYS CA . 34216 1 1220 . 1 1 99 99 LYS CB C 13 33.098 . . . . . . . A 109 LYS CB . 34216 1 1221 . 1 1 99 99 LYS CG C 13 25.253 . . . . . . . A 109 LYS CG . 34216 1 1222 . 1 1 99 99 LYS CD C 13 29.206 . . . . . . . A 109 LYS CD . 34216 1 1223 . 1 1 99 99 LYS CE C 13 42.195 . . . . . . . A 109 LYS CE . 34216 1 1224 . 1 1 99 99 LYS N N 15 117.604 . . . . . . . A 109 LYS N . 34216 1 1225 . 1 1 100 100 SER H H 1 7.539 . . . . . . . A 110 SER H . 34216 1 1226 . 1 1 100 100 SER HA H 1 4.962 . . . . . . . A 110 SER HA . 34216 1 1227 . 1 1 100 100 SER HB2 H 1 3.946 . . . . . . . A 110 SER HB2 . 34216 1 1228 . 1 1 100 100 SER HB3 H 1 4.267 . . . . . . . A 110 SER HB3 . 34216 1 1229 . 1 1 100 100 SER C C 13 172.326 . . . . . . . A 110 SER C . 34216 1 1230 . 1 1 100 100 SER CA C 13 55.469 . . . . . . . A 110 SER CA . 34216 1 1231 . 1 1 100 100 SER CB C 13 64.474 . . . . . . . A 110 SER CB . 34216 1 1232 . 1 1 100 100 SER N N 15 108.361 . . . . . . . A 110 SER N . 34216 1 1233 . 1 1 101 101 PRO HA H 1 4.494 . . . . . . . A 111 PRO HA . 34216 1 1234 . 1 1 101 101 PRO HB2 H 1 2.361 . . . . . . . A 111 PRO HB2 . 34216 1 1235 . 1 1 101 101 PRO HB3 H 1 1.993 . . . . . . . A 111 PRO HB3 . 34216 1 1236 . 1 1 101 101 PRO HG2 H 1 2.195 . . . . . . . A 111 PRO HG2 . 34216 1 1237 . 1 1 101 101 PRO HG3 H 1 2.195 . . . . . . . A 111 PRO HG3 . 34216 1 1238 . 1 1 101 101 PRO HD2 H 1 4.003 . . . . . . . A 111 PRO HD2 . 34216 1 1239 . 1 1 101 101 PRO HD3 H 1 4.003 . . . . . . . A 111 PRO HD3 . 34216 1 1240 . 1 1 101 101 PRO C C 13 178.500 . . . . . . . A 111 PRO C . 34216 1 1241 . 1 1 101 101 PRO CA C 13 64.822 . . . . . . . A 111 PRO CA . 34216 1 1242 . 1 1 101 101 PRO CB C 13 31.814 . . . . . . . A 111 PRO CB . 34216 1 1243 . 1 1 101 101 PRO CG C 13 28.284 . . . . . . . A 111 PRO CG . 34216 1 1244 . 1 1 101 101 PRO CD C 13 51.210 . . . . . . . A 111 PRO CD . 34216 1 1245 . 1 1 102 102 GLY H H 1 8.506 . . . . . . . A 112 GLY H . 34216 1 1246 . 1 1 102 102 GLY HA2 H 1 3.864 . . . . . . . A 112 GLY HA2 . 34216 1 1247 . 1 1 102 102 GLY HA3 H 1 3.864 . . . . . . . A 112 GLY HA3 . 34216 1 1248 . 1 1 102 102 GLY C C 13 177.164 . . . . . . . A 112 GLY C . 34216 1 1249 . 1 1 102 102 GLY CA C 13 47.004 . . . . . . . A 112 GLY CA . 34216 1 1250 . 1 1 102 102 GLY N N 15 130.367 . . . . . . . A 112 GLY N . 34216 1 1251 . 1 1 103 103 GLU H H 1 7.774 . . . . . . . A 113 GLU H . 34216 1 1252 . 1 1 103 103 GLU HA H 1 4.127 . . . . . . . A 113 GLU HA . 34216 1 1253 . 1 1 103 103 GLU HB2 H 1 2.295 . . . . . . . A 113 GLU HB2 . 34216 1 1254 . 1 1 103 103 GLU HB3 H 1 2.199 . . . . . . . A 113 GLU HB3 . 34216 1 1255 . 1 1 103 103 GLU HG2 H 1 2.333 . . . . . . . A 113 GLU HG2 . 34216 1 1256 . 1 1 103 103 GLU HG3 H 1 2.454 . . . . . . . A 113 GLU HG3 . 34216 1 1257 . 1 1 103 103 GLU C C 13 177.992 . . . . . . . A 113 GLU C . 34216 1 1258 . 1 1 103 103 GLU CA C 13 59.471 . . . . . . . A 113 GLU CA . 34216 1 1259 . 1 1 103 103 GLU CB C 13 30.865 . . . . . . . A 113 GLU CB . 34216 1 1260 . 1 1 103 103 GLU CG C 13 38.210 . . . . . . . A 113 GLU CG . 34216 1 1261 . 1 1 103 103 GLU N N 15 122.112 . . . . . . . A 113 GLU N . 34216 1 1262 . 1 1 104 104 ARG H H 1 7.326 . . . . . . . A 114 ARG H . 34216 1 1263 . 1 1 104 104 ARG HA H 1 2.233 . . . . . . . A 114 ARG HA . 34216 1 1264 . 1 1 104 104 ARG HB2 H 1 1.700 . . . . . . . A 114 ARG HB2 . 34216 1 1265 . 1 1 104 104 ARG HB3 H 1 1.700 . . . . . . . A 114 ARG HB3 . 34216 1 1266 . 1 1 104 104 ARG HG2 H 1 1.387 . . . . . . . A 114 ARG HG2 . 34216 1 1267 . 1 1 104 104 ARG HG3 H 1 1.387 . . . . . . . A 114 ARG HG3 . 34216 1 1268 . 1 1 104 104 ARG HD2 H 1 2.969 . . . . . . . A 114 ARG HD2 . 34216 1 1269 . 1 1 104 104 ARG HD3 H 1 2.969 . . . . . . . A 114 ARG HD3 . 34216 1 1270 . 1 1 104 104 ARG HE H 1 6.596 . . . . . . . A 114 ARG HE . 34216 1 1271 . 1 1 104 104 ARG C C 13 177.928 . . . . . . . A 114 ARG C . 34216 1 1272 . 1 1 104 104 ARG CA C 13 59.471 . . . . . . . A 114 ARG CA . 34216 1 1273 . 1 1 104 104 ARG CB C 13 27.360 . . . . . . . A 114 ARG CB . 34216 1 1274 . 1 1 104 104 ARG CG C 13 27.196 . . . . . . . A 114 ARG CG . 34216 1 1275 . 1 1 104 104 ARG CD C 13 42.131 . . . . . . . A 114 ARG CD . 34216 1 1276 . 1 1 104 104 ARG N N 15 120.835 . . . . . . . A 114 ARG N . 34216 1 1277 . 1 1 104 104 ARG NE N 15 107.737 . . . . . . . A 114 ARG NE . 34216 1 1278 . 1 1 105 105 GLU H H 1 8.776 . . . . . . . A 115 GLU H . 34216 1 1279 . 1 1 105 105 GLU HA H 1 3.817 . . . . . . . A 115 GLU HA . 34216 1 1280 . 1 1 105 105 GLU HB2 H 1 2.120 . . . . . . . A 115 GLU HB2 . 34216 1 1281 . 1 1 105 105 GLU HB3 H 1 2.040 . . . . . . . A 115 GLU HB3 . 34216 1 1282 . 1 1 105 105 GLU HG2 H 1 2.322 . . . . . . . A 115 GLU HG2 . 34216 1 1283 . 1 1 105 105 GLU HG3 H 1 2.237 . . . . . . . A 115 GLU HG3 . 34216 1 1284 . 1 1 105 105 GLU C C 13 179.070 . . . . . . . A 115 GLU C . 34216 1 1285 . 1 1 105 105 GLU CA C 13 59.722 . . . . . . . A 115 GLU CA . 34216 1 1286 . 1 1 105 105 GLU CB C 13 30.033 . . . . . . . A 115 GLU CB . 34216 1 1287 . 1 1 105 105 GLU CG C 13 35.959 . . . . . . . A 115 GLU CG . 34216 1 1288 . 1 1 105 105 GLU N N 15 119.336 . . . . . . . A 115 GLU N . 34216 1 1289 . 1 1 106 106 SER H H 1 7.977 . . . . . . . A 116 SER H . 34216 1 1290 . 1 1 106 106 SER HA H 1 4.278 . . . . . . . A 116 SER HA . 34216 1 1291 . 1 1 106 106 SER HB2 H 1 4.006 . . . . . . . A 116 SER HB2 . 34216 1 1292 . 1 1 106 106 SER HB3 H 1 3.970 . . . . . . . A 116 SER HB3 . 34216 1 1293 . 1 1 106 106 SER C C 13 175.955 . . . . . . . A 116 SER C . 34216 1 1294 . 1 1 106 106 SER CA C 13 61.536 . . . . . . . A 116 SER CA . 34216 1 1295 . 1 1 106 106 SER CB C 13 63.142 . . . . . . . A 116 SER CB . 34216 1 1296 . 1 1 106 106 SER N N 15 113.901 . . . . . . . A 116 SER N . 34216 1 1297 . 1 1 107 107 TRP H H 1 7.908 . . . . . . . A 117 TRP H . 34216 1 1298 . 1 1 107 107 TRP HA H 1 3.953 . . . . . . . A 117 TRP HA . 34216 1 1299 . 1 1 107 107 TRP HB2 H 1 2.910 . . . . . . . A 117 TRP HB2 . 34216 1 1300 . 1 1 107 107 TRP HB3 H 1 2.834 . . . . . . . A 117 TRP HB3 . 34216 1 1301 . 1 1 107 107 TRP HD1 H 1 7.098 . . . . . . . A 117 TRP HD1 . 34216 1 1302 . 1 1 107 107 TRP HE1 H 1 11.056 . . . . . . . A 117 TRP HE1 . 34216 1 1303 . 1 1 107 107 TRP HE3 H 1 6.568 . . . . . . . A 117 TRP HE3 . 34216 1 1304 . 1 1 107 107 TRP HZ2 H 1 6.439 . . . . . . . A 117 TRP HZ2 . 34216 1 1305 . 1 1 107 107 TRP HZ3 H 1 7.008 . . . . . . . A 117 TRP HZ3 . 34216 1 1306 . 1 1 107 107 TRP HH2 H 1 6.604 . . . . . . . A 117 TRP HH2 . 34216 1 1307 . 1 1 107 107 TRP C C 13 178.289 . . . . . . . A 117 TRP C . 34216 1 1308 . 1 1 107 107 TRP CA C 13 63.223 . . . . . . . A 117 TRP CA . 34216 1 1309 . 1 1 107 107 TRP CB C 13 31.084 . . . . . . . A 117 TRP CB . 34216 1 1310 . 1 1 107 107 TRP CD1 C 13 126.097 . . . . . . . A 117 TRP CD1 . 34216 1 1311 . 1 1 107 107 TRP CE3 C 13 152.358 . . . . . . . A 117 TRP CE3 . 34216 1 1312 . 1 1 107 107 TRP CZ2 C 13 124.596 . . . . . . . A 117 TRP CZ2 . 34216 1 1313 . 1 1 107 107 TRP CZ3 C 13 153.361 . . . . . . . A 117 TRP CZ3 . 34216 1 1314 . 1 1 107 107 TRP CH2 C 13 123.596 . . . . . . . A 117 TRP CH2 . 34216 1 1315 . 1 1 107 107 TRP N N 15 124.488 . . . . . . . A 117 TRP N . 34216 1 1316 . 1 1 107 107 TRP NE1 N 15 131.000 . . . . . . . A 117 TRP NE1 . 34216 1 1317 . 1 1 108 108 GLN H H 1 8.838 . . . . . . . A 118 GLN H . 34216 1 1318 . 1 1 108 108 GLN HA H 1 3.819 . . . . . . . A 118 GLN HA . 34216 1 1319 . 1 1 108 108 GLN HB2 H 1 2.314 . . . . . . . A 118 GLN HB2 . 34216 1 1320 . 1 1 108 108 GLN HB3 H 1 2.314 . . . . . . . A 118 GLN HB3 . 34216 1 1321 . 1 1 108 108 GLN HG2 H 1 2.017 . . . . . . . A 118 GLN HG2 . 34216 1 1322 . 1 1 108 108 GLN HG3 H 1 2.017 . . . . . . . A 118 GLN HG3 . 34216 1 1323 . 1 1 108 108 GLN HE21 H 1 7.053 . . . . . . . A 118 GLN HE21 . 34216 1 1324 . 1 1 108 108 GLN HE22 H 1 6.621 . . . . . . . A 118 GLN HE22 . 34216 1 1325 . 1 1 108 108 GLN C C 13 177.908 . . . . . . . A 118 GLN C . 34216 1 1326 . 1 1 108 108 GLN CA C 13 59.721 . . . . . . . A 118 GLN CA . 34216 1 1327 . 1 1 108 108 GLN CB C 13 28.706 . . . . . . . A 118 GLN CB . 34216 1 1328 . 1 1 108 108 GLN CG C 13 32.169 . . . . . . . A 118 GLN CG . 34216 1 1329 . 1 1 108 108 GLN N N 15 117.866 . . . . . . . A 118 GLN N . 34216 1 1330 . 1 1 108 108 GLN NE2 N 15 107.151 . . . . . . . A 118 GLN NE2 . 34216 1 1331 . 1 1 109 109 GLU H H 1 8.026 . . . . . . . A 119 GLU H . 34216 1 1332 . 1 1 109 109 GLU HA H 1 4.018 . . . . . . . A 119 GLU HA . 34216 1 1333 . 1 1 109 109 GLU HB2 H 1 2.172 . . . . . . . A 119 GLU HB2 . 34216 1 1334 . 1 1 109 109 GLU HB3 H 1 2.172 . . . . . . . A 119 GLU HB3 . 34216 1 1335 . 1 1 109 109 GLU HG2 H 1 2.413 . . . . . . . A 119 GLU HG2 . 34216 1 1336 . 1 1 109 109 GLU HG3 H 1 2.225 . . . . . . . A 119 GLU HG3 . 34216 1 1337 . 1 1 109 109 GLU C C 13 179.986 . . . . . . . A 119 GLU C . 34216 1 1338 . 1 1 109 109 GLU CA C 13 59.345 . . . . . . . A 119 GLU CA . 34216 1 1339 . 1 1 109 109 GLU CB C 13 29.206 . . . . . . . A 119 GLU CB . 34216 1 1340 . 1 1 109 109 GLU CG C 13 35.959 . . . . . . . A 119 GLU CG . 34216 1 1341 . 1 1 109 109 GLU N N 15 118.503 . . . . . . . A 119 GLU N . 34216 1 1342 . 1 1 110 110 GLN H H 1 7.988 . . . . . . . A 120 GLN H . 34216 1 1343 . 1 1 110 110 GLN HA H 1 4.048 . . . . . . . A 120 GLN HA . 34216 1 1344 . 1 1 110 110 GLN HB2 H 1 2.036 . . . . . . . A 120 GLN HB2 . 34216 1 1345 . 1 1 110 110 GLN HB3 H 1 2.036 . . . . . . . A 120 GLN HB3 . 34216 1 1346 . 1 1 110 110 GLN HG2 H 1 2.650 . . . . . . . A 120 GLN HG2 . 34216 1 1347 . 1 1 110 110 GLN HG3 H 1 2.650 . . . . . . . A 120 GLN HG3 . 34216 1 1348 . 1 1 110 110 GLN HE21 H 1 7.310 . . . . . . . A 120 GLN HE21 . 34216 1 1349 . 1 1 110 110 GLN HE22 H 1 6.782 . . . . . . . A 120 GLN HE22 . 34216 1 1350 . 1 1 110 110 GLN C C 13 178.246 . . . . . . . A 120 GLN C . 34216 1 1351 . 1 1 110 110 GLN CA C 13 58.471 . . . . . . . A 120 GLN CA . 34216 1 1352 . 1 1 110 110 GLN CB C 13 27.725 . . . . . . . A 120 GLN CB . 34216 1 1353 . 1 1 110 110 GLN CG C 13 33.335 . . . . . . . A 120 GLN CG . 34216 1 1354 . 1 1 110 110 GLN N N 15 118.872 . . . . . . . A 120 GLN N . 34216 1 1355 . 1 1 110 110 GLN NE2 N 15 111.860 . . . . . . . A 120 GLN NE2 . 34216 1 1356 . 1 1 111 111 ILE H H 1 8.907 . . . . . . . A 121 ILE H . 34216 1 1357 . 1 1 111 111 ILE HA H 1 3.837 . . . . . . . A 121 ILE HA . 34216 1 1358 . 1 1 111 111 ILE HB H 1 0.909 . . . . . . . A 121 ILE HB . 34216 1 1359 . 1 1 111 111 ILE HG12 H 1 1.094 . . . . . . . A 121 ILE HG12 . 34216 1 1360 . 1 1 111 111 ILE HG13 H 1 1.093 . . . . . . . A 121 ILE HG13 . 34216 1 1361 . 1 1 111 111 ILE HG21 H 1 1.127 . . . . . . . A 121 ILE HG21 . 34216 1 1362 . 1 1 111 111 ILE HG22 H 1 1.127 . . . . . . . A 121 ILE HG22 . 34216 1 1363 . 1 1 111 111 ILE HG23 H 1 1.127 . . . . . . . A 121 ILE HG23 . 34216 1 1364 . 1 1 111 111 ILE HD11 H 1 0.594 . . . . . . . A 121 ILE HD11 . 34216 1 1365 . 1 1 111 111 ILE HD12 H 1 0.594 . . . . . . . A 121 ILE HD12 . 34216 1 1366 . 1 1 111 111 ILE HD13 H 1 0.594 . . . . . . . A 121 ILE HD13 . 34216 1 1367 . 1 1 111 111 ILE C C 13 176.921 . . . . . . . A 121 ILE C . 34216 1 1368 . 1 1 111 111 ILE CA C 13 61.220 . . . . . . . A 121 ILE CA . 34216 1 1369 . 1 1 111 111 ILE CB C 13 36.030 . . . . . . . A 121 ILE CB . 34216 1 1370 . 1 1 111 111 ILE CG1 C 13 29.710 . . . . . . . A 121 ILE CG1 . 34216 1 1371 . 1 1 111 111 ILE CG2 C 13 19.951 . . . . . . . A 121 ILE CG2 . 34216 1 1372 . 1 1 111 111 ILE CD1 C 13 13.698 . . . . . . . A 121 ILE CD1 . 34216 1 1373 . 1 1 111 111 ILE N N 15 120.761 . . . . . . . A 121 ILE N . 34216 1 1374 . 1 1 112 112 GLN H H 1 7.548 . . . . . . . A 122 GLN H . 34216 1 1375 . 1 1 112 112 GLN HA H 1 4.513 . . . . . . . A 122 GLN HA . 34216 1 1376 . 1 1 112 112 GLN HB2 H 1 2.166 . . . . . . . A 122 GLN HB2 . 34216 1 1377 . 1 1 112 112 GLN HB3 H 1 2.100 . . . . . . . A 122 GLN HB3 . 34216 1 1378 . 1 1 112 112 GLN HG2 H 1 2.690 . . . . . . . A 122 GLN HG2 . 34216 1 1379 . 1 1 112 112 GLN HG3 H 1 2.690 . . . . . . . A 122 GLN HG3 . 34216 1 1380 . 1 1 112 112 GLN HE21 H 1 7.164 . . . . . . . A 122 GLN HE21 . 34216 1 1381 . 1 1 112 112 GLN HE22 H 1 7.099 . . . . . . . A 122 GLN HE22 . 34216 1 1382 . 1 1 112 112 GLN C C 13 179.053 . . . . . . . A 122 GLN C . 34216 1 1383 . 1 1 112 112 GLN CA C 13 58.721 . . . . . . . A 122 GLN CA . 34216 1 1384 . 1 1 112 112 GLN CB C 13 29.039 . . . . . . . A 122 GLN CB . 34216 1 1385 . 1 1 112 112 GLN CG C 13 36.209 . . . . . . . A 122 GLN CG . 34216 1 1386 . 1 1 112 112 GLN N N 15 121.414 . . . . . . . A 122 GLN N . 34216 1 1387 . 1 1 112 112 GLN NE2 N 15 110.862 . . . . . . . A 122 GLN NE2 . 34216 1 1388 . 1 1 113 113 SER H H 1 7.907 . . . . . . . A 123 SER H . 34216 1 1389 . 1 1 113 113 SER HA H 1 4.277 . . . . . . . A 123 SER HA . 34216 1 1390 . 1 1 113 113 SER HB2 H 1 4.270 . . . . . . . A 123 SER HB2 . 34216 1 1391 . 1 1 113 113 SER HB3 H 1 4.088 . . . . . . . A 123 SER HB3 . 34216 1 1392 . 1 1 113 113 SER C C 13 177.063 . . . . . . . A 123 SER C . 34216 1 1393 . 1 1 113 113 SER CA C 13 61.472 . . . . . . . A 123 SER CA . 34216 1 1394 . 1 1 113 113 SER CB C 13 62.558 . . . . . . . A 123 SER CB . 34216 1 1395 . 1 1 113 113 SER N N 15 115.951 . . . . . . . A 123 SER N . 34216 1 1396 . 1 1 114 114 LEU H H 1 8.538 . . . . . . . A 124 LEU H . 34216 1 1397 . 1 1 114 114 LEU HA H 1 3.389 . . . . . . . A 124 LEU HA . 34216 1 1398 . 1 1 114 114 LEU HB2 H 1 1.648 . . . . . . . A 124 LEU HB2 . 34216 1 1399 . 1 1 114 114 LEU HB3 H 1 0.577 . . . . . . . A 124 LEU HB3 . 34216 1 1400 . 1 1 114 114 LEU HG H 1 0.618 . . . . . . . A 124 LEU HG . 34216 1 1401 . 1 1 114 114 LEU HD11 H 1 0.612 . . . . . . . A 124 LEU HD11 . 34216 1 1402 . 1 1 114 114 LEU HD12 H 1 0.612 . . . . . . . A 124 LEU HD12 . 34216 1 1403 . 1 1 114 114 LEU HD13 H 1 0.612 . . . . . . . A 124 LEU HD13 . 34216 1 1404 . 1 1 114 114 LEU HD21 H 1 0.604 . . . . . . . A 124 LEU HD21 . 34216 1 1405 . 1 1 114 114 LEU HD22 H 1 0.604 . . . . . . . A 124 LEU HD22 . 34216 1 1406 . 1 1 114 114 LEU HD23 H 1 0.604 . . . . . . . A 124 LEU HD23 . 34216 1 1407 . 1 1 114 114 LEU C C 13 178.225 . . . . . . . A 124 LEU C . 34216 1 1408 . 1 1 114 114 LEU CA C 13 58.177 . . . . . . . A 124 LEU CA . 34216 1 1409 . 1 1 114 114 LEU CB C 13 40.796 . . . . . . . A 124 LEU CB . 34216 1 1410 . 1 1 114 114 LEU CG C 13 25.954 . . . . . . . A 124 LEU CG . 34216 1 1411 . 1 1 114 114 LEU CD1 C 13 22.952 . . . . . . . A 124 LEU CD1 . 34216 1 1412 . 1 1 114 114 LEU CD2 C 13 22.843 . . . . . . . A 124 LEU CD2 . 34216 1 1413 . 1 1 114 114 LEU N N 15 124.968 . . . . . . . A 124 LEU N . 34216 1 1414 . 1 1 115 115 MET H H 1 8.405 . . . . . . . A 125 MET H . 34216 1 1415 . 1 1 115 115 MET HA H 1 3.543 . . . . . . . A 125 MET HA . 34216 1 1416 . 1 1 115 115 MET HB2 H 1 2.299 . . . . . . . A 125 MET HB2 . 34216 1 1417 . 1 1 115 115 MET HB3 H 1 2.132 . . . . . . . A 125 MET HB3 . 34216 1 1418 . 1 1 115 115 MET HG2 H 1 2.546 . . . . . . . A 125 MET HG2 . 34216 1 1419 . 1 1 115 115 MET HG3 H 1 2.451 . . . . . . . A 125 MET HG3 . 34216 1 1420 . 1 1 115 115 MET HE1 H 1 1.997 . . . . . . . A 125 MET HE1 . 34216 1 1421 . 1 1 115 115 MET HE2 H 1 1.997 . . . . . . . A 125 MET HE2 . 34216 1 1422 . 1 1 115 115 MET HE3 H 1 1.997 . . . . . . . A 125 MET HE3 . 34216 1 1423 . 1 1 115 115 MET C C 13 179.159 . . . . . . . A 125 MET C . 34216 1 1424 . 1 1 115 115 MET CA C 13 59.722 . . . . . . . A 125 MET CA . 34216 1 1425 . 1 1 115 115 MET CB C 13 34.516 . . . . . . . A 125 MET CB . 34216 1 1426 . 1 1 115 115 MET CG C 13 31.207 . . . . . . . A 125 MET CG . 34216 1 1427 . 1 1 115 115 MET CE C 13 47.465 . . . . . . . A 125 MET CE . 34216 1 1428 . 1 1 115 115 MET N N 15 117.683 . . . . . . . A 125 MET N . 34216 1 1429 . 1 1 116 116 LYS H H 1 7.484 . . . . . . . A 126 LYS H . 34216 1 1430 . 1 1 116 116 LYS HA H 1 4.024 . . . . . . . A 126 LYS HA . 34216 1 1431 . 1 1 116 116 LYS HB2 H 1 1.966 . . . . . . . A 126 LYS HB2 . 34216 1 1432 . 1 1 116 116 LYS HB3 H 1 1.966 . . . . . . . A 126 LYS HB3 . 34216 1 1433 . 1 1 116 116 LYS HG2 H 1 1.576 . . . . . . . A 126 LYS HG2 . 34216 1 1434 . 1 1 116 116 LYS HG3 H 1 1.576 . . . . . . . A 126 LYS HG3 . 34216 1 1435 . 1 1 116 116 LYS HD2 H 1 1.715 . . . . . . . A 126 LYS HD2 . 34216 1 1436 . 1 1 116 116 LYS HD3 H 1 1.715 . . . . . . . A 126 LYS HD3 . 34216 1 1437 . 1 1 116 116 LYS HE2 H 1 2.995 . . . . . . . A 126 LYS HE2 . 34216 1 1438 . 1 1 116 116 LYS HE3 H 1 2.995 . . . . . . . A 126 LYS HE3 . 34216 1 1439 . 1 1 116 116 LYS C C 13 179.225 . . . . . . . A 126 LYS C . 34216 1 1440 . 1 1 116 116 LYS CA C 13 59.471 . . . . . . . A 126 LYS CA . 34216 1 1441 . 1 1 116 116 LYS CB C 13 32.252 . . . . . . . A 126 LYS CB . 34216 1 1442 . 1 1 116 116 LYS CG C 13 25.140 . . . . . . . A 126 LYS CG . 34216 1 1443 . 1 1 116 116 LYS CD C 13 29.202 . . . . . . . A 126 LYS CD . 34216 1 1444 . 1 1 116 116 LYS CE C 13 42.301 . . . . . . . A 126 LYS CE . 34216 1 1445 . 1 1 116 116 LYS N N 15 119.003 . . . . . . . A 126 LYS N . 34216 1 1446 . 1 1 117 117 PHE H H 1 8.638 . . . . . . . A 127 PHE H . 34216 1 1447 . 1 1 117 117 PHE HA H 1 4.302 . . . . . . . A 127 PHE HA . 34216 1 1448 . 1 1 117 117 PHE HB2 H 1 3.504 . . . . . . . A 127 PHE HB2 . 34216 1 1449 . 1 1 117 117 PHE HB3 H 1 3.106 . . . . . . . A 127 PHE HB3 . 34216 1 1450 . 1 1 117 117 PHE HD1 H 1 7.236 . . . . . . . A 127 PHE HD1 . 34216 1 1451 . 1 1 117 117 PHE HD2 H 1 7.236 . . . . . . . A 127 PHE HD2 . 34216 1 1452 . 1 1 117 117 PHE HE1 H 1 6.162 . . . . . . . A 127 PHE HE1 . 34216 1 1453 . 1 1 117 117 PHE HE2 H 1 6.162 . . . . . . . A 127 PHE HE2 . 34216 1 1454 . 1 1 117 117 PHE HZ H 1 6.902 . . . . . . . A 127 PHE HZ . 34216 1 1455 . 1 1 117 117 PHE C C 13 178.528 . . . . . . . A 127 PHE C . 34216 1 1456 . 1 1 117 117 PHE CA C 13 61.222 . . . . . . . A 127 PHE CA . 34216 1 1457 . 1 1 117 117 PHE CB C 13 39.895 . . . . . . . A 127 PHE CB . 34216 1 1458 . 1 1 117 117 PHE CD1 C 13 132.350 . . . . . . . A 127 PHE CD1 . 34216 1 1459 . 1 1 117 117 PHE CD2 C 13 132.350 . . . . . . . A 127 PHE CD2 . 34216 1 1460 . 1 1 117 117 PHE CE1 C 13 149.609 . . . . . . . A 127 PHE CE1 . 34216 1 1461 . 1 1 117 117 PHE CE2 C 13 149.609 . . . . . . . A 127 PHE CE2 . 34216 1 1462 . 1 1 117 117 PHE CZ C 13 165.611 . . . . . . . A 127 PHE CZ . 34216 1 1463 . 1 1 117 117 PHE N N 15 122.820 . . . . . . . A 127 PHE N . 34216 1 1464 . 1 1 118 118 MET H H 1 8.616 . . . . . . . A 128 MET H . 34216 1 1465 . 1 1 118 118 MET HA H 1 4.392 . . . . . . . A 128 MET HA . 34216 1 1466 . 1 1 118 118 MET HB2 H 1 2.093 . . . . . . . A 128 MET HB2 . 34216 1 1467 . 1 1 118 118 MET HB3 H 1 1.909 . . . . . . . A 128 MET HB3 . 34216 1 1468 . 1 1 118 118 MET HG2 H 1 2.678 . . . . . . . A 128 MET HG2 . 34216 1 1469 . 1 1 118 118 MET HG3 H 1 2.654 . . . . . . . A 128 MET HG3 . 34216 1 1470 . 1 1 118 118 MET C C 13 177.947 . . . . . . . A 128 MET C . 34216 1 1471 . 1 1 118 118 MET CA C 13 55.022 . . . . . . . A 128 MET CA . 34216 1 1472 . 1 1 118 118 MET CB C 13 30.099 . . . . . . . A 128 MET CB . 34216 1 1473 . 1 1 118 118 MET CG C 13 33.081 . . . . . . . A 128 MET CG . 34216 1 1474 . 1 1 118 118 MET N N 15 115.585 . . . . . . . A 128 MET N . 34216 1 1475 . 1 1 119 119 SER H H 1 7.575 . . . . . . . A 129 SER H . 34216 1 1476 . 1 1 119 119 SER HA H 1 4.398 . . . . . . . A 129 SER HA . 34216 1 1477 . 1 1 119 119 SER HB2 H 1 4.015 . . . . . . . A 129 SER HB2 . 34216 1 1478 . 1 1 119 119 SER HB3 H 1 4.015 . . . . . . . A 129 SER HB3 . 34216 1 1479 . 1 1 119 119 SER C C 13 174.405 . . . . . . . A 129 SER C . 34216 1 1480 . 1 1 119 119 SER CA C 13 59.564 . . . . . . . A 129 SER CA . 34216 1 1481 . 1 1 119 119 SER CB C 13 64.019 . . . . . . . A 129 SER CB . 34216 1 1482 . 1 1 119 119 SER N N 15 114.162 . . . . . . . A 129 SER N . 34216 1 1483 . 1 1 120 120 MET H H 1 7.424 . . . . . . . A 130 MET H . 34216 1 1484 . 1 1 120 120 MET HA H 1 4.424 . . . . . . . A 130 MET HA . 34216 1 1485 . 1 1 120 120 MET HB2 H 1 2.109 . . . . . . . A 130 MET HB2 . 34216 1 1486 . 1 1 120 120 MET HB3 H 1 1.981 . . . . . . . A 130 MET HB3 . 34216 1 1487 . 1 1 120 120 MET HG2 H 1 2.658 . . . . . . . A 130 MET HG2 . 34216 1 1488 . 1 1 120 120 MET HG3 H 1 2.530 . . . . . . . A 130 MET HG3 . 34216 1 1489 . 1 1 120 120 MET C C 13 174.872 . . . . . . . A 130 MET C . 34216 1 1490 . 1 1 120 120 MET CA C 13 55.767 . . . . . . . A 130 MET CA . 34216 1 1491 . 1 1 120 120 MET CB C 13 32.325 . . . . . . . A 130 MET CB . 34216 1 1492 . 1 1 120 120 MET CG C 13 32.207 . . . . . . . A 130 MET CG . 34216 1 1493 . 1 1 120 120 MET N N 15 121.578 . . . . . . . A 130 MET N . 34216 1 1494 . 1 1 121 121 LYS H H 1 7.739 . . . . . . . A 131 LYS H . 34216 1 1495 . 1 1 121 121 LYS HA H 1 4.048 . . . . . . . A 131 LYS HA . 34216 1 1496 . 1 1 121 121 LYS HB2 H 1 1.663 . . . . . . . A 131 LYS HB2 . 34216 1 1497 . 1 1 121 121 LYS HB3 H 1 1.773 . . . . . . . A 131 LYS HB3 . 34216 1 1498 . 1 1 121 121 LYS HG2 H 1 1.351 . . . . . . . A 131 LYS HG2 . 34216 1 1499 . 1 1 121 121 LYS HG3 H 1 1.351 . . . . . . . A 131 LYS HG3 . 34216 1 1500 . 1 1 121 121 LYS HD2 H 1 1.628 . . . . . . . A 131 LYS HD2 . 34216 1 1501 . 1 1 121 121 LYS HD3 H 1 1.628 . . . . . . . A 131 LYS HD3 . 34216 1 1502 . 1 1 121 121 LYS HE2 H 1 2.965 . . . . . . . A 131 LYS HE2 . 34216 1 1503 . 1 1 121 121 LYS HE3 H 1 2.965 . . . . . . . A 131 LYS HE3 . 34216 1 1504 . 1 1 121 121 LYS C C 13 181.217 . . . . . . . A 131 LYS C . 34216 1 1505 . 1 1 121 121 LYS CA C 13 57.739 . . . . . . . A 131 LYS CA . 34216 1 1506 . 1 1 121 121 LYS CB C 13 33.708 . . . . . . . A 131 LYS CB . 34216 1 1507 . 1 1 121 121 LYS CG C 13 24.609 . . . . . . . A 131 LYS CG . 34216 1 1508 . 1 1 121 121 LYS CD C 13 29.202 . . . . . . . A 131 LYS CD . 34216 1 1509 . 1 1 121 121 LYS CE C 13 42.216 . . . . . . . A 131 LYS CE . 34216 1 1510 . 1 1 121 121 LYS N N 15 127.659 . . . . . . . A 131 LYS N . 34216 1 stop_ save_