data_26747 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26747 _Entry.Title ; 1H, 13C, and 15N resonance assignments for human alpha-lactalbumin in its molten globule state ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-02-18 _Entry.Accession_date 2016-02-18 _Entry.Last_release_date 2016-02-18 _Entry.Original_release_date 2016-02-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Lorena Varela . . . . 26747 2 Christina Redfield . . . . 26747 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Oxford' . 26747 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26747 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 484 26747 '15N chemical shifts' 121 26747 '1H chemical shifts' 765 26747 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 . . 2026-09-11 . original BMRB . 26747 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26749 'human alpha-lactalbumin in its urea-denatured state' 26747 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26747 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 41571943 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N resonance assignments for human all-Ala alpha-lactalbumin in its molten globule and urea-denatured states ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 20 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 11 _Citation.Page_last 11 _Citation.Year 2026 _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 Lorena Varela L. . . . 26747 1 2 Lorna Smith L. J. . . 26747 1 3 Christina Redfield C. . . . 26747 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR resonance assignments' 26747 1 alpha-lactalbumin 26747 1 'molten globule state' 26747 1 'urea-denatured state' 26747 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26747 _Assembly.ID 1 _Assembly.Name 'allAla alpha-LA Molten Globule' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 'allAla alpha-LA Molten Globule' 1 $allAla_alpha-LA A . yes 'molten globule' yes no . . . 26747 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_allAla_alpha-LA _Entity.Sf_category entity _Entity.Sf_framecode allAla_alpha-LA _Entity.Entry_ID 26747 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name allAla_alpha-LA _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; KQFTKAELSQLLKDIDGYGG IALPELIATMFHTSGYDTQA IVENNESTEYGLFQISNKLW AKSSQVPQSRNIADISADKF LDDDITDDIMAAKKILDIKG IDYWLAHKALATEKLEQWLA EKL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Differs from wild-type alpha-lactalbumin in that all eight cysteines are replaced by alanine (residues 6, 28, 61, 73, 77, 91, 111, 120). ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 123 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation ; Differs from wild-type alpha-lactalbumin in that all eight cysteines are replaced by alanine (residues 6, 28, 61, 73, 77, 91, 111, 120). ; _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _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 . LYS . 26747 1 2 . GLN . 26747 1 3 . PHE . 26747 1 4 . THR . 26747 1 5 . LYS . 26747 1 6 . ALA . 26747 1 7 . GLU . 26747 1 8 . LEU . 26747 1 9 . SER . 26747 1 10 . GLN . 26747 1 11 . LEU . 26747 1 12 . LEU . 26747 1 13 . LYS . 26747 1 14 . ASP . 26747 1 15 . ILE . 26747 1 16 . ASP . 26747 1 17 . GLY . 26747 1 18 . TYR . 26747 1 19 . GLY . 26747 1 20 . GLY . 26747 1 21 . ILE . 26747 1 22 . ALA . 26747 1 23 . LEU . 26747 1 24 . PRO . 26747 1 25 . GLU . 26747 1 26 . LEU . 26747 1 27 . ILE . 26747 1 28 . ALA . 26747 1 29 . THR . 26747 1 30 . MET . 26747 1 31 . PHE . 26747 1 32 . HIS . 26747 1 33 . THR . 26747 1 34 . SER . 26747 1 35 . GLY . 26747 1 36 . TYR . 26747 1 37 . ASP . 26747 1 38 . THR . 26747 1 39 . GLN . 26747 1 40 . ALA . 26747 1 41 . ILE . 26747 1 42 . VAL . 26747 1 43 . GLU . 26747 1 44 . ASN . 26747 1 45 . ASN . 26747 1 46 . GLU . 26747 1 47 . SER . 26747 1 48 . THR . 26747 1 49 . GLU . 26747 1 50 . TYR . 26747 1 51 . GLY . 26747 1 52 . LEU . 26747 1 53 . PHE . 26747 1 54 . GLN . 26747 1 55 . ILE . 26747 1 56 . SER . 26747 1 57 . ASN . 26747 1 58 . LYS . 26747 1 59 . LEU . 26747 1 60 . TRP . 26747 1 61 . ALA . 26747 1 62 . LYS . 26747 1 63 . SER . 26747 1 64 . SER . 26747 1 65 . GLN . 26747 1 66 . VAL . 26747 1 67 . PRO . 26747 1 68 . GLN . 26747 1 69 . SER . 26747 1 70 . ARG . 26747 1 71 . ASN . 26747 1 72 . ILE . 26747 1 73 . ALA . 26747 1 74 . ASP . 26747 1 75 . ILE . 26747 1 76 . SER . 26747 1 77 . ALA . 26747 1 78 . ASP . 26747 1 79 . LYS . 26747 1 80 . PHE . 26747 1 81 . LEU . 26747 1 82 . ASP . 26747 1 83 . ASP . 26747 1 84 . ASP . 26747 1 85 . ILE . 26747 1 86 . THR . 26747 1 87 . ASP . 26747 1 88 . ASP . 26747 1 89 . ILE . 26747 1 90 . MET . 26747 1 91 . ALA . 26747 1 92 . ALA . 26747 1 93 . LYS . 26747 1 94 . LYS . 26747 1 95 . ILE . 26747 1 96 . LEU . 26747 1 97 . ASP . 26747 1 98 . ILE . 26747 1 99 . LYS . 26747 1 100 . GLY . 26747 1 101 . ILE . 26747 1 102 . ASP . 26747 1 103 . TYR . 26747 1 104 . TRP . 26747 1 105 . LEU . 26747 1 106 . ALA . 26747 1 107 . HIS . 26747 1 108 . LYS . 26747 1 109 . ALA . 26747 1 110 . LEU . 26747 1 111 . ALA . 26747 1 112 . THR . 26747 1 113 . GLU . 26747 1 114 . LYS . 26747 1 115 . LEU . 26747 1 116 . GLU . 26747 1 117 . GLN . 26747 1 118 . TRP . 26747 1 119 . LEU . 26747 1 120 . ALA . 26747 1 121 . GLU . 26747 1 122 . LYS . 26747 1 123 . LEU . 26747 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 . LYS 1 1 26747 1 . GLN 2 2 26747 1 . PHE 3 3 26747 1 . THR 4 4 26747 1 . LYS 5 5 26747 1 . ALA 6 6 26747 1 . GLU 7 7 26747 1 . LEU 8 8 26747 1 . SER 9 9 26747 1 . GLN 10 10 26747 1 . LEU 11 11 26747 1 . LEU 12 12 26747 1 . LYS 13 13 26747 1 . ASP 14 14 26747 1 . ILE 15 15 26747 1 . ASP 16 16 26747 1 . GLY 17 17 26747 1 . TYR 18 18 26747 1 . GLY 19 19 26747 1 . GLY 20 20 26747 1 . ILE 21 21 26747 1 . ALA 22 22 26747 1 . LEU 23 23 26747 1 . PRO 24 24 26747 1 . GLU 25 25 26747 1 . LEU 26 26 26747 1 . ILE 27 27 26747 1 . ALA 28 28 26747 1 . THR 29 29 26747 1 . MET 30 30 26747 1 . PHE 31 31 26747 1 . HIS 32 32 26747 1 . THR 33 33 26747 1 . SER 34 34 26747 1 . GLY 35 35 26747 1 . TYR 36 36 26747 1 . ASP 37 37 26747 1 . THR 38 38 26747 1 . GLN 39 39 26747 1 . ALA 40 40 26747 1 . ILE 41 41 26747 1 . VAL 42 42 26747 1 . GLU 43 43 26747 1 . ASN 44 44 26747 1 . ASN 45 45 26747 1 . GLU 46 46 26747 1 . SER 47 47 26747 1 . THR 48 48 26747 1 . GLU 49 49 26747 1 . TYR 50 50 26747 1 . GLY 51 51 26747 1 . LEU 52 52 26747 1 . PHE 53 53 26747 1 . GLN 54 54 26747 1 . ILE 55 55 26747 1 . SER 56 56 26747 1 . ASN 57 57 26747 1 . LYS 58 58 26747 1 . LEU 59 59 26747 1 . TRP 60 60 26747 1 . ALA 61 61 26747 1 . LYS 62 62 26747 1 . SER 63 63 26747 1 . SER 64 64 26747 1 . GLN 65 65 26747 1 . VAL 66 66 26747 1 . PRO 67 67 26747 1 . GLN 68 68 26747 1 . SER 69 69 26747 1 . ARG 70 70 26747 1 . ASN 71 71 26747 1 . ILE 72 72 26747 1 . ALA 73 73 26747 1 . ASP 74 74 26747 1 . ILE 75 75 26747 1 . SER 76 76 26747 1 . ALA 77 77 26747 1 . ASP 78 78 26747 1 . LYS 79 79 26747 1 . PHE 80 80 26747 1 . LEU 81 81 26747 1 . ASP 82 82 26747 1 . ASP 83 83 26747 1 . ASP 84 84 26747 1 . ILE 85 85 26747 1 . THR 86 86 26747 1 . ASP 87 87 26747 1 . ASP 88 88 26747 1 . ILE 89 89 26747 1 . MET 90 90 26747 1 . ALA 91 91 26747 1 . ALA 92 92 26747 1 . LYS 93 93 26747 1 . LYS 94 94 26747 1 . ILE 95 95 26747 1 . LEU 96 96 26747 1 . ASP 97 97 26747 1 . ILE 98 98 26747 1 . LYS 99 99 26747 1 . GLY 100 100 26747 1 . ILE 101 101 26747 1 . ASP 102 102 26747 1 . TYR 103 103 26747 1 . TRP 104 104 26747 1 . LEU 105 105 26747 1 . ALA 106 106 26747 1 . HIS 107 107 26747 1 . LYS 108 108 26747 1 . ALA 109 109 26747 1 . LEU 110 110 26747 1 . ALA 111 111 26747 1 . THR 112 112 26747 1 . GLU 113 113 26747 1 . LYS 114 114 26747 1 . LEU 115 115 26747 1 . GLU 116 116 26747 1 . GLN 117 117 26747 1 . TRP 118 118 26747 1 . LEU 119 119 26747 1 . ALA 120 120 26747 1 . GLU 121 121 26747 1 . LYS 122 122 26747 1 . LEU 123 123 26747 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 26747 _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 $allAla_alpha-LA . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . ; differs from wild-type alpha-lactalbumin in that all eight cysteines are replaced by alanine (residues 6, 28, 61, 73, 77, 91, 111, 120) ; 26747 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 26747 _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 $allAla_alpha-LA . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-30 . . . 26747 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_15N _Sample.Sf_category sample _Sample.Sf_framecode sample_15N _Sample.Entry_ID 26747 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'allAla alpha-LA' '[U-99% 15N]' . . 1 $allAla_alpha-LA . . 0.3 . . mM . . . . 26747 1 stop_ save_ save_sample_15N_13C _Sample.Sf_category sample _Sample.Sf_framecode sample_15N_13C _Sample.Entry_ID 26747 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'allAla alpha-LA' '[U-99% 13C; U-99% 15N]' . . 1 $allAla_alpha-LA . . 0.3 . . mM . . . . 26747 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_H2O _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_H2O _Sample_condition_list.Entry_ID 26747 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 2 . pH 26747 1 pressure 1 . atm 26747 1 temperature 313 . K 26747 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26747 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26747 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 26747 1 stop_ save_ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 26747 _Software.ID 2 _Software.Type . _Software.Name CcpNmr_Analysis _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 26747 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 26747 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Bruker_Avance_500_MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance_500_MHz _NMR_spectrometer.Entry_ID 26747 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_Omega_750_Mhz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Omega_750_Mhz _NMR_spectrometer.Entry_ID 26747 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Home-built _NMR_spectrometer.Model OMEGA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_Bruker_Avance_750_MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance_750_MHz _NMR_spectrometer.Entry_ID 26747 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 26747 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 Bruker_Avance_500_MHz Bruker Avance . 500 . . . 26747 1 2 Omega_750_Mhz Home-built OMEGA . 750 . . . 26747 1 3 Bruker_Avance_750_MHz Bruker Avance . 750 . . . 26747 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 26747 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_15N isotropic . . 1 $sample_conditions_H2O . . . 2 $Omega_750_Mhz . . . . . . . . . . . . . . . . . 26747 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . . . 1 $sample_15N isotropic . . 1 $sample_conditions_H2O . . . 2 $Omega_750_Mhz . . . . . . . . . . . . . . . . . 26747 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_15N isotropic . . 1 $sample_conditions_H2O . . . 2 $Omega_750_Mhz . . . . . . . . . . . . . . . . . 26747 1 4 '3D HNCA' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 6 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 7 '3D HNCO' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 8 '3D HN(CO)CA' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 11 '2D 1H-15N HSQC' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_500_MHz . . . . . . . . . . . . . . . . . 26747 1 12 '3D H(CCO)NH' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_750_MHz . . . . . . . . . . . . . . . . . 26747 1 13 '3D (H)C(CO)NH' no . . . . . . . . . . . . 2 $sample_15N_13C isotropic . . 1 $sample_conditions_H2O . . . 1 $Bruker_Avance_750_MHz . . . . . . . . . . . . . . . . . 26747 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26747 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.251449530 . . . . . 26747 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . 26747 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . . . 26747 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_MG _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_MG _Assigned_chem_shift_list.Entry_ID 26747 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_H2O _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 estimate _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' . . . 26747 1 2 '3D 1H-15N TOCSY' . . . 26747 1 3 '3D 1H-15N NOESY' . . . 26747 1 4 '3D HNCA' . . . 26747 1 5 '3D CBCA(CO)NH' . . . 26747 1 6 '3D HNCACB' . . . 26747 1 7 '3D HNCO' . . . 26747 1 8 '3D HN(CO)CA' . . . 26747 1 9 '3D HCCH-TOCSY' . . . 26747 1 10 '3D HBHA(CO)NH' . . . 26747 1 11 '2D 1H-15N HSQC' . . . 26747 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $CcpNmr_Analysis . . 26747 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 LYS H H 1 8.461 0.020 . 1 . . . . . 1 LYS H . 26747 1 2 . 1 . 1 1 1 LYS HA H 1 4.356 0.020 . 1 . . . . . 1 LYS HA . 26747 1 3 . 1 . 1 1 1 LYS HB2 H 1 1.707 0.020 . 2 . . . . . 1 LYS HB2 . 26747 1 4 . 1 . 1 1 1 LYS HB3 H 1 1.761 0.020 . 2 . . . . . 1 LYS HB3 . 26747 1 5 . 1 . 1 1 1 LYS HG2 H 1 1.405 0.020 . 2 . . . . . 1 LYS HG2 . 26747 1 6 . 1 . 1 1 1 LYS HG3 H 1 1.369 0.020 . 2 . . . . . 1 LYS HG3 . 26747 1 7 . 1 . 1 1 1 LYS HD2 H 1 1.683 0.020 . 1 . . . . . 1 LYS HD2 . 26747 1 8 . 1 . 1 1 1 LYS HD3 H 1 1.683 0.020 . 1 . . . . . 1 LYS HD3 . 26747 1 9 . 1 . 1 1 1 LYS HE2 H 1 2.983 0.020 . 1 . . . . . 1 LYS HE2 . 26747 1 10 . 1 . 1 1 1 LYS HE3 H 1 2.983 0.020 . 1 . . . . . 1 LYS HE3 . 26747 1 11 . 1 . 1 1 1 LYS C C 13 176.042 0.200 . 1 . . . . . 1 LYS C . 26747 1 12 . 1 . 1 1 1 LYS CA C 13 56.399 0.200 . 1 . . . . . 1 LYS CA . 26747 1 13 . 1 . 1 1 1 LYS CB C 13 33.275 0.200 . 1 . . . . . 1 LYS CB . 26747 1 14 . 1 . 1 1 1 LYS CD C 13 28.945 0.200 . 1 . . . . . 1 LYS CD . 26747 1 15 . 1 . 1 1 1 LYS CE C 13 42.054 0.200 . 1 . . . . . 1 LYS CE . 26747 1 16 . 1 . 1 1 1 LYS CG C 13 24.728 0.200 . 1 . . . . . 1 LYS CG . 26747 1 17 . 1 . 1 1 1 LYS N N 15 120.902 0.200 . 1 . . . . . 1 LYS N . 26747 1 18 . 1 . 1 2 2 GLN C C 13 175.508 0.200 . 1 . . . . . 2 GLN C . 26747 1 19 . 1 . 1 2 2 GLN CA C 13 55.417 0.200 . 1 . . . . . 2 GLN CA . 26747 1 20 . 1 . 1 2 2 GLN CB C 13 29.982 0.200 . 1 . . . . . 2 GLN CB . 26747 1 21 . 1 . 1 2 2 GLN CG C 13 33.692 0.200 . 1 . . . . . 2 GLN CG . 26747 1 22 . 1 . 1 2 2 GLN H H 1 8.292 0.020 . 1 . . . . . 2 GLN H . 26747 1 23 . 1 . 1 2 2 GLN HA H 1 4.369 0.020 . 1 . . . . . 2 GLN HA . 26747 1 24 . 1 . 1 2 2 GLN HB2 H 1 1.935 0.020 . 2 . . . . . 2 GLN HB2 . 26747 1 25 . 1 . 1 2 2 GLN HB3 H 1 2.018 0.020 . 2 . . . . . 2 GLN HB3 . 26747 1 26 . 1 . 1 2 2 GLN HG2 H 1 2.320 0.020 . 1 . . . . . 2 GLN HG2 . 26747 1 27 . 1 . 1 2 2 GLN HG3 H 1 2.320 0.020 . 1 . . . . . 2 GLN HG3 . 26747 1 28 . 1 . 1 2 2 GLN N N 15 121.366 0.200 . 1 . . . . . 2 GLN N . 26747 1 29 . 1 . 1 3 3 PHE C C 13 176.082 0.200 . 1 . . . . . 3 PHE C . 26747 1 30 . 1 . 1 3 3 PHE CA C 13 57.367 0.200 . 1 . . . . . 3 PHE CA . 26747 1 31 . 1 . 1 3 3 PHE CB C 13 40.203 0.200 . 1 . . . . . 3 PHE CB . 26747 1 32 . 1 . 1 3 3 PHE H H 1 8.262 0.020 . 1 . . . . . 3 PHE H . 26747 1 33 . 1 . 1 3 3 PHE HA H 1 4.847 0.020 . 1 . . . . . 3 PHE HA . 26747 1 34 . 1 . 1 3 3 PHE HB2 H 1 2.946 0.020 . 2 . . . . . 3 PHE HB2 . 26747 1 35 . 1 . 1 3 3 PHE HB3 H 1 3.148 0.020 . 2 . . . . . 3 PHE HB3 . 26747 1 36 . 1 . 1 3 3 PHE N N 15 121.777 0.200 . 1 . . . . . 3 PHE N . 26747 1 37 . 1 . 1 4 4 THR C C 13 174.949 0.200 . 1 . . . . . 4 THR C . 26747 1 38 . 1 . 1 4 4 THR CA C 13 60.838 0.200 . 1 . . . . . 4 THR CA . 26747 1 39 . 1 . 1 4 4 THR CB C 13 70.866 0.200 . 1 . . . . . 4 THR CB . 26747 1 40 . 1 . 1 4 4 THR CG2 C 13 21.777 0.200 . 1 . . . . . 4 THR CG2 . 26747 1 41 . 1 . 1 4 4 THR H H 1 7.887 0.020 . 1 . . . . . 4 THR H . 26747 1 42 . 1 . 1 4 4 THR HA H 1 4.486 0.020 . 1 . . . . . 4 THR HA . 26747 1 43 . 1 . 1 4 4 THR HB H 1 4.556 0.020 . 1 . . . . . 4 THR HB . 26747 1 44 . 1 . 1 4 4 THR HG21 H 1 1.286 0.020 . 1 . . . . . 4 THR HG21 . 26747 1 45 . 1 . 1 4 4 THR HG22 H 1 1.286 0.020 . 1 . . . . . 4 THR HG22 . 26747 1 46 . 1 . 1 4 4 THR HG23 H 1 1.286 0.020 . 1 . . . . . 4 THR HG23 . 26747 1 47 . 1 . 1 4 4 THR N N 15 113.802 0.200 . 1 . . . . . 4 THR N . 26747 1 48 . 1 . 1 5 5 LYS C C 13 178.202 0.200 . 1 . . . . . 5 LYS C . 26747 1 49 . 1 . 1 5 5 LYS CA C 13 59.108 0.200 . 1 . . . . . 5 LYS CA . 26747 1 50 . 1 . 1 5 5 LYS CB C 13 32.300 0.200 . 1 . . . . . 5 LYS CB . 26747 1 51 . 1 . 1 5 5 LYS CD C 13 29.182 0.200 . 1 . . . . . 5 LYS CD . 26747 1 52 . 1 . 1 5 5 LYS CE C 13 41.873 0.200 . 1 . . . . . 5 LYS CE . 26747 1 53 . 1 . 1 5 5 LYS CG C 13 25.097 0.200 . 1 . . . . . 5 LYS CG . 26747 1 54 . 1 . 1 5 5 LYS H H 1 8.569 0.020 . 1 . . . . . 5 LYS H . 26747 1 55 . 1 . 1 5 5 LYS HA H 1 4.040 0.020 . 1 . . . . . 5 LYS HA . 26747 1 56 . 1 . 1 5 5 LYS HB2 H 1 1.864 0.020 . 1 . . . . . 5 LYS HB2 . 26747 1 57 . 1 . 1 5 5 LYS HB3 H 1 1.864 0.020 . 1 . . . . . 5 LYS HB3 . 26747 1 58 . 1 . 1 5 5 LYS HD2 H 1 1.730 0.020 . 1 . . . . . 5 LYS HD2 . 26747 1 59 . 1 . 1 5 5 LYS HD3 H 1 1.730 0.020 . 1 . . . . . 5 LYS HD3 . 26747 1 60 . 1 . 1 5 5 LYS HE2 H 1 3.007 0.020 . 1 . . . . . 5 LYS HE2 . 26747 1 61 . 1 . 1 5 5 LYS HE3 H 1 3.007 0.020 . 1 . . . . . 5 LYS HE3 . 26747 1 62 . 1 . 1 5 5 LYS HG2 H 1 1.555 0.020 . 2 . . . . . 5 LYS HG2 . 26747 1 63 . 1 . 1 5 5 LYS HG3 H 1 1.449 0.020 . 2 . . . . . 5 LYS HG3 . 26747 1 64 . 1 . 1 5 5 LYS N N 15 122.101 0.200 . 1 . . . . . 5 LYS N . 26747 1 65 . 1 . 1 6 6 ALA C C 13 179.776 0.200 . 1 . . . . . 6 ALA C . 26747 1 66 . 1 . 1 6 6 ALA CA C 13 54.291 0.200 . 1 . . . . . 6 ALA CA . 26747 1 67 . 1 . 1 6 6 ALA CB C 13 18.698 0.200 . 1 . . . . . 6 ALA CB . 26747 1 68 . 1 . 1 6 6 ALA H H 1 8.231 0.020 . 1 . . . . . 6 ALA H . 26747 1 69 . 1 . 1 6 6 ALA HA H 1 4.211 0.020 . 1 . . . . . 6 ALA HA . 26747 1 70 . 1 . 1 6 6 ALA HB1 H 1 1.425 0.020 . 1 . . . . . 6 ALA HB1 . 26747 1 71 . 1 . 1 6 6 ALA HB2 H 1 1.425 0.020 . 1 . . . . . 6 ALA HB2 . 26747 1 72 . 1 . 1 6 6 ALA HB3 H 1 1.425 0.020 . 1 . . . . . 6 ALA HB3 . 26747 1 73 . 1 . 1 6 6 ALA N N 15 122.246 0.200 . 1 . . . . . 6 ALA N . 26747 1 74 . 1 . 1 7 7 GLU C C 13 178.013 0.200 . 1 . . . . . 7 GLU C . 26747 1 75 . 1 . 1 7 7 GLU CA C 13 57.628 0.200 . 1 . . . . . 7 GLU CA . 26747 1 76 . 1 . 1 7 7 GLU CB C 13 28.698 0.200 . 1 . . . . . 7 GLU CB . 26747 1 77 . 1 . 1 7 7 GLU CG C 13 33.401 0.200 . 1 . . . . . 7 GLU CG . 26747 1 78 . 1 . 1 7 7 GLU H H 1 7.815 0.020 . 1 . . . . . 7 GLU H . 26747 1 79 . 1 . 1 7 7 GLU HA H 1 4.164 0.020 . 1 . . . . . 7 GLU HA . 26747 1 80 . 1 . 1 7 7 GLU HB2 H 1 2.047 0.020 . 2 . . . . . 7 GLU HB2 . 26747 1 81 . 1 . 1 7 7 GLU HB3 H 1 2.188 0.020 . 2 . . . . . 7 GLU HB3 . 26747 1 82 . 1 . 1 7 7 GLU HG2 H 1 2.487 0.020 . 1 . . . . . 7 GLU HG2 . 26747 1 83 . 1 . 1 7 7 GLU HG3 H 1 2.487 0.020 . 1 . . . . . 7 GLU HG3 . 26747 1 84 . 1 . 1 7 7 GLU N N 15 118.515 0.200 . 1 . . . . . 7 GLU N . 26747 1 85 . 1 . 1 8 8 LEU C C 13 178.177 0.200 . 1 . . . . . 8 LEU C . 26747 1 86 . 1 . 1 8 8 LEU CA C 13 57.705 0.200 . 1 . . . . . 8 LEU CA . 26747 1 87 . 1 . 1 8 8 LEU CB C 13 41.778 0.200 . 1 . . . . . 8 LEU CB . 26747 1 88 . 1 . 1 8 8 LEU CD1 C 13 24.209 0.200 . 1 . . . . . 8 LEU CD1 . 26747 1 89 . 1 . 1 8 8 LEU CD2 C 13 24.209 0.200 . 1 . . . . . 8 LEU CD2 . 26747 1 90 . 1 . 1 8 8 LEU CG C 13 26.986 0.200 . 1 . . . . . 8 LEU CG . 26747 1 91 . 1 . 1 8 8 LEU H H 1 8.176 0.020 . 1 . . . . . 8 LEU H . 26747 1 92 . 1 . 1 8 8 LEU HA H 1 4.035 0.020 . 1 . . . . . 8 LEU HA . 26747 1 93 . 1 . 1 8 8 LEU HB2 H 1 1.687 0.020 . 1 . . . . . 8 LEU HB2 . 26747 1 94 . 1 . 1 8 8 LEU HB3 H 1 1.687 0.020 . 1 . . . . . 8 LEU HB3 . 26747 1 95 . 1 . 1 8 8 LEU HD11 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD11 . 26747 1 96 . 1 . 1 8 8 LEU HD12 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD12 . 26747 1 97 . 1 . 1 8 8 LEU HD13 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD13 . 26747 1 98 . 1 . 1 8 8 LEU HD21 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD21 . 26747 1 99 . 1 . 1 8 8 LEU HD22 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD22 . 26747 1 100 . 1 . 1 8 8 LEU HD23 H 1 0.840 0.020 . 1 . . . . . 8 LEU HD23 . 26747 1 101 . 1 . 1 8 8 LEU HG H 1 1.677 0.020 . 1 . . . . . 8 LEU HG . 26747 1 102 . 1 . 1 8 8 LEU N N 15 120.942 0.200 . 1 . . . . . 8 LEU N . 26747 1 103 . 1 . 1 9 9 SER C C 13 176.336 0.200 . 1 . . . . . 9 SER C . 26747 1 104 . 1 . 1 9 9 SER CA C 13 61.458 0.200 . 1 . . . . . 9 SER CA . 26747 1 105 . 1 . 1 9 9 SER CB C 13 62.804 0.200 . 1 . . . . . 9 SER CB . 26747 1 106 . 1 . 1 9 9 SER H H 1 8.175 0.020 . 1 . . . . . 9 SER H . 26747 1 107 . 1 . 1 9 9 SER HA H 1 4.145 0.020 . 1 . . . . . 9 SER HA . 26747 1 108 . 1 . 1 9 9 SER HB2 H 1 3.966 0.020 . 1 . . . . . 9 SER HB2 . 26747 1 109 . 1 . 1 9 9 SER HB3 H 1 3.966 0.020 . 1 . . . . . 9 SER HB3 . 26747 1 110 . 1 . 1 9 9 SER N N 15 113.548 0.200 . 1 . . . . . 9 SER N . 26747 1 111 . 1 . 1 10 10 GLN C C 13 177.465 0.200 . 1 . . . . . 10 GLN C . 26747 1 112 . 1 . 1 10 10 GLN CA C 13 58.069 0.200 . 1 . . . . . 10 GLN CA . 26747 1 113 . 1 . 1 10 10 GLN CB C 13 28.816 0.200 . 1 . . . . . 10 GLN CB . 26747 1 114 . 1 . 1 10 10 GLN CG C 13 33.677 0.200 . 1 . . . . . 10 GLN CG . 26747 1 115 . 1 . 1 10 10 GLN H H 1 7.708 0.020 . 1 . . . . . 10 GLN H . 26747 1 116 . 1 . 1 10 10 GLN HA H 1 4.082 0.020 . 1 . . . . . 10 GLN HA . 26747 1 117 . 1 . 1 10 10 GLN HB2 H 1 2.160 0.020 . 1 . . . . . 10 GLN HB2 . 26747 1 118 . 1 . 1 10 10 GLN HB3 H 1 2.160 0.020 . 1 . . . . . 10 GLN HB3 . 26747 1 119 . 1 . 1 10 10 GLN HG2 H 1 2.426 0.020 . 2 . . . . . 10 GLN HG2 . 26747 1 120 . 1 . 1 10 10 GLN HG3 H 1 2.420 0.020 . 2 . . . . . 10 GLN HG3 . 26747 1 121 . 1 . 1 10 10 GLN N N 15 120.545 0.200 . 1 . . . . . 10 GLN N . 26747 1 122 . 1 . 1 11 11 LEU C C 13 178.495 0.200 . 1 . . . . . 11 LEU C . 26747 1 123 . 1 . 1 11 11 LEU CA C 13 57.540 0.200 . 1 . . . . . 11 LEU CA . 26747 1 124 . 1 . 1 11 11 LEU CB C 13 42.040 0.200 . 1 . . . . . 11 LEU CB . 26747 1 125 . 1 . 1 11 11 LEU H H 1 7.914 0.020 . 1 . . . . . 11 LEU H . 26747 1 126 . 1 . 1 11 11 LEU HA H 1 4.132 0.020 . 1 . . . . . 11 LEU HA . 26747 1 127 . 1 . 1 11 11 LEU HB2 H 1 1.689 0.020 . 1 . . . . . 11 LEU HB2 . 26747 1 128 . 1 . 1 11 11 LEU HB3 H 1 1.689 0.020 . 1 . . . . . 11 LEU HB3 . 26747 1 129 . 1 . 1 11 11 LEU N N 15 120.442 0.200 . 1 . . . . . 11 LEU N . 26747 1 130 . 1 . 1 12 12 LEU C C 13 178.504 0.200 . 1 . . . . . 12 LEU C . 26747 1 131 . 1 . 1 12 12 LEU CA C 13 57.155 0.200 . 1 . . . . . 12 LEU CA . 26747 1 132 . 1 . 1 12 12 LEU CB C 13 41.543 0.200 . 1 . . . . . 12 LEU CB . 26747 1 133 . 1 . 1 12 12 LEU CD1 C 13 23.286 0.200 . 2 . . . . . 12 LEU CD1 . 26747 1 134 . 1 . 1 12 12 LEU CD2 C 13 24.993 0.200 . 2 . . . . . 12 LEU CD2 . 26747 1 135 . 1 . 1 12 12 LEU H H 1 8.002 0.020 . 1 . . . . . 12 LEU H . 26747 1 136 . 1 . 1 12 12 LEU HA H 1 4.056 0.020 . 1 . . . . . 12 LEU HA . 26747 1 137 . 1 . 1 12 12 LEU HB2 H 1 1.551 0.020 . 2 . . . . . 12 LEU HB2 . 26747 1 138 . 1 . 1 12 12 LEU HB3 H 1 1.775 0.020 . 2 . . . . . 12 LEU HB3 . 26747 1 139 . 1 . 1 12 12 LEU HD11 H 1 0.845 0.020 . 2 . . . . . 12 LEU HD11 . 26747 1 140 . 1 . 1 12 12 LEU HD12 H 1 0.845 0.020 . 2 . . . . . 12 LEU HD12 . 26747 1 141 . 1 . 1 12 12 LEU HD13 H 1 0.845 0.020 . 2 . . . . . 12 LEU HD13 . 26747 1 142 . 1 . 1 12 12 LEU HD21 H 1 0.835 0.020 . 2 . . . . . 12 LEU HD21 . 26747 1 143 . 1 . 1 12 12 LEU HD22 H 1 0.835 0.020 . 2 . . . . . 12 LEU HD22 . 26747 1 144 . 1 . 1 12 12 LEU HD23 H 1 0.835 0.020 . 2 . . . . . 12 LEU HD23 . 26747 1 145 . 1 . 1 12 12 LEU N N 15 117.896 0.200 . 1 . . . . . 12 LEU N . 26747 1 146 . 1 . 1 13 13 LYS C C 13 178.179 0.200 . 1 . . . . . 13 LYS C . 26747 1 147 . 1 . 1 13 13 LYS CA C 13 58.445 0.200 . 1 . . . . . 13 LYS CA . 26747 1 148 . 1 . 1 13 13 LYS CB C 13 32.481 0.200 . 1 . . . . . 13 LYS CB . 26747 1 149 . 1 . 1 13 13 LYS CD C 13 29.345 0.200 . 1 . . . . . 13 LYS CD . 26747 1 150 . 1 . 1 13 13 LYS CG C 13 25.187 0.200 . 1 . . . . . 13 LYS CG . 26747 1 151 . 1 . 1 13 13 LYS H H 1 7.676 0.020 . 1 . . . . . 13 LYS H . 26747 1 152 . 1 . 1 13 13 LYS HA H 1 4.121 0.020 . 1 . . . . . 13 LYS HA . 26747 1 153 . 1 . 1 13 13 LYS HB2 H 1 1.879 0.020 . 1 . . . . . 13 LYS HB2 . 26747 1 154 . 1 . 1 13 13 LYS HB3 H 1 1.879 0.020 . 1 . . . . . 13 LYS HB3 . 26747 1 155 . 1 . 1 13 13 LYS N N 15 118.698 0.200 . 1 . . . . . 13 LYS N . 26747 1 156 . 1 . 1 14 14 ASP C C 13 176.624 0.200 . 1 . . . . . 14 ASP C . 26747 1 157 . 1 . 1 14 14 ASP CA C 13 54.724 0.200 . 1 . . . . . 14 ASP CA . 26747 1 158 . 1 . 1 14 14 ASP CB C 13 38.004 0.200 . 1 . . . . . 14 ASP CB . 26747 1 159 . 1 . 1 14 14 ASP H H 1 8.059 0.020 . 1 . . . . . 14 ASP H . 26747 1 160 . 1 . 1 14 14 ASP HA H 1 4.605 0.020 . 1 . . . . . 14 ASP HA . 26747 1 161 . 1 . 1 14 14 ASP HB2 H 1 2.891 0.020 . 2 . . . . . 14 ASP HB2 . 26747 1 162 . 1 . 1 14 14 ASP HB3 H 1 3.057 0.020 . 2 . . . . . 14 ASP HB3 . 26747 1 163 . 1 . 1 14 14 ASP N N 15 117.973 0.200 . 1 . . . . . 14 ASP N . 26747 1 164 . 1 . 1 15 15 ILE C C 13 176.331 0.200 . 1 . . . . . 15 ILE C . 26747 1 165 . 1 . 1 15 15 ILE CA C 13 63.006 0.200 . 1 . . . . . 15 ILE CA . 26747 1 166 . 1 . 1 15 15 ILE CB C 13 38.072 0.200 . 1 . . . . . 15 ILE CB . 26747 1 167 . 1 . 1 15 15 ILE CD1 C 13 13.275 0.200 . 1 . . . . . 15 ILE CD1 . 26747 1 168 . 1 . 1 15 15 ILE CG1 C 13 28.680 0.200 . 1 . . . . . 15 ILE CG1 . 26747 1 169 . 1 . 1 15 15 ILE CG2 C 13 17.597 0.200 . 1 . . . . . 15 ILE CG2 . 26747 1 170 . 1 . 1 15 15 ILE H H 1 7.930 0.020 . 1 . . . . . 15 ILE H . 26747 1 171 . 1 . 1 15 15 ILE HA H 1 4.064 0.020 . 1 . . . . . 15 ILE HA . 26747 1 172 . 1 . 1 15 15 ILE HB H 1 1.932 0.020 . 1 . . . . . 15 ILE HB . 26747 1 173 . 1 . 1 15 15 ILE HD11 H 1 0.882 0.020 . 1 . . . . . 15 ILE HD11 . 26747 1 174 . 1 . 1 15 15 ILE HD12 H 1 0.882 0.020 . 1 . . . . . 15 ILE HD12 . 26747 1 175 . 1 . 1 15 15 ILE HD13 H 1 0.882 0.020 . 1 . . . . . 15 ILE HD13 . 26747 1 176 . 1 . 1 15 15 ILE HG12 H 1 1.538 0.020 . 2 . . . . . 15 ILE HG12 . 26747 1 177 . 1 . 1 15 15 ILE HG13 H 1 1.271 0.020 . 2 . . . . . 15 ILE HG13 . 26747 1 178 . 1 . 1 15 15 ILE HG21 H 1 0.962 0.020 . 1 . . . . . 15 ILE HG21 . 26747 1 179 . 1 . 1 15 15 ILE HG22 H 1 0.962 0.020 . 1 . . . . . 15 ILE HG22 . 26747 1 180 . 1 . 1 15 15 ILE HG23 H 1 0.962 0.020 . 1 . . . . . 15 ILE HG23 . 26747 1 181 . 1 . 1 15 15 ILE N N 15 118.362 0.200 . 1 . . . . . 15 ILE N . 26747 1 182 . 1 . 1 16 16 ASP C C 13 176.077 0.200 . 1 . . . . . 16 ASP C . 26747 1 183 . 1 . 1 16 16 ASP CA C 13 53.993 0.200 . 1 . . . . . 16 ASP CA . 26747 1 184 . 1 . 1 16 16 ASP CB C 13 38.387 0.200 . 1 . . . . . 16 ASP CB . 26747 1 185 . 1 . 1 16 16 ASP H H 1 8.159 0.020 . 1 . . . . . 16 ASP H . 26747 1 186 . 1 . 1 16 16 ASP HA H 1 4.673 0.020 . 1 . . . . . 16 ASP HA . 26747 1 187 . 1 . 1 16 16 ASP HB2 H 1 2.918 0.020 . 1 . . . . . 16 ASP HB2 . 26747 1 188 . 1 . 1 16 16 ASP HB3 H 1 2.918 0.020 . 1 . . . . . 16 ASP HB3 . 26747 1 189 . 1 . 1 16 16 ASP N N 15 119.177 0.200 . 1 . . . . . 16 ASP N . 26747 1 190 . 1 . 1 17 17 GLY C C 13 174.295 0.200 . 1 . . . . . 17 GLY C . 26747 1 191 . 1 . 1 17 17 GLY CA C 13 45.667 0.200 . 1 . . . . . 17 GLY CA . 26747 1 192 . 1 . 1 17 17 GLY H H 1 8.006 0.020 . 1 . . . . . 17 GLY H . 26747 1 193 . 1 . 1 17 17 GLY HA2 H 1 3.941 0.020 . 1 . . . . . 17 GLY HA2 . 26747 1 194 . 1 . 1 17 17 GLY HA3 H 1 3.941 0.020 . 1 . . . . . 17 GLY HA3 . 26747 1 195 . 1 . 1 17 17 GLY N N 15 107.801 0.200 . 1 . . . . . 17 GLY N . 26747 1 196 . 1 . 1 18 18 TYR C C 13 176.397 0.200 . 1 . . . . . 18 TYR C . 26747 1 197 . 1 . 1 18 18 TYR CA C 13 58.557 0.200 . 1 . . . . . 18 TYR CA . 26747 1 198 . 1 . 1 18 18 TYR CB C 13 38.624 0.200 . 1 . . . . . 18 TYR CB . 26747 1 199 . 1 . 1 18 18 TYR H H 1 7.943 0.020 . 1 . . . . . 18 TYR H . 26747 1 200 . 1 . 1 18 18 TYR HA H 1 4.552 0.020 . 1 . . . . . 18 TYR HA . 26747 1 201 . 1 . 1 18 18 TYR HB2 H 1 3.114 0.020 . 2 . . . . . 18 TYR HB2 . 26747 1 202 . 1 . 1 18 18 TYR HB3 H 1 2.984 0.020 . 2 . . . . . 18 TYR HB3 . 26747 1 203 . 1 . 1 18 18 TYR N N 15 119.876 0.200 . 1 . . . . . 18 TYR N . 26747 1 204 . 1 . 1 19 19 GLY C C 13 174.612 0.200 . 1 . . . . . 19 GLY C . 26747 1 205 . 1 . 1 19 19 GLY CA C 13 45.748 0.200 . 1 . . . . . 19 GLY CA . 26747 1 206 . 1 . 1 19 19 GLY H H 1 8.207 0.020 . 1 . . . . . 19 GLY H . 26747 1 207 . 1 . 1 19 19 GLY HA2 H 1 3.917 0.020 . 1 . . . . . 19 GLY HA2 . 26747 1 208 . 1 . 1 19 19 GLY HA3 H 1 3.917 0.020 . 1 . . . . . 19 GLY HA3 . 26747 1 209 . 1 . 1 19 19 GLY N N 15 109.752 0.200 . 1 . . . . . 19 GLY N . 26747 1 210 . 1 . 1 20 20 GLY C C 13 174.139 0.200 . 1 . . . . . 20 GLY C . 26747 1 211 . 1 . 1 20 20 GLY CA C 13 45.735 0.200 . 1 . . . . . 20 GLY CA . 26747 1 212 . 1 . 1 20 20 GLY H H 1 7.885 0.020 . 1 . . . . . 20 GLY H . 26747 1 213 . 1 . 1 20 20 GLY HA2 H 1 3.953 0.020 . 1 . . . . . 20 GLY HA2 . 26747 1 214 . 1 . 1 20 20 GLY HA3 H 1 3.953 0.020 . 1 . . . . . 20 GLY HA3 . 26747 1 215 . 1 . 1 20 20 GLY N N 15 107.831 0.200 . 1 . . . . . 20 GLY N . 26747 1 216 . 1 . 1 21 21 ILE C C 13 175.355 0.200 . 1 . . . . . 21 ILE C . 26747 1 217 . 1 . 1 21 21 ILE CA C 13 61.107 0.200 . 1 . . . . . 21 ILE CA . 26747 1 218 . 1 . 1 21 21 ILE CB C 13 39.100 0.200 . 1 . . . . . 21 ILE CB . 26747 1 219 . 1 . 1 21 21 ILE CD1 C 13 13.306 0.200 . 1 . . . . . 21 ILE CD1 . 26747 1 220 . 1 . 1 21 21 ILE CG1 C 13 27.463 0.200 . 1 . . . . . 21 ILE CG1 . 26747 1 221 . 1 . 1 21 21 ILE CG2 C 13 17.545 0.200 . 1 . . . . . 21 ILE CG2 . 26747 1 222 . 1 . 1 21 21 ILE H H 1 7.702 0.020 . 1 . . . . . 21 ILE H . 26747 1 223 . 1 . 1 21 21 ILE HA H 1 4.206 0.020 . 1 . . . . . 21 ILE HA . 26747 1 224 . 1 . 1 21 21 ILE HB H 1 1.875 0.020 . 1 . . . . . 21 ILE HB . 26747 1 225 . 1 . 1 21 21 ILE HD11 H 1 0.853 0.020 . 1 . . . . . 21 ILE HD11 . 26747 1 226 . 1 . 1 21 21 ILE HD12 H 1 0.853 0.020 . 1 . . . . . 21 ILE HD12 . 26747 1 227 . 1 . 1 21 21 ILE HD13 H 1 0.853 0.020 . 1 . . . . . 21 ILE HD13 . 26747 1 228 . 1 . 1 21 21 ILE HG12 H 1 1.199 0.020 . 2 . . . . . 21 ILE HG12 . 26747 1 229 . 1 . 1 21 21 ILE HG13 H 1 1.476 0.020 . 2 . . . . . 21 ILE HG13 . 26747 1 230 . 1 . 1 21 21 ILE HG21 H 1 0.912 0.020 . 1 . . . . . 21 ILE HG21 . 26747 1 231 . 1 . 1 21 21 ILE HG22 H 1 0.912 0.020 . 1 . . . . . 21 ILE HG22 . 26747 1 232 . 1 . 1 21 21 ILE HG23 H 1 0.912 0.020 . 1 . . . . . 21 ILE HG23 . 26747 1 233 . 1 . 1 21 21 ILE N N 15 118.776 0.200 . 1 . . . . . 21 ILE N . 26747 1 234 . 1 . 1 22 22 ALA C C 13 177.819 0.200 . 1 . . . . . 22 ALA C . 26747 1 235 . 1 . 1 22 22 ALA CA C 13 52.448 0.200 . 1 . . . . . 22 ALA CA . 26747 1 236 . 1 . 1 22 22 ALA CB C 13 19.461 0.200 . 1 . . . . . 22 ALA CB . 26747 1 237 . 1 . 1 22 22 ALA H H 1 8.123 0.020 . 1 . . . . . 22 ALA H . 26747 1 238 . 1 . 1 22 22 ALA HA H 1 4.407 0.020 . 1 . . . . . 22 ALA HA . 26747 1 239 . 1 . 1 22 22 ALA HB1 H 1 1.422 0.020 . 1 . . . . . 22 ALA HB1 . 26747 1 240 . 1 . 1 22 22 ALA HB2 H 1 1.422 0.020 . 1 . . . . . 22 ALA HB2 . 26747 1 241 . 1 . 1 22 22 ALA HB3 H 1 1.422 0.020 . 1 . . . . . 22 ALA HB3 . 26747 1 242 . 1 . 1 22 22 ALA N N 15 126.338 0.200 . 1 . . . . . 22 ALA N . 26747 1 243 . 1 . 1 23 23 LEU C C 13 175.122 0.200 . 1 . . . . . 23 LEU C . 26747 1 244 . 1 . 1 23 23 LEU CA C 13 57.582 0.200 . 1 . . . . . 23 LEU CA . 26747 1 245 . 1 . 1 23 23 LEU CB C 13 40.116 0.200 . 1 . . . . . 23 LEU CB . 26747 1 246 . 1 . 1 23 23 LEU CD1 C 13 24.611 0.200 . 1 . . . . . 23 LEU CD1 . 26747 1 247 . 1 . 1 23 23 LEU H H 1 8.205 0.020 . 1 . . . . . 23 LEU H . 26747 1 248 . 1 . 1 23 23 LEU HA H 1 4.283 0.020 . 1 . . . . . 23 LEU HA . 26747 1 249 . 1 . 1 23 23 LEU HB2 H 1 1.696 0.020 . 1 . . . . . 23 LEU HB2 . 26747 1 250 . 1 . 1 23 23 LEU HB3 H 1 1.697 0.020 . 1 . . . . . 23 LEU HB3 . 26747 1 251 . 1 . 1 23 23 LEU HD11 H 1 0.892 0.020 . 2 . . . . . 23 LEU HD11 . 26747 1 252 . 1 . 1 23 23 LEU HD12 H 1 0.892 0.020 . 2 . . . . . 23 LEU HD12 . 26747 1 253 . 1 . 1 23 23 LEU HD13 H 1 0.892 0.020 . 2 . . . . . 23 LEU HD13 . 26747 1 254 . 1 . 1 23 23 LEU HD21 H 1 0.914 0.020 . 2 . . . . . 23 LEU HD21 . 26747 1 255 . 1 . 1 23 23 LEU HD22 H 1 0.914 0.020 . 2 . . . . . 23 LEU HD22 . 26747 1 256 . 1 . 1 23 23 LEU HD23 H 1 0.914 0.020 . 2 . . . . . 23 LEU HD23 . 26747 1 257 . 1 . 1 23 23 LEU HG H 1 1.642 0.020 . 1 . . . . . 23 LEU HG . 26747 1 258 . 1 . 1 23 23 LEU N N 15 121.201 0.200 . 1 . . . . . 23 LEU N . 26747 1 259 . 1 . 1 24 24 PRO C C 13 178.348 0.200 . 1 . . . . . 24 PRO C . 26747 1 260 . 1 . 1 24 24 PRO CA C 13 65.841 0.200 . 1 . . . . . 24 PRO CA . 26747 1 261 . 1 . 1 24 24 PRO CB C 13 31.222 0.200 . 1 . . . . . 24 PRO CB . 26747 1 262 . 1 . 1 24 24 PRO CD C 13 50.035 0.200 . 1 . . . . . 24 PRO CD . 26747 1 263 . 1 . 1 24 24 PRO CG C 13 28.188 0.200 . 1 . . . . . 24 PRO CG . 26747 1 264 . 1 . 1 24 24 PRO HA H 1 4.179 0.020 . 1 . . . . . 24 PRO HA . 26747 1 265 . 1 . 1 24 24 PRO HB2 H 1 1.837 0.020 . 2 . . . . . 24 PRO HB2 . 26747 1 266 . 1 . 1 24 24 PRO HB3 H 1 2.270 0.020 . 2 . . . . . 24 PRO HB3 . 26747 1 267 . 1 . 1 24 24 PRO HD2 H 1 3.699 0.020 . 2 . . . . . 24 PRO HD2 . 26747 1 268 . 1 . 1 24 24 PRO HD3 H 1 3.671 0.020 . 2 . . . . . 24 PRO HD3 . 26747 1 269 . 1 . 1 24 24 PRO HG2 H 1 2.130 0.020 . 2 . . . . . 24 PRO HG2 . 26747 1 270 . 1 . 1 24 24 PRO HG3 H 1 1.896 0.020 . 2 . . . . . 24 PRO HG3 . 26747 1 271 . 1 . 1 25 25 GLU C C 13 177.930 0.200 . 1 . . . . . 25 GLU C . 26747 1 272 . 1 . 1 25 25 GLU CA C 13 58.300 0.200 . 1 . . . . . 25 GLU CA . 26747 1 273 . 1 . 1 25 25 GLU CB C 13 28.123 0.200 . 1 . . . . . 25 GLU CB . 26747 1 274 . 1 . 1 25 25 GLU CG C 13 33.213 0.200 . 1 . . . . . 25 GLU CG . 26747 1 275 . 1 . 1 25 25 GLU H H 1 7.621 0.020 . 1 . . . . . 25 GLU H . 26747 1 276 . 1 . 1 25 25 GLU HA H 1 4.167 0.020 . 1 . . . . . 25 GLU HA . 26747 1 277 . 1 . 1 25 25 GLU HB2 H 1 2.111 0.020 . 2 . . . . . 25 GLU HB2 . 26747 1 278 . 1 . 1 25 25 GLU HB3 H 1 2.180 0.020 . 2 . . . . . 25 GLU HB3 . 26747 1 279 . 1 . 1 25 25 GLU HG2 H 1 2.493 0.020 . 1 . . . . . 25 GLU HG2 . 26747 1 280 . 1 . 1 25 25 GLU HG3 H 1 2.493 0.020 . 1 . . . . . 25 GLU HG3 . 26747 1 281 . 1 . 1 25 25 GLU N N 15 116.623 0.200 . 1 . . . . . 25 GLU N . 26747 1 282 . 1 . 1 26 26 LEU C C 13 178.619 0.200 . 1 . . . . . 26 LEU C . 26747 1 283 . 1 . 1 26 26 LEU CA C 13 57.774 0.200 . 1 . . . . . 26 LEU CA . 26747 1 284 . 1 . 1 26 26 LEU CB C 13 42.125 0.200 . 1 . . . . . 26 LEU CB . 26747 1 285 . 1 . 1 26 26 LEU CD1 C 13 24.669 0.200 . 1 . . . . . 26 LEU CD1 . 26747 1 286 . 1 . 1 26 26 LEU CD2 C 13 24.669 0.200 . 1 . . . . . 26 LEU CD2 . 26747 1 287 . 1 . 1 26 26 LEU CG C 13 27.015 0.200 . 1 . . . . . 26 LEU CG . 26747 1 288 . 1 . 1 26 26 LEU H H 1 8.036 0.020 . 1 . . . . . 26 LEU H . 26747 1 289 . 1 . 1 26 26 LEU HA H 1 4.095 0.020 . 1 . . . . . 26 LEU HA . 26747 1 290 . 1 . 1 26 26 LEU HB2 H 1 1.710 0.020 . 1 . . . . . 26 LEU HB2 . 26747 1 291 . 1 . 1 26 26 LEU HB3 H 1 1.710 0.020 . 1 . . . . . 26 LEU HB3 . 26747 1 292 . 1 . 1 26 26 LEU HD11 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD11 . 26747 1 293 . 1 . 1 26 26 LEU HD12 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD12 . 26747 1 294 . 1 . 1 26 26 LEU HD13 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD13 . 26747 1 295 . 1 . 1 26 26 LEU HD21 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD21 . 26747 1 296 . 1 . 1 26 26 LEU HD22 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD22 . 26747 1 297 . 1 . 1 26 26 LEU HD23 H 1 0.837 0.020 . 1 . . . . . 26 LEU HD23 . 26747 1 298 . 1 . 1 26 26 LEU HG H 1 1.608 0.020 . 1 . . . . . 26 LEU HG . 26747 1 299 . 1 . 1 26 26 LEU N N 15 122.104 0.200 . 1 . . . . . 26 LEU N . 26747 1 300 . 1 . 1 27 27 ILE C C 13 177.256 0.200 . 1 . . . . . 27 ILE C . 26747 1 301 . 1 . 1 27 27 ILE CA C 13 63.854 0.200 . 1 . . . . . 27 ILE CA . 26747 1 302 . 1 . 1 27 27 ILE CB C 13 37.792 0.200 . 1 . . . . . 27 ILE CB . 26747 1 303 . 1 . 1 27 27 ILE CD1 C 13 12.395 0.200 . 1 . . . . . 27 ILE CD1 . 26747 1 304 . 1 . 1 27 27 ILE CG1 C 13 28.636 0.200 . 1 . . . . . 27 ILE CG1 . 26747 1 305 . 1 . 1 27 27 ILE CG2 C 13 17.674 0.200 . 1 . . . . . 27 ILE CG2 . 26747 1 306 . 1 . 1 27 27 ILE H H 1 8.043 0.020 . 1 . . . . . 27 ILE H . 26747 1 307 . 1 . 1 27 27 ILE HA H 1 3.711 0.020 . 1 . . . . . 27 ILE HA . 26747 1 308 . 1 . 1 27 27 ILE HB H 1 1.890 0.020 . 1 . . . . . 27 ILE HB . 26747 1 309 . 1 . 1 27 27 ILE HD11 H 1 0.745 0.020 . 1 . . . . . 27 ILE HD11 . 26747 1 310 . 1 . 1 27 27 ILE HD12 H 1 0.745 0.020 . 1 . . . . . 27 ILE HD12 . 26747 1 311 . 1 . 1 27 27 ILE HD13 H 1 0.745 0.020 . 1 . . . . . 27 ILE HD13 . 26747 1 312 . 1 . 1 27 27 ILE HG12 H 1 1.170 0.020 . 2 . . . . . 27 ILE HG12 . 26747 1 313 . 1 . 1 27 27 ILE HG13 H 1 1.542 0.020 . 2 . . . . . 27 ILE HG13 . 26747 1 314 . 1 . 1 27 27 ILE HG21 H 1 0.842 0.020 . 1 . . . . . 27 ILE HG21 . 26747 1 315 . 1 . 1 27 27 ILE HG22 H 1 0.842 0.020 . 1 . . . . . 27 ILE HG22 . 26747 1 316 . 1 . 1 27 27 ILE HG23 H 1 0.842 0.020 . 1 . . . . . 27 ILE HG23 . 26747 1 317 . 1 . 1 27 27 ILE N N 15 118.600 0.200 . 1 . . . . . 27 ILE N . 26747 1 318 . 1 . 1 28 28 ALA C C 13 179.696 0.200 . 1 . . . . . 28 ALA C . 26747 1 319 . 1 . 1 28 28 ALA CA C 13 54.941 0.200 . 1 . . . . . 28 ALA CA . 26747 1 320 . 1 . 1 28 28 ALA CB C 13 18.638 0.200 . 1 . . . . . 28 ALA CB . 26747 1 321 . 1 . 1 28 28 ALA H H 1 7.897 0.020 . 1 . . . . . 28 ALA H . 26747 1 322 . 1 . 1 28 28 ALA HA H 1 4.148 0.020 . 1 . . . . . 28 ALA HA . 26747 1 323 . 1 . 1 28 28 ALA HB1 H 1 1.484 0.020 . 1 . . . . . 28 ALA HB1 . 26747 1 324 . 1 . 1 28 28 ALA HB2 H 1 1.484 0.020 . 1 . . . . . 28 ALA HB2 . 26747 1 325 . 1 . 1 28 28 ALA HB3 H 1 1.484 0.020 . 1 . . . . . 28 ALA HB3 . 26747 1 326 . 1 . 1 28 28 ALA N N 15 121.472 0.200 . 1 . . . . . 28 ALA N . 26747 1 327 . 1 . 1 29 29 THR C C 13 176.010 0.200 . 1 . . . . . 29 THR C . 26747 1 328 . 1 . 1 29 29 THR CA C 13 64.917 0.200 . 1 . . . . . 29 THR CA . 26747 1 329 . 1 . 1 29 29 THR CB C 13 69.231 0.200 . 1 . . . . . 29 THR CB . 26747 1 330 . 1 . 1 29 29 THR CG2 C 13 21.469 0.200 . 1 . . . . . 29 THR CG2 . 26747 1 331 . 1 . 1 29 29 THR H H 1 7.774 0.020 . 1 . . . . . 29 THR H . 26747 1 332 . 1 . 1 29 29 THR HA H 1 4.114 0.020 . 1 . . . . . 29 THR HA . 26747 1 333 . 1 . 1 29 29 THR HB H 1 4.287 0.020 . 1 . . . . . 29 THR HB . 26747 1 334 . 1 . 1 29 29 THR HG21 H 1 1.263 0.020 . 1 . . . . . 29 THR HG21 . 26747 1 335 . 1 . 1 29 29 THR HG22 H 1 1.263 0.020 . 1 . . . . . 29 THR HG22 . 26747 1 336 . 1 . 1 29 29 THR HG23 H 1 1.263 0.020 . 1 . . . . . 29 THR HG23 . 26747 1 337 . 1 . 1 29 29 THR N N 15 111.109 0.200 . 1 . . . . . 29 THR N . 26747 1 338 . 1 . 1 30 30 MET C C 13 176.747 0.200 . 1 . . . . . 30 MET C . 26747 1 339 . 1 . 1 30 30 MET CA C 13 57.781 0.200 . 1 . . . . . 30 MET CA . 26747 1 340 . 1 . 1 30 30 MET CB C 13 33.083 0.200 . 1 . . . . . 30 MET CB . 26747 1 341 . 1 . 1 30 30 MET CG C 13 32.094 0.200 . 1 . . . . . 30 MET CG . 26747 1 342 . 1 . 1 30 30 MET H H 1 7.989 0.020 . 1 . . . . . 30 MET H . 26747 1 343 . 1 . 1 30 30 MET HA H 1 4.135 0.020 . 1 . . . . . 30 MET HA . 26747 1 344 . 1 . 1 30 30 MET HB2 H 1 1.725 0.020 . 2 . . . . . 30 MET HB2 . 26747 1 345 . 1 . 1 30 30 MET HB3 H 1 1.878 0.020 . 2 . . . . . 30 MET HB3 . 26747 1 346 . 1 . 1 30 30 MET HG2 H 1 2.207 0.020 . 2 . . . . . 30 MET HG2 . 26747 1 347 . 1 . 1 30 30 MET HG3 H 1 2.375 0.020 . 2 . . . . . 30 MET HG3 . 26747 1 348 . 1 . 1 30 30 MET N N 15 120.586 0.200 . 1 . . . . . 30 MET N . 26747 1 349 . 1 . 1 31 31 PHE C C 13 175.709 0.200 . 1 . . . . . 31 PHE C . 26747 1 350 . 1 . 1 31 31 PHE CA C 13 57.886 0.200 . 1 . . . . . 31 PHE CA . 26747 1 351 . 1 . 1 31 31 PHE CB C 13 39.140 0.200 . 1 . . . . . 31 PHE CB . 26747 1 352 . 1 . 1 31 31 PHE H H 1 7.894 0.020 . 1 . . . . . 31 PHE H . 26747 1 353 . 1 . 1 31 31 PHE HA H 1 4.592 0.020 . 1 . . . . . 31 PHE HA . 26747 1 354 . 1 . 1 31 31 PHE HB2 H 1 3.201 0.020 . 2 . . . . . 31 PHE HB2 . 26747 1 355 . 1 . 1 31 31 PHE HB3 H 1 2.940 0.020 . 2 . . . . . 31 PHE HB3 . 26747 1 356 . 1 . 1 31 31 PHE N N 15 116.529 0.200 . 1 . . . . . 31 PHE N . 26747 1 357 . 1 . 1 32 32 HIS C C 13 174.808 0.200 . 1 . . . . . 32 HIS C . 26747 1 358 . 1 . 1 32 32 HIS CA C 13 55.935 0.200 . 1 . . . . . 32 HIS CA . 26747 1 359 . 1 . 1 32 32 HIS CB C 13 28.453 0.200 . 1 . . . . . 32 HIS CB . 26747 1 360 . 1 . 1 32 32 HIS H H 1 8.003 0.020 . 1 . . . . . 32 HIS H . 26747 1 361 . 1 . 1 32 32 HIS HA H 1 4.723 0.020 . 1 . . . . . 32 HIS HA . 26747 1 362 . 1 . 1 32 32 HIS HB2 H 1 3.326 0.020 . 2 . . . . . 32 HIS HB2 . 26747 1 363 . 1 . 1 32 32 HIS HB3 H 1 3.399 0.020 . 2 . . . . . 32 HIS HB3 . 26747 1 364 . 1 . 1 32 32 HIS N N 15 117.877 0.200 . 1 . . . . . 32 HIS N . 26747 1 365 . 1 . 1 33 33 THR C C 13 174.550 0.200 . 1 . . . . . 33 THR C . 26747 1 366 . 1 . 1 33 33 THR CA C 13 62.062 0.200 . 1 . . . . . 33 THR CA . 26747 1 367 . 1 . 1 33 33 THR CB C 13 69.772 0.200 . 1 . . . . . 33 THR CB . 26747 1 368 . 1 . 1 33 33 THR CG2 C 13 21.672 0.200 . 1 . . . . . 33 THR CG2 . 26747 1 369 . 1 . 1 33 33 THR H H 1 8.054 0.020 . 1 . . . . . 33 THR H . 26747 1 370 . 1 . 1 33 33 THR HA H 1 4.433 0.020 . 1 . . . . . 33 THR HA . 26747 1 371 . 1 . 1 33 33 THR HB H 1 4.288 0.020 . 1 . . . . . 33 THR HB . 26747 1 372 . 1 . 1 33 33 THR HG21 H 1 1.225 0.020 . 1 . . . . . 33 THR HG21 . 26747 1 373 . 1 . 1 33 33 THR HG22 H 1 1.225 0.020 . 1 . . . . . 33 THR HG22 . 26747 1 374 . 1 . 1 33 33 THR HG23 H 1 1.225 0.020 . 1 . . . . . 33 THR HG23 . 26747 1 375 . 1 . 1 33 33 THR N N 15 113.766 0.200 . 1 . . . . . 33 THR N . 26747 1 376 . 1 . 1 34 34 SER C C 13 174.837 0.200 . 1 . . . . . 34 SER C . 26747 1 377 . 1 . 1 34 34 SER CA C 13 58.788 0.200 . 1 . . . . . 34 SER CA . 26747 1 378 . 1 . 1 34 34 SER CB C 13 64.148 0.200 . 1 . . . . . 34 SER CB . 26747 1 379 . 1 . 1 34 34 SER H H 1 8.195 0.020 . 1 . . . . . 34 SER H . 26747 1 380 . 1 . 1 34 34 SER HA H 1 4.487 0.020 . 1 . . . . . 34 SER HA . 26747 1 381 . 1 . 1 34 34 SER HB2 H 1 3.910 0.020 . 1 . . . . . 34 SER HB2 . 26747 1 382 . 1 . 1 34 34 SER HB3 H 1 3.910 0.020 . 1 . . . . . 34 SER HB3 . 26747 1 383 . 1 . 1 34 34 SER N N 15 117.136 0.200 . 1 . . . . . 34 SER N . 26747 1 384 . 1 . 1 35 35 GLY C C 13 173.925 0.200 . 1 . . . . . 35 GLY C . 26747 1 385 . 1 . 1 35 35 GLY CA C 13 45.488 0.200 . 1 . . . . . 35 GLY CA . 26747 1 386 . 1 . 1 35 35 GLY H H 1 8.235 0.020 . 1 . . . . . 35 GLY H . 26747 1 387 . 1 . 1 35 35 GLY HA2 H 1 3.883 0.020 . 2 . . . . . 35 GLY HA2 . 26747 1 388 . 1 . 1 35 35 GLY HA3 H 1 3.979 0.020 . 2 . . . . . 35 GLY HA3 . 26747 1 389 . 1 . 1 35 35 GLY N N 15 110.021 0.200 . 1 . . . . . 35 GLY N . 26747 1 390 . 1 . 1 36 36 TYR C C 13 175.529 0.200 . 1 . . . . . 36 TYR C . 26747 1 391 . 1 . 1 36 36 TYR CA C 13 58.280 0.200 . 1 . . . . . 36 TYR CA . 26747 1 392 . 1 . 1 36 36 TYR CB C 13 38.803 0.200 . 1 . . . . . 36 TYR CB . 26747 1 393 . 1 . 1 36 36 TYR H H 1 7.923 0.020 . 1 . . . . . 36 TYR H . 26747 1 394 . 1 . 1 36 36 TYR HA H 1 4.536 0.020 . 1 . . . . . 36 TYR HA . 26747 1 395 . 1 . 1 36 36 TYR HB2 H 1 3.023 0.020 . 2 . . . . . 36 TYR HB2 . 26747 1 396 . 1 . 1 36 36 TYR HB3 H 1 2.907 0.020 . 2 . . . . . 36 TYR HB3 . 26747 1 397 . 1 . 1 36 36 TYR N N 15 119.706 0.200 . 1 . . . . . 36 TYR N . 26747 1 398 . 1 . 1 37 37 ASP C C 13 175.342 0.200 . 1 . . . . . 37 ASP C . 26747 1 399 . 1 . 1 37 37 ASP CA C 13 53.184 0.200 . 1 . . . . . 37 ASP CA . 26747 1 400 . 1 . 1 37 37 ASP CB C 13 38.226 0.200 . 1 . . . . . 37 ASP CB . 26747 1 401 . 1 . 1 37 37 ASP H H 1 8.245 0.020 . 1 . . . . . 37 ASP H . 26747 1 402 . 1 . 1 37 37 ASP HA H 1 4.729 0.020 . 1 . . . . . 37 ASP HA . 26747 1 403 . 1 . 1 37 37 ASP HB2 H 1 2.791 0.020 . 2 . . . . . 37 ASP HB2 . 26747 1 404 . 1 . 1 37 37 ASP HB3 H 1 2.921 0.020 . 2 . . . . . 37 ASP HB3 . 26747 1 405 . 1 . 1 37 37 ASP N N 15 120.088 0.200 . 1 . . . . . 37 ASP N . 26747 1 406 . 1 . 1 38 38 THR C C 13 174.759 0.200 . 1 . . . . . 38 THR C . 26747 1 407 . 1 . 1 38 38 THR CA C 13 62.685 0.200 . 1 . . . . . 38 THR CA . 26747 1 408 . 1 . 1 38 38 THR CB C 13 69.377 0.200 . 1 . . . . . 38 THR CB . 26747 1 409 . 1 . 1 38 38 THR CG2 C 13 21.720 0.200 . 1 . . . . . 38 THR CG2 . 26747 1 410 . 1 . 1 38 38 THR H H 1 7.945 0.020 . 1 . . . . . 38 THR H . 26747 1 411 . 1 . 1 38 38 THR HA H 1 4.235 0.020 . 1 . . . . . 38 THR HA . 26747 1 412 . 1 . 1 38 38 THR HB H 1 4.250 0.020 . 1 . . . . . 38 THR HB . 26747 1 413 . 1 . 1 38 38 THR HG21 H 1 1.189 0.020 . 1 . . . . . 38 THR HG21 . 26747 1 414 . 1 . 1 38 38 THR HG22 H 1 1.189 0.020 . 1 . . . . . 38 THR HG22 . 26747 1 415 . 1 . 1 38 38 THR HG23 H 1 1.189 0.020 . 1 . . . . . 38 THR HG23 . 26747 1 416 . 1 . 1 38 38 THR N N 15 114.114 0.200 . 1 . . . . . 38 THR N . 26747 1 417 . 1 . 1 39 39 GLN C C 13 175.770 0.200 . 1 . . . . . 39 GLN C . 26747 1 418 . 1 . 1 39 39 GLN CA C 13 56.588 0.200 . 1 . . . . . 39 GLN CA . 26747 1 419 . 1 . 1 39 39 GLN CB C 13 29.269 0.200 . 1 . . . . . 39 GLN CB . 26747 1 420 . 1 . 1 39 39 GLN CG C 13 33.888 0.200 . 1 . . . . . 39 GLN CG . 26747 1 421 . 1 . 1 39 39 GLN H H 1 8.149 0.020 . 1 . . . . . 39 GLN H . 26747 1 422 . 1 . 1 39 39 GLN HA H 1 4.278 0.020 . 1 . . . . . 39 GLN HA . 26747 1 423 . 1 . 1 39 39 GLN HB2 H 1 2.018 0.020 . 2 . . . . . 39 GLN HB2 . 26747 1 424 . 1 . 1 39 39 GLN HB3 H 1 2.112 0.020 . 2 . . . . . 39 GLN HB3 . 26747 1 425 . 1 . 1 39 39 GLN HG2 H 1 2.374 0.020 . 1 . . . . . 39 GLN HG2 . 26747 1 426 . 1 . 1 39 39 GLN HG3 H 1 2.374 0.020 . 1 . . . . . 39 GLN HG3 . 26747 1 427 . 1 . 1 39 39 GLN N N 15 121.321 0.200 . 1 . . . . . 39 GLN N . 26747 1 428 . 1 . 1 40 40 ALA C C 13 177.652 0.200 . 1 . . . . . 40 ALA C . 26747 1 429 . 1 . 1 40 40 ALA CA C 13 52.812 0.200 . 1 . . . . . 40 ALA CA . 26747 1 430 . 1 . 1 40 40 ALA CB C 13 19.226 0.200 . 1 . . . . . 40 ALA CB . 26747 1 431 . 1 . 1 40 40 ALA H H 1 7.965 0.020 . 1 . . . . . 40 ALA H . 26747 1 432 . 1 . 1 40 40 ALA HA H 1 4.285 0.020 . 1 . . . . . 40 ALA HA . 26747 1 433 . 1 . 1 40 40 ALA HB1 H 1 1.365 0.020 . 1 . . . . . 40 ALA HB1 . 26747 1 434 . 1 . 1 40 40 ALA HB2 H 1 1.365 0.020 . 1 . . . . . 40 ALA HB2 . 26747 1 435 . 1 . 1 40 40 ALA HB3 H 1 1.365 0.020 . 1 . . . . . 40 ALA HB3 . 26747 1 436 . 1 . 1 40 40 ALA N N 15 123.450 0.200 . 1 . . . . . 40 ALA N . 26747 1 437 . 1 . 1 41 41 ILE C C 13 176.302 0.200 . 1 . . . . . 41 ILE C . 26747 1 438 . 1 . 1 41 41 ILE CA C 13 61.624 0.200 . 1 . . . . . 41 ILE CA . 26747 1 439 . 1 . 1 41 41 ILE CB C 13 38.598 0.200 . 1 . . . . . 41 ILE CB . 26747 1 440 . 1 . 1 41 41 ILE CD1 C 13 13.046 0.200 . 1 . . . . . 41 ILE CD1 . 26747 1 441 . 1 . 1 41 41 ILE CG1 C 13 27.569 0.200 . 1 . . . . . 41 ILE CG1 . 26747 1 442 . 1 . 1 41 41 ILE CG2 C 13 17.527 0.200 . 1 . . . . . 41 ILE CG2 . 26747 1 443 . 1 . 1 41 41 ILE H H 1 7.791 0.020 . 1 . . . . . 41 ILE H . 26747 1 444 . 1 . 1 41 41 ILE HA H 1 4.124 0.020 . 1 . . . . . 41 ILE HA . 26747 1 445 . 1 . 1 41 41 ILE HB H 1 1.864 0.020 . 1 . . . . . 41 ILE HB . 26747 1 446 . 1 . 1 41 41 ILE HD11 H 1 0.813 0.020 . 1 . . . . . 41 ILE HD11 . 26747 1 447 . 1 . 1 41 41 ILE HD12 H 1 0.813 0.020 . 1 . . . . . 41 ILE HD12 . 26747 1 448 . 1 . 1 41 41 ILE HD13 H 1 0.813 0.020 . 1 . . . . . 41 ILE HD13 . 26747 1 449 . 1 . 1 41 41 ILE HG12 H 1 1.488 0.020 . 2 . . . . . 41 ILE HG12 . 26747 1 450 . 1 . 1 41 41 ILE HG13 H 1 1.159 0.020 . 2 . . . . . 41 ILE HG13 . 26747 1 451 . 1 . 1 41 41 ILE HG21 H 1 0.867 0.020 . 1 . . . . . 41 ILE HG21 . 26747 1 452 . 1 . 1 41 41 ILE HG22 H 1 0.867 0.020 . 1 . . . . . 41 ILE HG22 . 26747 1 453 . 1 . 1 41 41 ILE HG23 H 1 0.867 0.020 . 1 . . . . . 41 ILE HG23 . 26747 1 454 . 1 . 1 41 41 ILE N N 15 118.764 0.200 . 1 . . . . . 41 ILE N . 26747 1 455 . 1 . 1 42 42 VAL C C 13 176.185 0.200 . 1 . . . . . 42 VAL C . 26747 1 456 . 1 . 1 42 42 VAL CA C 13 62.706 0.200 . 1 . . . . . 42 VAL CA . 26747 1 457 . 1 . 1 42 42 VAL CB C 13 32.681 0.200 . 1 . . . . . 42 VAL CB . 26747 1 458 . 1 . 1 42 42 VAL CG1 C 13 21.225 0.200 . 2 . . . . . 42 VAL CG1 . 26747 1 459 . 1 . 1 42 42 VAL CG2 C 13 21.003 0.200 . 2 . . . . . 42 VAL CG2 . 26747 1 460 . 1 . 1 42 42 VAL H H 1 7.916 0.020 . 1 . . . . . 42 VAL H . 26747 1 461 . 1 . 1 42 42 VAL HA H 1 4.099 0.020 . 1 . . . . . 42 VAL HA . 26747 1 462 . 1 . 1 42 42 VAL HB H 1 2.067 0.020 . 1 . . . . . 42 VAL HB . 26747 1 463 . 1 . 1 42 42 VAL HG11 H 1 0.913 0.020 . 2 . . . . . 42 VAL HG11 . 26747 1 464 . 1 . 1 42 42 VAL HG12 H 1 0.913 0.020 . 2 . . . . . 42 VAL HG12 . 26747 1 465 . 1 . 1 42 42 VAL HG13 H 1 0.913 0.020 . 2 . . . . . 42 VAL HG13 . 26747 1 466 . 1 . 1 42 42 VAL HG21 H 1 0.922 0.020 . 2 . . . . . 42 VAL HG21 . 26747 1 467 . 1 . 1 42 42 VAL HG22 H 1 0.922 0.020 . 2 . . . . . 42 VAL HG22 . 26747 1 468 . 1 . 1 42 42 VAL HG23 H 1 0.922 0.020 . 2 . . . . . 42 VAL HG23 . 26747 1 469 . 1 . 1 42 42 VAL N N 15 122.260 0.200 . 1 . . . . . 42 VAL N . 26747 1 470 . 1 . 1 43 43 GLU C C 13 175.823 0.200 . 1 . . . . . 43 GLU C . 26747 1 471 . 1 . 1 43 43 GLU CA C 13 55.706 0.200 . 1 . . . . . 43 GLU CA . 26747 1 472 . 1 . 1 43 43 GLU CB C 13 28.944 0.200 . 1 . . . . . 43 GLU CB . 26747 1 473 . 1 . 1 43 43 GLU CG C 13 32.714 0.200 . 1 . . . . . 43 GLU CG . 26747 1 474 . 1 . 1 43 43 GLU H H 1 8.176 0.020 . 1 . . . . . 43 GLU H . 26747 1 475 . 1 . 1 43 43 GLU HA H 1 4.366 0.020 . 1 . . . . . 43 GLU HA . 26747 1 476 . 1 . 1 43 43 GLU HB2 H 1 1.980 0.020 . 2 . . . . . 43 GLU HB2 . 26747 1 477 . 1 . 1 43 43 GLU HB3 H 1 2.109 0.020 . 2 . . . . . 43 GLU HB3 . 26747 1 478 . 1 . 1 43 43 GLU HG2 H 1 2.459 0.020 . 1 . . . . . 43 GLU HG2 . 26747 1 479 . 1 . 1 43 43 GLU HG3 H 1 2.459 0.020 . 1 . . . . . 43 GLU HG3 . 26747 1 480 . 1 . 1 43 43 GLU N N 15 122.453 0.200 . 1 . . . . . 43 GLU N . 26747 1 481 . 1 . 1 44 44 ASN C C 13 175.047 0.200 . 1 . . . . . 44 ASN C . 26747 1 482 . 1 . 1 44 44 ASN CA C 13 53.386 0.200 . 1 . . . . . 44 ASN CA . 26747 1 483 . 1 . 1 44 44 ASN CB C 13 38.914 0.200 . 1 . . . . . 44 ASN CB . 26747 1 484 . 1 . 1 44 44 ASN H H 1 8.248 0.020 . 1 . . . . . 44 ASN H . 26747 1 485 . 1 . 1 44 44 ASN HA H 1 4.694 0.020 . 1 . . . . . 44 ASN HA . 26747 1 486 . 1 . 1 44 44 ASN HB2 H 1 2.828 0.020 . 1 . . . . . 44 ASN HB2 . 26747 1 487 . 1 . 1 44 44 ASN HB3 H 1 2.828 0.020 . 1 . . . . . 44 ASN HB3 . 26747 1 488 . 1 . 1 44 44 ASN N N 15 119.170 0.200 . 1 . . . . . 44 ASN N . 26747 1 489 . 1 . 1 45 45 ASN C C 13 175.386 0.200 . 1 . . . . . 45 ASN C . 26747 1 490 . 1 . 1 45 45 ASN CA C 13 53.759 0.200 . 1 . . . . . 45 ASN CA . 26747 1 491 . 1 . 1 45 45 ASN CB C 13 38.718 0.200 . 1 . . . . . 45 ASN CB . 26747 1 492 . 1 . 1 45 45 ASN H H 1 8.279 0.020 . 1 . . . . . 45 ASN H . 26747 1 493 . 1 . 1 45 45 ASN HA H 1 4.686 0.020 . 1 . . . . . 45 ASN HA . 26747 1 494 . 1 . 1 45 45 ASN HB2 H 1 2.836 0.020 . 1 . . . . . 45 ASN HB2 . 26747 1 495 . 1 . 1 45 45 ASN HB3 H 1 2.836 0.020 . 1 . . . . . 45 ASN HB3 . 26747 1 496 . 1 . 1 45 45 ASN N N 15 118.600 0.200 . 1 . . . . . 45 ASN N . 26747 1 497 . 1 . 1 46 46 GLU C C 13 176.402 0.200 . 1 . . . . . 46 GLU C . 26747 1 498 . 1 . 1 46 46 GLU CA C 13 56.646 0.200 . 1 . . . . . 46 GLU CA . 26747 1 499 . 1 . 1 46 46 GLU CB C 13 28.693 0.200 . 1 . . . . . 46 GLU CB . 26747 1 500 . 1 . 1 46 46 GLU CG C 13 32.816 0.200 . 1 . . . . . 46 GLU CG . 26747 1 501 . 1 . 1 46 46 GLU H H 1 8.216 0.020 . 1 . . . . . 46 GLU H . 26747 1 502 . 1 . 1 46 46 GLU HA H 1 4.370 0.020 . 1 . . . . . 46 GLU HA . 26747 1 503 . 1 . 1 46 46 GLU HB2 H 1 2.181 0.020 . 2 . . . . . 46 GLU HB2 . 26747 1 504 . 1 . 1 46 46 GLU HB3 H 1 2.046 0.020 . 2 . . . . . 46 GLU HB3 . 26747 1 505 . 1 . 1 46 46 GLU HG2 H 1 2.492 0.020 . 1 . . . . . 46 GLU HG2 . 26747 1 506 . 1 . 1 46 46 GLU HG3 H 1 2.492 0.020 . 1 . . . . . 46 GLU HG3 . 26747 1 507 . 1 . 1 46 46 GLU N N 15 119.606 0.200 . 1 . . . . . 46 GLU N . 26747 1 508 . 1 . 1 47 47 SER C C 13 175.293 0.200 . 1 . . . . . 47 SER C . 26747 1 509 . 1 . 1 47 47 SER CA C 13 59.211 0.200 . 1 . . . . . 47 SER CA . 26747 1 510 . 1 . 1 47 47 SER CB C 13 63.719 0.200 . 1 . . . . . 47 SER CB . 26747 1 511 . 1 . 1 47 47 SER H H 1 8.184 0.020 . 1 . . . . . 47 SER H . 26747 1 512 . 1 . 1 47 47 SER HA H 1 4.453 0.020 . 1 . . . . . 47 SER HA . 26747 1 513 . 1 . 1 47 47 SER HB2 H 1 3.940 0.020 . 1 . . . . . 47 SER HB2 . 26747 1 514 . 1 . 1 47 47 SER HB3 H 1 3.940 0.020 . 1 . . . . . 47 SER HB3 . 26747 1 515 . 1 . 1 47 47 SER N N 15 115.551 0.200 . 1 . . . . . 47 SER N . 26747 1 516 . 1 . 1 48 48 THR C C 13 174.939 0.200 . 1 . . . . . 48 THR C . 26747 1 517 . 1 . 1 48 48 THR CA C 13 62.550 0.200 . 1 . . . . . 48 THR CA . 26747 1 518 . 1 . 1 48 48 THR CB C 13 69.470 0.200 . 1 . . . . . 48 THR CB . 26747 1 519 . 1 . 1 48 48 THR CG2 C 13 21.642 0.200 . 1 . . . . . 48 THR CG2 . 26747 1 520 . 1 . 1 48 48 THR H H 1 7.978 0.020 . 1 . . . . . 48 THR H . 26747 1 521 . 1 . 1 48 48 THR HA H 1 4.316 0.020 . 1 . . . . . 48 THR HA . 26747 1 522 . 1 . 1 48 48 THR HB H 1 4.250 0.020 . 1 . . . . . 48 THR HB . 26747 1 523 . 1 . 1 48 48 THR HG21 H 1 1.188 0.020 . 1 . . . . . 48 THR HG21 . 26747 1 524 . 1 . 1 48 48 THR HG22 H 1 1.188 0.020 . 1 . . . . . 48 THR HG22 . 26747 1 525 . 1 . 1 48 48 THR HG23 H 1 1.188 0.020 . 1 . . . . . 48 THR HG23 . 26747 1 526 . 1 . 1 48 48 THR N N 15 114.995 0.200 . 1 . . . . . 48 THR N . 26747 1 527 . 1 . 1 49 49 GLU C C 13 175.886 0.200 . 1 . . . . . 49 GLU C . 26747 1 528 . 1 . 1 49 49 GLU CA C 13 56.640 0.200 . 1 . . . . . 49 GLU CA . 26747 1 529 . 1 . 1 49 49 GLU CB C 13 28.679 0.200 . 1 . . . . . 49 GLU CB . 26747 1 530 . 1 . 1 49 49 GLU CG C 13 32.615 0.200 . 1 . . . . . 49 GLU CG . 26747 1 531 . 1 . 1 49 49 GLU H H 1 8.078 0.020 . 1 . . . . . 49 GLU H . 26747 1 532 . 1 . 1 49 49 GLU HA H 1 4.242 0.020 . 1 . . . . . 49 GLU HA . 26747 1 533 . 1 . 1 49 49 GLU HB2 H 1 1.960 0.020 . 1 . . . . . 49 GLU HB2 . 26747 1 534 . 1 . 1 49 49 GLU HB3 H 1 1.960 0.020 . 1 . . . . . 49 GLU HB3 . 26747 1 535 . 1 . 1 49 49 GLU HG2 H 1 2.308 0.020 . 1 . . . . . 49 GLU HG2 . 26747 1 536 . 1 . 1 49 49 GLU HG3 H 1 2.308 0.020 . 1 . . . . . 49 GLU HG3 . 26747 1 537 . 1 . 1 49 49 GLU N N 15 121.291 0.200 . 1 . . . . . 49 GLU N . 26747 1 538 . 1 . 1 50 50 TYR C C 13 176.510 0.200 . 1 . . . . . 50 TYR C . 26747 1 539 . 1 . 1 50 50 TYR CA C 13 58.529 0.200 . 1 . . . . . 50 TYR CA . 26747 1 540 . 1 . 1 50 50 TYR CB C 13 38.491 0.200 . 1 . . . . . 50 TYR CB . 26747 1 541 . 1 . 1 50 50 TYR H H 1 7.959 0.020 . 1 . . . . . 50 TYR H . 26747 1 542 . 1 . 1 50 50 TYR HA H 1 4.504 0.020 . 1 . . . . . 50 TYR HA . 26747 1 543 . 1 . 1 50 50 TYR HB2 H 1 3.106 0.020 . 2 . . . . . 50 TYR HB2 . 26747 1 544 . 1 . 1 50 50 TYR HB3 H 1 2.960 0.020 . 2 . . . . . 50 TYR HB3 . 26747 1 545 . 1 . 1 50 50 TYR N N 15 119.386 0.200 . 1 . . . . . 50 TYR N . 26747 1 546 . 1 . 1 51 51 GLY C C 13 174.387 0.200 . 1 . . . . . 51 GLY C . 26747 1 547 . 1 . 1 51 51 GLY CA C 13 45.884 0.200 . 1 . . . . . 51 GLY CA . 26747 1 548 . 1 . 1 51 51 GLY H H 1 8.071 0.020 . 1 . . . . . 51 GLY H . 26747 1 549 . 1 . 1 51 51 GLY HA2 H 1 3.883 0.020 . 1 . . . . . 51 GLY HA2 . 26747 1 550 . 1 . 1 51 51 GLY HA3 H 1 3.883 0.020 . 1 . . . . . 51 GLY HA3 . 26747 1 551 . 1 . 1 51 51 GLY N N 15 108.789 0.200 . 1 . . . . . 51 GLY N . 26747 1 552 . 1 . 1 52 52 LEU C C 13 177.340 0.200 . 1 . . . . . 52 LEU C . 26747 1 553 . 1 . 1 52 52 LEU CA C 13 55.940 0.200 . 1 . . . . . 52 LEU CA . 26747 1 554 . 1 . 1 52 52 LEU CB C 13 42.255 0.200 . 1 . . . . . 52 LEU CB . 26747 1 555 . 1 . 1 52 52 LEU CD1 C 13 23.698 0.200 . 2 . . . . . 52 LEU CD1 . 26747 1 556 . 1 . 1 52 52 LEU CD2 C 13 24.785 0.200 . 2 . . . . . 52 LEU CD2 . 26747 1 557 . 1 . 1 52 52 LEU CG C 13 27.035 0.200 . 1 . . . . . 52 LEU CG . 26747 1 558 . 1 . 1 52 52 LEU H H 1 7.795 0.020 . 1 . . . . . 52 LEU H . 26747 1 559 . 1 . 1 52 52 LEU HA H 1 4.228 0.020 . 1 . . . . . 52 LEU HA . 26747 1 560 . 1 . 1 52 52 LEU HB2 H 1 1.523 0.020 . 2 . . . . . 52 LEU HB2 . 26747 1 561 . 1 . 1 52 52 LEU HB3 H 1 1.388 0.020 . 2 . . . . . 52 LEU HB3 . 26747 1 562 . 1 . 1 52 52 LEU HD11 H 1 0.781 0.020 . 2 . . . . . 52 LEU HD11 . 26747 1 563 . 1 . 1 52 52 LEU HD12 H 1 0.781 0.020 . 2 . . . . . 52 LEU HD12 . 26747 1 564 . 1 . 1 52 52 LEU HD13 H 1 0.781 0.020 . 2 . . . . . 52 LEU HD13 . 26747 1 565 . 1 . 1 52 52 LEU HD21 H 1 0.818 0.020 . 2 . . . . . 52 LEU HD21 . 26747 1 566 . 1 . 1 52 52 LEU HD22 H 1 0.818 0.020 . 2 . . . . . 52 LEU HD22 . 26747 1 567 . 1 . 1 52 52 LEU HD23 H 1 0.818 0.020 . 2 . . . . . 52 LEU HD23 . 26747 1 568 . 1 . 1 52 52 LEU HG H 1 1.506 0.020 . 1 . . . . . 52 LEU HG . 26747 1 569 . 1 . 1 52 52 LEU N N 15 120.916 0.200 . 1 . . . . . 52 LEU N . 26747 1 570 . 1 . 1 53 53 PHE C C 13 175.798 0.200 . 1 . . . . . 53 PHE C . 26747 1 571 . 1 . 1 53 53 PHE CA C 13 57.877 0.200 . 1 . . . . . 53 PHE CA . 26747 1 572 . 1 . 1 53 53 PHE CB C 13 39.203 0.200 . 1 . . . . . 53 PHE CB . 26747 1 573 . 1 . 1 53 53 PHE H H 1 7.972 0.020 . 1 . . . . . 53 PHE H . 26747 1 574 . 1 . 1 53 53 PHE HA H 1 4.561 0.020 . 1 . . . . . 53 PHE HA . 26747 1 575 . 1 . 1 53 53 PHE HB2 H 1 3.155 0.020 . 2 . . . . . 53 PHE HB2 . 26747 1 576 . 1 . 1 53 53 PHE HB3 H 1 3.010 0.020 . 2 . . . . . 53 PHE HB3 . 26747 1 577 . 1 . 1 53 53 PHE N N 15 118.852 0.200 . 1 . . . . . 53 PHE N . 26747 1 578 . 1 . 1 54 54 GLN C C 13 176.135 0.200 . 1 . . . . . 54 GLN C . 26747 1 579 . 1 . 1 54 54 GLN CA C 13 56.216 0.200 . 1 . . . . . 54 GLN CA . 26747 1 580 . 1 . 1 54 54 GLN CB C 13 29.436 0.200 . 1 . . . . . 54 GLN CB . 26747 1 581 . 1 . 1 54 54 GLN CG C 13 33.877 0.200 . 1 . . . . . 54 GLN CG . 26747 1 582 . 1 . 1 54 54 GLN H H 1 8.018 0.020 . 1 . . . . . 54 GLN H . 26747 1 583 . 1 . 1 54 54 GLN HA H 1 4.286 0.020 . 1 . . . . . 54 GLN HA . 26747 1 584 . 1 . 1 54 54 GLN HB2 H 1 1.951 0.020 . 2 . . . . . 54 GLN HB2 . 26747 1 585 . 1 . 1 54 54 GLN HB3 H 1 2.058 0.020 . 2 . . . . . 54 GLN HB3 . 26747 1 586 . 1 . 1 54 54 GLN HG2 H 1 2.260 0.020 . 1 . . . . . 54 GLN HG2 . 26747 1 587 . 1 . 1 54 54 GLN HG3 H 1 2.260 0.020 . 1 . . . . . 54 GLN HG3 . 26747 1 588 . 1 . 1 54 54 GLN N N 15 120.196 0.200 . 1 . . . . . 54 GLN N . 26747 1 589 . 1 . 1 55 55 ILE C C 13 176.326 0.200 . 1 . . . . . 55 ILE C . 26747 1 590 . 1 . 1 55 55 ILE CA C 13 61.679 0.200 . 1 . . . . . 55 ILE CA . 26747 1 591 . 1 . 1 55 55 ILE CB C 13 38.658 0.200 . 1 . . . . . 55 ILE CB . 26747 1 592 . 1 . 1 55 55 ILE CD1 C 13 13.077 0.200 . 1 . . . . . 55 ILE CD1 . 26747 1 593 . 1 . 1 55 55 ILE CG1 C 13 27.531 0.200 . 1 . . . . . 55 ILE CG1 . 26747 1 594 . 1 . 1 55 55 ILE CG2 C 13 17.574 0.200 . 1 . . . . . 55 ILE CG2 . 26747 1 595 . 1 . 1 55 55 ILE H H 1 7.941 0.020 . 1 . . . . . 55 ILE H . 26747 1 596 . 1 . 1 55 55 ILE HA H 1 4.125 0.020 . 1 . . . . . 55 ILE HA . 26747 1 597 . 1 . 1 55 55 ILE HB H 1 1.874 0.020 . 1 . . . . . 55 ILE HB . 26747 1 598 . 1 . 1 55 55 ILE HD11 H 1 0.830 0.020 . 1 . . . . . 55 ILE HD11 . 26747 1 599 . 1 . 1 55 55 ILE HD12 H 1 0.830 0.020 . 1 . . . . . 55 ILE HD12 . 26747 1 600 . 1 . 1 55 55 ILE HD13 H 1 0.830 0.020 . 1 . . . . . 55 ILE HD13 . 26747 1 601 . 1 . 1 55 55 ILE HG12 H 1 1.182 0.020 . 2 . . . . . 55 ILE HG12 . 26747 1 602 . 1 . 1 55 55 ILE HG13 H 1 1.482 0.020 . 2 . . . . . 55 ILE HG13 . 26747 1 603 . 1 . 1 55 55 ILE HG21 H 1 0.891 0.020 . 1 . . . . . 55 ILE HG21 . 26747 1 604 . 1 . 1 55 55 ILE HG22 H 1 0.891 0.020 . 1 . . . . . 55 ILE HG22 . 26747 1 605 . 1 . 1 55 55 ILE HG23 H 1 0.891 0.020 . 1 . . . . . 55 ILE HG23 . 26747 1 606 . 1 . 1 55 55 ILE N N 15 120.351 0.200 . 1 . . . . . 55 ILE N . 26747 1 607 . 1 . 1 56 56 SER C C 13 174.556 0.200 . 1 . . . . . 56 SER C . 26747 1 608 . 1 . 1 56 56 SER CA C 13 58.828 0.200 . 1 . . . . . 56 SER CA . 26747 1 609 . 1 . 1 56 56 SER CB C 13 63.834 0.200 . 1 . . . . . 56 SER CB . 26747 1 610 . 1 . 1 56 56 SER H H 1 8.077 0.020 . 1 . . . . . 56 SER H . 26747 1 611 . 1 . 1 56 56 SER HA H 1 4.385 0.020 . 1 . . . . . 56 SER HA . 26747 1 612 . 1 . 1 56 56 SER HB2 H 1 3.837 0.020 . 2 . . . . . 56 SER HB2 . 26747 1 613 . 1 . 1 56 56 SER HB3 H 1 3.912 0.020 . 2 . . . . . 56 SER HB3 . 26747 1 614 . 1 . 1 56 56 SER N N 15 117.744 0.200 . 1 . . . . . 56 SER N . 26747 1 615 . 1 . 1 57 57 ASN C C 13 175.622 0.200 . 1 . . . . . 57 ASN C . 26747 1 616 . 1 . 1 57 57 ASN CA C 13 53.734 0.200 . 1 . . . . . 57 ASN CA . 26747 1 617 . 1 . 1 57 57 ASN CB C 13 38.775 0.200 . 1 . . . . . 57 ASN CB . 26747 1 618 . 1 . 1 57 57 ASN H H 1 8.150 0.020 . 1 . . . . . 57 ASN H . 26747 1 619 . 1 . 1 57 57 ASN HA H 1 4.561 0.020 . 1 . . . . . 57 ASN HA . 26747 1 620 . 1 . 1 57 57 ASN HB2 H 1 2.727 0.020 . 1 . . . . . 57 ASN HB2 . 26747 1 621 . 1 . 1 57 57 ASN HB3 H 1 2.727 0.020 . 1 . . . . . 57 ASN HB3 . 26747 1 622 . 1 . 1 57 57 ASN N N 15 120.477 0.200 . 1 . . . . . 57 ASN N . 26747 1 623 . 1 . 1 58 58 LYS C C 13 176.819 0.200 . 1 . . . . . 58 LYS C . 26747 1 624 . 1 . 1 58 58 LYS CA C 13 56.950 0.200 . 1 . . . . . 58 LYS CA . 26747 1 625 . 1 . 1 58 58 LYS CB C 13 32.636 0.200 . 1 . . . . . 58 LYS CB . 26747 1 626 . 1 . 1 58 58 LYS CD C 13 28.929 0.200 . 1 . . . . . 58 LYS CD . 26747 1 627 . 1 . 1 58 58 LYS CG C 13 24.760 0.200 . 1 . . . . . 58 LYS CG . 26747 1 628 . 1 . 1 58 58 LYS H H 1 8.008 0.020 . 1 . . . . . 58 LYS H . 26747 1 629 . 1 . 1 58 58 LYS HA H 1 4.179 0.020 . 1 . . . . . 58 LYS HA . 26747 1 630 . 1 . 1 58 58 LYS HB2 H 1 1.741 0.020 . 1 . . . . . 58 LYS HB2 . 26747 1 631 . 1 . 1 58 58 LYS HB3 H 1 1.741 0.020 . 1 . . . . . 58 LYS HB3 . 26747 1 632 . 1 . 1 58 58 LYS HD2 H 1 1.652 0.020 . 1 . . . . . 58 LYS HD2 . 26747 1 633 . 1 . 1 58 58 LYS HD3 H 1 1.652 0.020 . 1 . . . . . 58 LYS HD3 . 26747 1 634 . 1 . 1 58 58 LYS HE2 H 1 2.959 0.020 . 1 . . . . . 58 LYS HE2 . 26747 1 635 . 1 . 1 58 58 LYS HE3 H 1 2.959 0.020 . 1 . . . . . 58 LYS HE3 . 26747 1 636 . 1 . 1 58 58 LYS HG2 H 1 1.398 0.020 . 1 . . . . . 58 LYS HG2 . 26747 1 637 . 1 . 1 58 58 LYS HG3 H 1 1.398 0.020 . 1 . . . . . 58 LYS HG3 . 26747 1 638 . 1 . 1 58 58 LYS N N 15 120.254 0.200 . 1 . . . . . 58 LYS N . 26747 1 639 . 1 . 1 59 59 LEU C C 13 177.301 0.200 . 1 . . . . . 59 LEU C . 26747 1 640 . 1 . 1 59 59 LEU CA C 13 55.825 0.200 . 1 . . . . . 59 LEU CA . 26747 1 641 . 1 . 1 59 59 LEU CB C 13 42.182 0.200 . 1 . . . . . 59 LEU CB . 26747 1 642 . 1 . 1 59 59 LEU CD1 C 13 24.915 0.200 . 2 . . . . . 59 LEU CD1 . 26747 1 643 . 1 . 1 59 59 LEU CD2 C 13 23.584 0.200 . 2 . . . . . 59 LEU CD2 . 26747 1 644 . 1 . 1 59 59 LEU CG C 13 26.877 0.200 . 1 . . . . . 59 LEU CG . 26747 1 645 . 1 . 1 59 59 LEU H H 1 7.854 0.020 . 1 . . . . . 59 LEU H . 26747 1 646 . 1 . 1 59 59 LEU HA H 1 4.231 0.020 . 1 . . . . . 59 LEU HA . 26747 1 647 . 1 . 1 59 59 LEU HB2 H 1 1.382 0.020 . 2 . . . . . 59 LEU HB2 . 26747 1 648 . 1 . 1 59 59 LEU HB3 H 1 1.504 0.020 . 2 . . . . . 59 LEU HB3 . 26747 1 649 . 1 . 1 59 59 LEU HD11 H 1 0.793 0.020 . 2 . . . . . 59 LEU HD11 . 26747 1 650 . 1 . 1 59 59 LEU HD12 H 1 0.793 0.020 . 2 . . . . . 59 LEU HD12 . 26747 1 651 . 1 . 1 59 59 LEU HD13 H 1 0.793 0.020 . 2 . . . . . 59 LEU HD13 . 26747 1 652 . 1 . 1 59 59 LEU HD21 H 1 0.835 0.020 . 2 . . . . . 59 LEU HD21 . 26747 1 653 . 1 . 1 59 59 LEU HD22 H 1 0.835 0.020 . 2 . . . . . 59 LEU HD22 . 26747 1 654 . 1 . 1 59 59 LEU HD23 H 1 0.835 0.020 . 2 . . . . . 59 LEU HD23 . 26747 1 655 . 1 . 1 59 59 LEU HG H 1 1.510 0.020 . 1 . . . . . 59 LEU HG . 26747 1 656 . 1 . 1 59 59 LEU N N 15 120.619 0.200 . 1 . . . . . 59 LEU N . 26747 1 657 . 1 . 1 60 60 TRP C C 13 176.099 0.200 . 1 . . . . . 60 TRP C . 26747 1 658 . 1 . 1 60 60 TRP CA C 13 57.161 0.200 . 1 . . . . . 60 TRP CA . 26747 1 659 . 1 . 1 60 60 TRP CB C 13 29.463 0.200 . 1 . . . . . 60 TRP CB . 26747 1 660 . 1 . 1 60 60 TRP H H 1 7.754 0.020 . 1 . . . . . 60 TRP H . 26747 1 661 . 1 . 1 60 60 TRP HA H 1 4.674 0.020 . 1 . . . . . 60 TRP HA . 26747 1 662 . 1 . 1 60 60 TRP HB2 H 1 3.221 0.020 . 2 . . . . . 60 TRP HB2 . 26747 1 663 . 1 . 1 60 60 TRP HB3 H 1 3.321 0.020 . 2 . . . . . 60 TRP HB3 . 26747 1 664 . 1 . 1 60 60 TRP N N 15 119.901 0.200 . 1 . . . . . 60 TRP N . 26747 1 665 . 1 . 1 61 61 ALA C C 13 177.612 0.200 . 1 . . . . . 61 ALA C . 26747 1 666 . 1 . 1 61 61 ALA CA C 13 52.847 0.200 . 1 . . . . . 61 ALA CA . 26747 1 667 . 1 . 1 61 61 ALA CB C 13 19.405 0.200 . 1 . . . . . 61 ALA CB . 26747 1 668 . 1 . 1 61 61 ALA H H 1 7.842 0.020 . 1 . . . . . 61 ALA H . 26747 1 669 . 1 . 1 61 61 ALA HA H 1 4.289 0.020 . 1 . . . . . 61 ALA HA . 26747 1 670 . 1 . 1 61 61 ALA HB1 H 1 1.338 0.020 . 1 . . . . . 61 ALA HB1 . 26747 1 671 . 1 . 1 61 61 ALA HB2 H 1 1.338 0.020 . 1 . . . . . 61 ALA HB2 . 26747 1 672 . 1 . 1 61 61 ALA HB3 H 1 1.338 0.020 . 1 . . . . . 61 ALA HB3 . 26747 1 673 . 1 . 1 61 61 ALA N N 15 124.183 0.200 . 1 . . . . . 61 ALA N . 26747 1 674 . 1 . 1 62 62 LYS C C 13 176.819 0.200 . 1 . . . . . 62 LYS C . 26747 1 675 . 1 . 1 62 62 LYS CA C 13 56.632 0.200 . 1 . . . . . 62 LYS CA . 26747 1 676 . 1 . 1 62 62 LYS CB C 13 32.807 0.200 . 1 . . . . . 62 LYS CB . 26747 1 677 . 1 . 1 62 62 LYS CD C 13 28.952 0.200 . 1 . . . . . 62 LYS CD . 26747 1 678 . 1 . 1 62 62 LYS CE C 13 42.190 0.200 . 1 . . . . . 62 LYS CE . 26747 1 679 . 1 . 1 62 62 LYS CG C 13 24.716 0.200 . 1 . . . . . 62 LYS CG . 26747 1 680 . 1 . 1 62 62 LYS H H 1 7.962 0.020 . 1 . . . . . 62 LYS H . 26747 1 681 . 1 . 1 62 62 LYS HA H 1 4.291 0.020 . 1 . . . . . 62 LYS HA . 26747 1 682 . 1 . 1 62 62 LYS HB2 H 1 1.763 0.020 . 2 . . . . . 62 LYS HB2 . 26747 1 683 . 1 . 1 62 62 LYS HB3 H 1 1.878 0.020 . 2 . . . . . 62 LYS HB3 . 26747 1 684 . 1 . 1 62 62 LYS HD2 H 1 1.702 0.020 . 1 . . . . . 62 LYS HD2 . 26747 1 685 . 1 . 1 62 62 LYS HD3 H 1 1.702 0.020 . 1 . . . . . 62 LYS HD3 . 26747 1 686 . 1 . 1 62 62 LYS HE2 H 1 3.021 0.020 . 1 . . . . . 62 LYS HE2 . 26747 1 687 . 1 . 1 62 62 LYS HE3 H 1 3.021 0.020 . 1 . . . . . 62 LYS HE3 . 26747 1 688 . 1 . 1 62 62 LYS HG2 H 1 1.464 0.020 . 1 . . . . . 62 LYS HG2 . 26747 1 689 . 1 . 1 62 62 LYS HG3 H 1 1.464 0.020 . 1 . . . . . 62 LYS HG3 . 26747 1 690 . 1 . 1 62 62 LYS N N 15 119.440 0.200 . 1 . . . . . 62 LYS N . 26747 1 691 . 1 . 1 63 63 SER C C 13 174.611 0.200 . 1 . . . . . 63 SER C . 26747 1 692 . 1 . 1 63 63 SER CA C 13 58.542 0.200 . 1 . . . . . 63 SER CA . 26747 1 693 . 1 . 1 63 63 SER CB C 13 64.046 0.200 . 1 . . . . . 63 SER CB . 26747 1 694 . 1 . 1 63 63 SER H H 1 8.084 0.020 . 1 . . . . . 63 SER H . 26747 1 695 . 1 . 1 63 63 SER HA H 1 4.477 0.020 . 1 . . . . . 63 SER HA . 26747 1 696 . 1 . 1 63 63 SER HB2 H 1 3.913 0.020 . 1 . . . . . 63 SER HB2 . 26747 1 697 . 1 . 1 63 63 SER HB3 H 1 3.913 0.020 . 1 . . . . . 63 SER HB3 . 26747 1 698 . 1 . 1 63 63 SER N N 15 115.767 0.200 . 1 . . . . . 63 SER N . 26747 1 699 . 1 . 1 64 64 SER C C 13 174.330 0.200 . 1 . . . . . 64 SER C . 26747 1 700 . 1 . 1 64 64 SER CA C 13 58.443 0.200 . 1 . . . . . 64 SER CA . 26747 1 701 . 1 . 1 64 64 SER CB C 13 63.882 0.200 . 1 . . . . . 64 SER CB . 26747 1 702 . 1 . 1 64 64 SER H H 1 8.149 0.020 . 1 . . . . . 64 SER H . 26747 1 703 . 1 . 1 64 64 SER HA H 1 4.469 0.020 . 1 . . . . . 64 SER HA . 26747 1 704 . 1 . 1 64 64 SER HB2 H 1 3.878 0.020 . 1 . . . . . 64 SER HB2 . 26747 1 705 . 1 . 1 64 64 SER HB3 H 1 3.878 0.020 . 1 . . . . . 64 SER HB3 . 26747 1 706 . 1 . 1 64 64 SER N N 15 117.063 0.200 . 1 . . . . . 64 SER N . 26747 1 707 . 1 . 1 65 65 GLN C C 13 175.596 0.200 . 1 . . . . . 65 GLN C . 26747 1 708 . 1 . 1 65 65 GLN CA C 13 55.709 0.200 . 1 . . . . . 65 GLN CA . 26747 1 709 . 1 . 1 65 65 GLN CB C 13 29.580 0.200 . 1 . . . . . 65 GLN CB . 26747 1 710 . 1 . 1 65 65 GLN CG C 13 33.906 0.200 . 1 . . . . . 65 GLN CG . 26747 1 711 . 1 . 1 65 65 GLN H H 1 8.178 0.020 . 1 . . . . . 65 GLN H . 26747 1 712 . 1 . 1 65 65 GLN HA H 1 4.391 0.020 . 1 . . . . . 65 GLN HA . 26747 1 713 . 1 . 1 65 65 GLN HB2 H 1 1.975 0.020 . 2 . . . . . 65 GLN HB2 . 26747 1 714 . 1 . 1 65 65 GLN HB3 H 1 2.125 0.020 . 2 . . . . . 65 GLN HB3 . 26747 1 715 . 1 . 1 65 65 GLN HG2 H 1 2.358 0.020 . 1 . . . . . 65 GLN HG2 . 26747 1 716 . 1 . 1 65 65 GLN HG3 H 1 2.358 0.020 . 1 . . . . . 65 GLN HG3 . 26747 1 717 . 1 . 1 65 65 GLN N N 15 121.503 0.200 . 1 . . . . . 65 GLN N . 26747 1 718 . 1 . 1 66 66 VAL C C 13 174.508 0.200 . 1 . . . . . 66 VAL C . 26747 1 719 . 1 . 1 66 66 VAL CA C 13 59.860 0.200 . 1 . . . . . 66 VAL CA . 26747 1 720 . 1 . 1 66 66 VAL CB C 13 32.468 0.200 . 1 . . . . . 66 VAL CB . 26747 1 721 . 1 . 1 66 66 VAL CG1 C 13 20.465 0.200 . 2 . . . . . 66 VAL CG1 . 26747 1 722 . 1 . 1 66 66 VAL CG2 C 13 21.237 0.200 . 2 . . . . . 66 VAL CG2 . 26747 1 723 . 1 . 1 66 66 VAL H H 1 7.944 0.020 . 1 . . . . . 66 VAL H . 26747 1 724 . 1 . 1 66 66 VAL HA H 1 4.397 0.020 . 1 . . . . . 66 VAL HA . 26747 1 725 . 1 . 1 66 66 VAL HB H 1 2.096 0.020 . 1 . . . . . 66 VAL HB . 26747 1 726 . 1 . 1 66 66 VAL HG11 H 1 0.946 0.020 . 2 . . . . . 66 VAL HG11 . 26747 1 727 . 1 . 1 66 66 VAL HG12 H 1 0.946 0.020 . 2 . . . . . 66 VAL HG12 . 26747 1 728 . 1 . 1 66 66 VAL HG13 H 1 0.946 0.020 . 2 . . . . . 66 VAL HG13 . 26747 1 729 . 1 . 1 66 66 VAL HG21 H 1 0.968 0.020 . 2 . . . . . 66 VAL HG21 . 26747 1 730 . 1 . 1 66 66 VAL HG22 H 1 0.968 0.020 . 2 . . . . . 66 VAL HG22 . 26747 1 731 . 1 . 1 66 66 VAL HG23 H 1 0.968 0.020 . 2 . . . . . 66 VAL HG23 . 26747 1 732 . 1 . 1 66 66 VAL N N 15 121.642 0.200 . 1 . . . . . 66 VAL N . 26747 1 733 . 1 . 1 67 67 PRO C C 13 176.951 0.200 . 1 . . . . . 67 PRO C . 26747 1 734 . 1 . 1 67 67 PRO CA C 13 63.459 0.200 . 1 . . . . . 67 PRO CA . 26747 1 735 . 1 . 1 67 67 PRO CB C 13 32.025 0.200 . 1 . . . . . 67 PRO CB . 26747 1 736 . 1 . 1 67 67 PRO CD C 13 51.025 0.200 . 1 . . . . . 67 PRO CD . 26747 1 737 . 1 . 1 67 67 PRO CG C 13 27.440 0.200 . 1 . . . . . 67 PRO CG . 26747 1 738 . 1 . 1 67 67 PRO HA H 1 4.410 0.020 . 1 . . . . . 67 PRO HA . 26747 1 739 . 1 . 1 67 67 PRO HB2 H 1 2.302 0.020 . 2 . . . . . 67 PRO HB2 . 26747 1 740 . 1 . 1 67 67 PRO HB3 H 1 1.911 0.020 . 2 . . . . . 67 PRO HB3 . 26747 1 741 . 1 . 1 67 67 PRO HD2 H 1 3.853 0.020 . 2 . . . . . 67 PRO HD2 . 26747 1 742 . 1 . 1 67 67 PRO HD3 H 1 3.650 0.020 . 2 . . . . . 67 PRO HD3 . 26747 1 743 . 1 . 1 67 67 PRO HG2 H 1 2.021 0.020 . 1 . . . . . 67 PRO HG2 . 26747 1 744 . 1 . 1 67 67 PRO HG3 H 1 2.021 0.020 . 1 . . . . . 67 PRO HG3 . 26747 1 745 . 1 . 1 68 68 GLN C C 13 176.198 0.200 . 1 . . . . . 68 GLN C . 26747 1 746 . 1 . 1 68 68 GLN CA C 13 56.169 0.200 . 1 . . . . . 68 GLN CA . 26747 1 747 . 1 . 1 68 68 GLN CB C 13 29.534 0.200 . 1 . . . . . 68 GLN CB . 26747 1 748 . 1 . 1 68 68 GLN CG C 13 33.929 0.200 . 1 . . . . . 68 GLN CG . 26747 1 749 . 1 . 1 68 68 GLN H H 1 8.353 0.020 . 1 . . . . . 68 GLN H . 26747 1 750 . 1 . 1 68 68 GLN HA H 1 4.331 0.020 . 1 . . . . . 68 GLN HA . 26747 1 751 . 1 . 1 68 68 GLN HB2 H 1 2.011 0.020 . 2 . . . . . 68 GLN HB2 . 26747 1 752 . 1 . 1 68 68 GLN HB3 H 1 2.137 0.020 . 2 . . . . . 68 GLN HB3 . 26747 1 753 . 1 . 1 68 68 GLN HG2 H 1 2.429 0.020 . 1 . . . . . 68 GLN HG2 . 26747 1 754 . 1 . 1 68 68 GLN HG3 H 1 2.429 0.020 . 1 . . . . . 68 GLN HG3 . 26747 1 755 . 1 . 1 68 68 GLN N N 15 120.177 0.200 . 1 . . . . . 68 GLN N . 26747 1 756 . 1 . 1 69 69 SER C C 13 174.596 0.200 . 1 . . . . . 69 SER C . 26747 1 757 . 1 . 1 69 69 SER CA C 13 58.422 0.200 . 1 . . . . . 69 SER CA . 26747 1 758 . 1 . 1 69 69 SER CB C 13 63.874 0.200 . 1 . . . . . 69 SER CB . 26747 1 759 . 1 . 1 69 69 SER H H 1 8.158 0.020 . 1 . . . . . 69 SER H . 26747 1 760 . 1 . 1 69 69 SER HA H 1 4.433 0.020 . 1 . . . . . 69 SER HA . 26747 1 761 . 1 . 1 69 69 SER HB2 H 1 3.899 0.020 . 1 . . . . . 69 SER HB2 . 26747 1 762 . 1 . 1 69 69 SER HB3 H 1 3.899 0.020 . 1 . . . . . 69 SER HB3 . 26747 1 763 . 1 . 1 69 69 SER N N 15 116.168 0.200 . 1 . . . . . 69 SER N . 26747 1 764 . 1 . 1 70 70 ARG C C 13 175.823 0.200 . 1 . . . . . 70 ARG C . 26747 1 765 . 1 . 1 70 70 ARG CA C 13 56.161 0.200 . 1 . . . . . 70 ARG CA . 26747 1 766 . 1 . 1 70 70 ARG CB C 13 30.841 0.200 . 1 . . . . . 70 ARG CB . 26747 1 767 . 1 . 1 70 70 ARG CD C 13 43.391 0.200 . 1 . . . . . 70 ARG CD . 26747 1 768 . 1 . 1 70 70 ARG CG C 13 27.124 0.200 . 1 . . . . . 70 ARG CG . 26747 1 769 . 1 . 1 70 70 ARG H H 1 8.221 0.020 . 1 . . . . . 70 ARG H . 26747 1 770 . 1 . 1 70 70 ARG HA H 1 4.366 0.020 . 1 . . . . . 70 ARG HA . 26747 1 771 . 1 . 1 70 70 ARG HB2 H 1 1.769 0.020 . 2 . . . . . 70 ARG HB2 . 26747 1 772 . 1 . 1 70 70 ARG HB3 H 1 1.886 0.020 . 2 . . . . . 70 ARG HB3 . 26747 1 773 . 1 . 1 70 70 ARG HD2 H 1 3.194 0.020 . 1 . . . . . 70 ARG HD2 . 26747 1 774 . 1 . 1 70 70 ARG HD3 H 1 3.194 0.020 . 1 . . . . . 70 ARG HD3 . 26747 1 775 . 1 . 1 70 70 ARG HG2 H 1 1.651 0.020 . 1 . . . . . 70 ARG HG2 . 26747 1 776 . 1 . 1 70 70 ARG HG3 H 1 1.651 0.020 . 1 . . . . . 70 ARG HG3 . 26747 1 777 . 1 . 1 70 70 ARG N N 15 122.098 0.200 . 1 . . . . . 70 ARG N . 26747 1 778 . 1 . 1 71 71 ASN C C 13 175.338 0.200 . 1 . . . . . 71 ASN C . 26747 1 779 . 1 . 1 71 71 ASN CA C 13 53.274 0.200 . 1 . . . . . 71 ASN CA . 26747 1 780 . 1 . 1 71 71 ASN CB C 13 38.837 0.200 . 1 . . . . . 71 ASN CB . 26747 1 781 . 1 . 1 71 71 ASN H H 1 8.250 0.020 . 1 . . . . . 71 ASN H . 26747 1 782 . 1 . 1 71 71 ASN HA H 1 4.729 0.020 . 1 . . . . . 71 ASN HA . 26747 1 783 . 1 . 1 71 71 ASN HB2 H 1 2.867 0.020 . 2 . . . . . 71 ASN HB2 . 26747 1 784 . 1 . 1 71 71 ASN HB3 H 1 2.757 0.020 . 2 . . . . . 71 ASN HB3 . 26747 1 785 . 1 . 1 71 71 ASN N N 15 119.244 0.200 . 1 . . . . . 71 ASN N . 26747 1 786 . 1 . 1 72 72 ILE C C 13 175.961 0.200 . 1 . . . . . 72 ILE C . 26747 1 787 . 1 . 1 72 72 ILE CA C 13 61.558 0.200 . 1 . . . . . 72 ILE CA . 26747 1 788 . 1 . 1 72 72 ILE CB C 13 38.649 0.200 . 1 . . . . . 72 ILE CB . 26747 1 789 . 1 . 1 72 72 ILE CD1 C 13 13.033 0.200 . 1 . . . . . 72 ILE CD1 . 26747 1 790 . 1 . 1 72 72 ILE CG1 C 13 27.369 0.200 . 1 . . . . . 72 ILE CG1 . 26747 1 791 . 1 . 1 72 72 ILE CG2 C 13 17.610 0.200 . 1 . . . . . 72 ILE CG2 . 26747 1 792 . 1 . 1 72 72 ILE H H 1 7.948 0.020 . 1 . . . . . 72 ILE H . 26747 1 793 . 1 . 1 72 72 ILE HA H 1 4.147 0.020 . 1 . . . . . 72 ILE HA . 26747 1 794 . 1 . 1 72 72 ILE HB H 1 1.904 0.020 . 1 . . . . . 72 ILE HB . 26747 1 795 . 1 . 1 72 72 ILE HD11 H 1 0.856 0.020 . 1 . . . . . 72 ILE HD11 . 26747 1 796 . 1 . 1 72 72 ILE HD12 H 1 0.856 0.020 . 1 . . . . . 72 ILE HD12 . 26747 1 797 . 1 . 1 72 72 ILE HD13 H 1 0.856 0.020 . 1 . . . . . 72 ILE HD13 . 26747 1 798 . 1 . 1 72 72 ILE HG12 H 1 1.462 0.020 . 2 . . . . . 72 ILE HG12 . 26747 1 799 . 1 . 1 72 72 ILE HG13 H 1 1.202 0.020 . 2 . . . . . 72 ILE HG13 . 26747 1 800 . 1 . 1 72 72 ILE HG21 H 1 0.922 0.020 . 1 . . . . . 72 ILE HG21 . 26747 1 801 . 1 . 1 72 72 ILE HG22 H 1 0.922 0.020 . 1 . . . . . 72 ILE HG22 . 26747 1 802 . 1 . 1 72 72 ILE HG23 H 1 0.922 0.020 . 1 . . . . . 72 ILE HG23 . 26747 1 803 . 1 . 1 72 72 ILE N N 15 120.835 0.200 . 1 . . . . . 72 ILE N . 26747 1 804 . 1 . 1 73 73 ALA C C 13 177.615 0.200 . 1 . . . . . 73 ALA C . 26747 1 805 . 1 . 1 73 73 ALA CA C 13 52.983 0.200 . 1 . . . . . 73 ALA CA . 26747 1 806 . 1 . 1 73 73 ALA CB C 13 19.190 0.200 . 1 . . . . . 73 ALA CB . 26747 1 807 . 1 . 1 73 73 ALA H H 1 8.149 0.020 . 1 . . . . . 73 ALA H . 26747 1 808 . 1 . 1 73 73 ALA HA H 1 4.312 0.020 . 1 . . . . . 73 ALA HA . 26747 1 809 . 1 . 1 73 73 ALA HB1 H 1 1.402 0.020 . 1 . . . . . 73 ALA HB1 . 26747 1 810 . 1 . 1 73 73 ALA HB2 H 1 1.402 0.020 . 1 . . . . . 73 ALA HB2 . 26747 1 811 . 1 . 1 73 73 ALA HB3 H 1 1.402 0.020 . 1 . . . . . 73 ALA HB3 . 26747 1 812 . 1 . 1 73 73 ALA N N 15 126.020 0.200 . 1 . . . . . 73 ALA N . 26747 1 813 . 1 . 1 74 74 ASP C C 13 175.524 0.200 . 1 . . . . . 74 ASP C . 26747 1 814 . 1 . 1 74 74 ASP CA C 13 53.286 0.200 . 1 . . . . . 74 ASP CA . 26747 1 815 . 1 . 1 74 74 ASP CB C 13 38.259 0.200 . 1 . . . . . 74 ASP CB . 26747 1 816 . 1 . 1 74 74 ASP H H 1 8.123 0.020 . 1 . . . . . 74 ASP H . 26747 1 817 . 1 . 1 74 74 ASP HA H 1 4.728 0.020 . 1 . . . . . 74 ASP HA . 26747 1 818 . 1 . 1 74 74 ASP HB2 H 1 2.952 0.020 . 2 . . . . . 74 ASP HB2 . 26747 1 819 . 1 . 1 74 74 ASP HB3 H 1 2.844 0.020 . 2 . . . . . 74 ASP HB3 . 26747 1 820 . 1 . 1 74 74 ASP N N 15 117.302 0.200 . 1 . . . . . 74 ASP N . 26747 1 821 . 1 . 1 75 75 ILE C C 13 176.505 0.200 . 1 . . . . . 75 ILE C . 26747 1 822 . 1 . 1 75 75 ILE CA C 13 61.887 0.200 . 1 . . . . . 75 ILE CA . 26747 1 823 . 1 . 1 75 75 ILE CB C 13 38.644 0.200 . 1 . . . . . 75 ILE CB . 26747 1 824 . 1 . 1 75 75 ILE CD1 C 13 13.091 0.200 . 1 . . . . . 75 ILE CD1 . 26747 1 825 . 1 . 1 75 75 ILE CG1 C 13 27.513 0.200 . 1 . . . . . 75 ILE CG1 . 26747 1 826 . 1 . 1 75 75 ILE CG2 C 13 17.548 0.200 . 1 . . . . . 75 ILE CG2 . 26747 1 827 . 1 . 1 75 75 ILE H H 1 7.861 0.020 . 1 . . . . . 75 ILE H . 26747 1 828 . 1 . 1 75 75 ILE HA H 1 4.157 0.020 . 1 . . . . . 75 ILE HA . 26747 1 829 . 1 . 1 75 75 ILE HB H 1 1.940 0.020 . 1 . . . . . 75 ILE HB . 26747 1 830 . 1 . 1 75 75 ILE HD11 H 1 0.879 0.020 . 1 . . . . . 75 ILE HD11 . 26747 1 831 . 1 . 1 75 75 ILE HD12 H 1 0.879 0.020 . 1 . . . . . 75 ILE HD12 . 26747 1 832 . 1 . 1 75 75 ILE HD13 H 1 0.879 0.020 . 1 . . . . . 75 ILE HD13 . 26747 1 833 . 1 . 1 75 75 ILE HG12 H 1 1.489 0.020 . 2 . . . . . 75 ILE HG12 . 26747 1 834 . 1 . 1 75 75 ILE HG13 H 1 1.221 0.020 . 2 . . . . . 75 ILE HG13 . 26747 1 835 . 1 . 1 75 75 ILE HG21 H 1 0.926 0.020 . 1 . . . . . 75 ILE HG21 . 26747 1 836 . 1 . 1 75 75 ILE HG22 H 1 0.926 0.020 . 1 . . . . . 75 ILE HG22 . 26747 1 837 . 1 . 1 75 75 ILE HG23 H 1 0.926 0.020 . 1 . . . . . 75 ILE HG23 . 26747 1 838 . 1 . 1 75 75 ILE N N 15 120.195 0.200 . 1 . . . . . 75 ILE N . 26747 1 839 . 1 . 1 76 76 SER C C 13 174.773 0.200 . 1 . . . . . 76 SER C . 26747 1 840 . 1 . 1 76 76 SER CA C 13 59.017 0.200 . 1 . . . . . 76 SER CA . 26747 1 841 . 1 . 1 76 76 SER CB C 13 63.650 0.200 . 1 . . . . . 76 SER CB . 26747 1 842 . 1 . 1 76 76 SER H H 1 8.136 0.020 . 1 . . . . . 76 SER H . 26747 1 843 . 1 . 1 76 76 SER HA H 1 4.398 0.020 . 1 . . . . . 76 SER HA . 26747 1 844 . 1 . 1 76 76 SER HB2 H 1 3.909 0.020 . 1 . . . . . 76 SER HB2 . 26747 1 845 . 1 . 1 76 76 SER HB3 H 1 3.909 0.020 . 1 . . . . . 76 SER HB3 . 26747 1 846 . 1 . 1 76 76 SER N N 15 118.103 0.200 . 1 . . . . . 76 SER N . 26747 1 847 . 1 . 1 77 77 ALA C C 13 177.772 0.200 . 1 . . . . . 77 ALA C . 26747 1 848 . 1 . 1 77 77 ALA CA C 13 53.248 0.200 . 1 . . . . . 77 ALA CA . 26747 1 849 . 1 . 1 77 77 ALA CB C 13 19.089 0.200 . 1 . . . . . 77 ALA CB . 26747 1 850 . 1 . 1 77 77 ALA H H 1 8.050 0.020 . 1 . . . . . 77 ALA H . 26747 1 851 . 1 . 1 77 77 ALA HA H 1 4.284 0.020 . 1 . . . . . 77 ALA HA . 26747 1 852 . 1 . 1 77 77 ALA HB1 H 1 1.418 0.020 . 1 . . . . . 77 ALA HB1 . 26747 1 853 . 1 . 1 77 77 ALA HB2 H 1 1.418 0.020 . 1 . . . . . 77 ALA HB2 . 26747 1 854 . 1 . 1 77 77 ALA HB3 H 1 1.418 0.020 . 1 . . . . . 77 ALA HB3 . 26747 1 855 . 1 . 1 77 77 ALA N N 15 124.823 0.200 . 1 . . . . . 77 ALA N . 26747 1 856 . 1 . 1 78 78 ASP C C 13 175.591 0.200 . 1 . . . . . 78 ASP C . 26747 1 857 . 1 . 1 78 78 ASP CA C 13 53.625 0.200 . 1 . . . . . 78 ASP CA . 26747 1 858 . 1 . 1 78 78 ASP CB C 13 38.083 0.200 . 1 . . . . . 78 ASP CB . 26747 1 859 . 1 . 1 78 78 ASP H H 1 8.093 0.020 . 1 . . . . . 78 ASP H . 26747 1 860 . 1 . 1 78 78 ASP HA H 1 4.614 0.020 . 1 . . . . . 78 ASP HA . 26747 1 861 . 1 . 1 78 78 ASP HB2 H 1 2.880 0.020 . 1 . . . . . 78 ASP HB2 . 26747 1 862 . 1 . 1 78 78 ASP HB3 H 1 2.880 0.020 . 1 . . . . . 78 ASP HB3 . 26747 1 863 . 1 . 1 78 78 ASP N N 15 116.696 0.200 . 1 . . . . . 78 ASP N . 26747 1 864 . 1 . 1 79 79 LYS C C 13 176.679 0.200 . 1 . . . . . 79 LYS C . 26747 1 865 . 1 . 1 79 79 LYS CA C 13 57.253 0.200 . 1 . . . . . 79 LYS CA . 26747 1 866 . 1 . 1 79 79 LYS CB C 13 32.580 0.200 . 1 . . . . . 79 LYS CB . 26747 1 867 . 1 . 1 79 79 LYS CD C 13 29.032 0.200 . 1 . . . . . 79 LYS CD . 26747 1 868 . 1 . 1 79 79 LYS CE C 13 42.296 0.200 . 1 . . . . . 79 LYS CE . 26747 1 869 . 1 . 1 79 79 LYS CG C 13 24.619 0.200 . 1 . . . . . 79 LYS CG . 26747 1 870 . 1 . 1 79 79 LYS H H 1 7.947 0.020 . 1 . . . . . 79 LYS H . 26747 1 871 . 1 . 1 79 79 LYS HA H 1 4.173 0.020 . 1 . . . . . 79 LYS HA . 26747 1 872 . 1 . 1 79 79 LYS HB2 H 1 1.695 0.020 . 1 . . . . . 79 LYS HB2 . 26747 1 873 . 1 . 1 79 79 LYS HB3 H 1 1.695 0.020 . 1 . . . . . 79 LYS HB3 . 26747 1 874 . 1 . 1 79 79 LYS HD2 H 1 1.624 0.020 . 1 . . . . . 79 LYS HD2 . 26747 1 875 . 1 . 1 79 79 LYS HD3 H 1 1.624 0.020 . 1 . . . . . 79 LYS HD3 . 26747 1 876 . 1 . 1 79 79 LYS HE2 H 1 2.952 0.020 . 1 . . . . . 79 LYS HE2 . 26747 1 877 . 1 . 1 79 79 LYS HE3 H 1 2.952 0.020 . 1 . . . . . 79 LYS HE3 . 26747 1 878 . 1 . 1 79 79 LYS HG2 H 1 1.298 0.020 . 1 . . . . . 79 LYS HG2 . 26747 1 879 . 1 . 1 79 79 LYS HG3 H 1 1.298 0.020 . 1 . . . . . 79 LYS HG3 . 26747 1 880 . 1 . 1 79 79 LYS N N 15 121.034 0.200 . 1 . . . . . 79 LYS N . 26747 1 881 . 1 . 1 80 80 PHE C C 13 176.121 0.200 . 1 . . . . . 80 PHE C . 26747 1 882 . 1 . 1 80 80 PHE CA C 13 58.219 0.200 . 1 . . . . . 80 PHE CA . 26747 1 883 . 1 . 1 80 80 PHE CB C 13 39.059 0.200 . 1 . . . . . 80 PHE CB . 26747 1 884 . 1 . 1 80 80 PHE H H 1 7.849 0.020 . 1 . . . . . 80 PHE H . 26747 1 885 . 1 . 1 80 80 PHE HA H 1 4.579 0.020 . 1 . . . . . 80 PHE HA . 26747 1 886 . 1 . 1 80 80 PHE HB2 H 1 3.049 0.020 . 2 . . . . . 80 PHE HB2 . 26747 1 887 . 1 . 1 80 80 PHE HB3 H 1 3.202 0.020 . 2 . . . . . 80 PHE HB3 . 26747 1 888 . 1 . 1 80 80 PHE N N 15 118.622 0.200 . 1 . . . . . 80 PHE N . 26747 1 889 . 1 . 1 81 81 LEU C C 13 177.217 0.200 . 1 . . . . . 81 LEU C . 26747 1 890 . 1 . 1 81 81 LEU CA C 13 55.930 0.200 . 1 . . . . . 81 LEU CA . 26747 1 891 . 1 . 1 81 81 LEU CB C 13 42.314 0.200 . 1 . . . . . 81 LEU CB . 26747 1 892 . 1 . 1 81 81 LEU CD1 C 13 24.793 0.200 . 2 . . . . . 81 LEU CD1 . 26747 1 893 . 1 . 1 81 81 LEU CD2 C 13 24.163 0.200 . 2 . . . . . 81 LEU CD2 . 26747 1 894 . 1 . 1 81 81 LEU CG C 13 26.998 0.200 . 1 . . . . . 81 LEU CG . 26747 1 895 . 1 . 1 81 81 LEU H H 1 7.762 0.020 . 1 . . . . . 81 LEU H . 26747 1 896 . 1 . 1 81 81 LEU HA H 1 4.227 0.020 . 1 . . . . . 81 LEU HA . 26747 1 897 . 1 . 1 81 81 LEU HB2 H 1 1.613 0.020 . 1 . . . . . 81 LEU HB2 . 26747 1 898 . 1 . 1 81 81 LEU HB3 H 1 1.613 0.020 . 1 . . . . . 81 LEU HB3 . 26747 1 899 . 1 . 1 81 81 LEU HG H 1 1.578 0.020 . 1 . . . . . 81 LEU HG . 26747 1 900 . 1 . 1 81 81 LEU N N 15 121.314 0.200 . 1 . . . . . 81 LEU N . 26747 1 901 . 1 . 1 82 82 ASP C C 13 175.687 0.200 . 1 . . . . . 82 ASP C . 26747 1 902 . 1 . 1 82 82 ASP CA C 13 53.920 0.200 . 1 . . . . . 82 ASP CA . 26747 1 903 . 1 . 1 82 82 ASP CB C 13 38.194 0.200 . 1 . . . . . 82 ASP CB . 26747 1 904 . 1 . 1 82 82 ASP H H 1 8.142 0.020 . 1 . . . . . 82 ASP H . 26747 1 905 . 1 . 1 82 82 ASP HA H 1 4.582 0.020 . 1 . . . . . 82 ASP HA . 26747 1 906 . 1 . 1 82 82 ASP HB2 H 1 2.941 0.020 . 2 . . . . . 82 ASP HB2 . 26747 1 907 . 1 . 1 82 82 ASP HB3 H 1 2.874 0.020 . 2 . . . . . 82 ASP HB3 . 26747 1 908 . 1 . 1 82 82 ASP N N 15 118.050 0.200 . 1 . . . . . 82 ASP N . 26747 1 909 . 1 . 1 83 83 ASP C C 13 175.300 0.200 . 1 . . . . . 83 ASP C . 26747 1 910 . 1 . 1 83 83 ASP CA C 13 53.989 0.200 . 1 . . . . . 83 ASP CA . 26747 1 911 . 1 . 1 83 83 ASP CB C 13 38.230 0.200 . 1 . . . . . 83 ASP CB . 26747 1 912 . 1 . 1 83 83 ASP H H 1 8.214 0.020 . 1 . . . . . 83 ASP H . 26747 1 913 . 1 . 1 83 83 ASP HA H 1 4.660 0.020 . 1 . . . . . 83 ASP HA . 26747 1 914 . 1 . 1 83 83 ASP HB2 H 1 2.918 0.020 . 1 . . . . . 83 ASP HB2 . 26747 1 915 . 1 . 1 83 83 ASP HB3 H 1 2.918 0.020 . 1 . . . . . 83 ASP HB3 . 26747 1 916 . 1 . 1 83 83 ASP N N 15 118.937 0.200 . 1 . . . . . 83 ASP N . 26747 1 917 . 1 . 1 84 84 ASP C C 13 175.946 0.200 . 1 . . . . . 84 ASP C . 26747 1 918 . 1 . 1 84 84 ASP CA C 13 54.012 0.200 . 1 . . . . . 84 ASP CA . 26747 1 919 . 1 . 1 84 84 ASP CB C 13 38.115 0.200 . 1 . . . . . 84 ASP CB . 26747 1 920 . 1 . 1 84 84 ASP H H 1 8.172 0.020 . 1 . . . . . 84 ASP H . 26747 1 921 . 1 . 1 84 84 ASP HA H 1 4.672 0.020 . 1 . . . . . 84 ASP HA . 26747 1 922 . 1 . 1 84 84 ASP HB2 H 1 2.909 0.020 . 1 . . . . . 84 ASP HB2 . 26747 1 923 . 1 . 1 84 84 ASP HB3 H 1 2.909 0.020 . 1 . . . . . 84 ASP HB3 . 26747 1 924 . 1 . 1 84 84 ASP N N 15 118.945 0.200 . 1 . . . . . 84 ASP N . 26747 1 925 . 1 . 1 85 85 ILE C C 13 176.985 0.200 . 1 . . . . . 85 ILE C . 26747 1 926 . 1 . 1 85 85 ILE CA C 13 62.802 0.200 . 1 . . . . . 85 ILE CA . 26747 1 927 . 1 . 1 85 85 ILE CB C 13 38.130 0.200 . 1 . . . . . 85 ILE CB . 26747 1 928 . 1 . 1 85 85 ILE CD1 C 13 13.031 0.200 . 1 . . . . . 85 ILE CD1 . 26747 1 929 . 1 . 1 85 85 ILE CG1 C 13 28.170 0.200 . 1 . . . . . 85 ILE CG1 . 26747 1 930 . 1 . 1 85 85 ILE CG2 C 13 17.746 0.200 . 1 . . . . . 85 ILE CG2 . 26747 1 931 . 1 . 1 85 85 ILE H H 1 7.998 0.020 . 1 . . . . . 85 ILE H . 26747 1 932 . 1 . 1 85 85 ILE HA H 1 4.065 0.020 . 1 . . . . . 85 ILE HA . 26747 1 933 . 1 . 1 85 85 ILE HB H 1 1.948 0.020 . 1 . . . . . 85 ILE HB . 26747 1 934 . 1 . 1 85 85 ILE HG12 H 1 1.199 0.020 . 2 . . . . . 85 ILE HG12 . 26747 1 935 . 1 . 1 85 85 ILE HG13 H 1 1.522 0.020 . 2 . . . . . 85 ILE HG13 . 26747 1 936 . 1 . 1 85 85 ILE HG21 H 1 0.899 0.020 . 1 . . . . . 85 ILE HG21 . 26747 1 937 . 1 . 1 85 85 ILE HG22 H 1 0.899 0.020 . 1 . . . . . 85 ILE HG22 . 26747 1 938 . 1 . 1 85 85 ILE HG23 H 1 0.899 0.020 . 1 . . . . . 85 ILE HG23 . 26747 1 939 . 1 . 1 85 85 ILE N N 15 120.165 0.200 . 1 . . . . . 85 ILE N . 26747 1 940 . 1 . 1 86 86 THR C C 13 175.575 0.200 . 1 . . . . . 86 THR C . 26747 1 941 . 1 . 1 86 86 THR CA C 13 64.986 0.200 . 1 . . . . . 86 THR CA . 26747 1 942 . 1 . 1 86 86 THR CB C 13 68.861 0.200 . 1 . . . . . 86 THR CB . 26747 1 943 . 1 . 1 86 86 THR CG2 C 13 21.836 0.200 . 1 . . . . . 86 THR CG2 . 26747 1 944 . 1 . 1 86 86 THR H H 1 7.958 0.020 . 1 . . . . . 86 THR H . 26747 1 945 . 1 . 1 86 86 THR HA H 1 4.009 0.020 . 1 . . . . . 86 THR HA . 26747 1 946 . 1 . 1 86 86 THR HB H 1 4.239 0.020 . 1 . . . . . 86 THR HB . 26747 1 947 . 1 . 1 86 86 THR HG21 H 1 1.228 0.020 . 1 . . . . . 86 THR HG21 . 26747 1 948 . 1 . 1 86 86 THR HG22 H 1 1.228 0.020 . 1 . . . . . 86 THR HG22 . 26747 1 949 . 1 . 1 86 86 THR HG23 H 1 1.228 0.020 . 1 . . . . . 86 THR HG23 . 26747 1 950 . 1 . 1 86 86 THR N N 15 116.120 0.200 . 1 . . . . . 86 THR N . 26747 1 951 . 1 . 1 87 87 ASP C C 13 176.578 0.200 . 1 . . . . . 87 ASP C . 26747 1 952 . 1 . 1 87 87 ASP CA C 13 55.027 0.200 . 1 . . . . . 87 ASP CA . 26747 1 953 . 1 . 1 87 87 ASP CB C 13 37.985 0.200 . 1 . . . . . 87 ASP CB . 26747 1 954 . 1 . 1 87 87 ASP H H 1 8.115 0.020 . 1 . . . . . 87 ASP H . 26747 1 955 . 1 . 1 87 87 ASP HA H 1 4.561 0.020 . 1 . . . . . 87 ASP HA . 26747 1 956 . 1 . 1 87 87 ASP HB2 H 1 2.922 0.020 . 1 . . . . . 87 ASP HB2 . 26747 1 957 . 1 . 1 87 87 ASP HB3 H 1 2.922 0.020 . 1 . . . . . 87 ASP HB3 . 26747 1 958 . 1 . 1 87 87 ASP N N 15 119.793 0.200 . 1 . . . . . 87 ASP N . 26747 1 959 . 1 . 1 88 88 ASP C C 13 176.469 0.200 . 1 . . . . . 88 ASP C . 26747 1 960 . 1 . 1 88 88 ASP CA C 13 55.185 0.200 . 1 . . . . . 88 ASP CA . 26747 1 961 . 1 . 1 88 88 ASP CB C 13 37.957 0.200 . 1 . . . . . 88 ASP CB . 26747 1 962 . 1 . 1 88 88 ASP H H 1 8.143 0.020 . 1 . . . . . 88 ASP H . 26747 1 963 . 1 . 1 88 88 ASP HA H 1 4.663 0.020 . 1 . . . . . 88 ASP HA . 26747 1 964 . 1 . 1 88 88 ASP HB2 H 1 2.811 0.020 . 2 . . . . . 88 ASP HB2 . 26747 1 965 . 1 . 1 88 88 ASP HB3 H 1 3.001 0.020 . 2 . . . . . 88 ASP HB3 . 26747 1 966 . 1 . 1 88 88 ASP N N 15 119.587 0.200 . 1 . . . . . 88 ASP N . 26747 1 967 . 1 . 1 89 89 ILE C C 13 177.188 0.200 . 1 . . . . . 89 ILE C . 26747 1 968 . 1 . 1 89 89 ILE CA C 13 63.760 0.200 . 1 . . . . . 89 ILE CA . 26747 1 969 . 1 . 1 89 89 ILE CB C 13 37.934 0.200 . 1 . . . . . 89 ILE CB . 26747 1 970 . 1 . 1 89 89 ILE CD1 C 13 13.400 0.200 . 1 . . . . . 89 ILE CD1 . 26747 1 971 . 1 . 1 89 89 ILE CG1 C 13 28.180 0.200 . 1 . . . . . 89 ILE CG1 . 26747 1 972 . 1 . 1 89 89 ILE CG2 C 13 17.527 0.200 . 1 . . . . . 89 ILE CG2 . 26747 1 973 . 1 . 1 89 89 ILE H H 1 8.069 0.020 . 1 . . . . . 89 ILE H . 26747 1 974 . 1 . 1 89 89 ILE HA H 1 3.834 0.020 . 1 . . . . . 89 ILE HA . 26747 1 975 . 1 . 1 89 89 ILE HB H 1 1.966 0.020 . 1 . . . . . 89 ILE HB . 26747 1 976 . 1 . 1 89 89 ILE HD11 H 1 0.800 0.020 . 1 . . . . . 89 ILE HD11 . 26747 1 977 . 1 . 1 89 89 ILE HD12 H 1 0.800 0.020 . 1 . . . . . 89 ILE HD12 . 26747 1 978 . 1 . 1 89 89 ILE HD13 H 1 0.800 0.020 . 1 . . . . . 89 ILE HD13 . 26747 1 979 . 1 . 1 89 89 ILE HG12 H 1 1.128 0.020 . 2 . . . . . 89 ILE HG12 . 26747 1 980 . 1 . 1 89 89 ILE HG13 H 1 1.635 0.020 . 2 . . . . . 89 ILE HG13 . 26747 1 981 . 1 . 1 89 89 ILE HG21 H 1 0.897 0.020 . 1 . . . . . 89 ILE HG21 . 26747 1 982 . 1 . 1 89 89 ILE HG22 H 1 0.897 0.020 . 1 . . . . . 89 ILE HG22 . 26747 1 983 . 1 . 1 89 89 ILE HG23 H 1 0.897 0.020 . 1 . . . . . 89 ILE HG23 . 26747 1 984 . 1 . 1 89 89 ILE N N 15 120.543 0.200 . 1 . . . . . 89 ILE N . 26747 1 985 . 1 . 1 90 90 MET C C 13 177.961 0.200 . 1 . . . . . 90 MET C . 26747 1 986 . 1 . 1 90 90 MET CA C 13 57.399 0.200 . 1 . . . . . 90 MET CA . 26747 1 987 . 1 . 1 90 90 MET CB C 13 32.092 0.200 . 1 . . . . . 90 MET CB . 26747 1 988 . 1 . 1 90 90 MET CG C 13 32.331 0.200 . 1 . . . . . 90 MET CG . 26747 1 989 . 1 . 1 90 90 MET H H 1 8.068 0.020 . 1 . . . . . 90 MET H . 26747 1 990 . 1 . 1 90 90 MET HA H 1 4.268 0.020 . 1 . . . . . 90 MET HA . 26747 1 991 . 1 . 1 90 90 MET HB2 H 1 2.139 0.020 . 1 . . . . . 90 MET HB2 . 26747 1 992 . 1 . 1 90 90 MET HB3 H 1 2.139 0.020 . 1 . . . . . 90 MET HB3 . 26747 1 993 . 1 . 1 90 90 MET HG2 H 1 2.633 0.020 . 2 . . . . . 90 MET HG2 . 26747 1 994 . 1 . 1 90 90 MET HG3 H 1 2.745 0.020 . 2 . . . . . 90 MET HG3 . 26747 1 995 . 1 . 1 90 90 MET N N 15 119.406 0.200 . 1 . . . . . 90 MET N . 26747 1 996 . 1 . 1 91 91 ALA C C 13 178.786 0.200 . 1 . . . . . 91 ALA C . 26747 1 997 . 1 . 1 91 91 ALA CA C 13 53.974 0.200 . 1 . . . . . 91 ALA CA . 26747 1 998 . 1 . 1 91 91 ALA CB C 13 18.736 0.200 . 1 . . . . . 91 ALA CB . 26747 1 999 . 1 . 1 91 91 ALA H H 1 7.882 0.020 . 1 . . . . . 91 ALA H . 26747 1 1000 . 1 . 1 91 91 ALA HA H 1 4.178 0.020 . 1 . . . . . 91 ALA HA . 26747 1 1001 . 1 . 1 91 91 ALA HB1 H 1 1.485 0.020 . 1 . . . . . 91 ALA HB1 . 26747 1 1002 . 1 . 1 91 91 ALA HB2 H 1 1.485 0.020 . 1 . . . . . 91 ALA HB2 . 26747 1 1003 . 1 . 1 91 91 ALA HB3 H 1 1.485 0.020 . 1 . . . . . 91 ALA HB3 . 26747 1 1004 . 1 . 1 91 91 ALA N N 15 122.208 0.200 . 1 . . . . . 91 ALA N . 26747 1 1005 . 1 . 1 92 92 ALA C C 13 178.407 0.200 . 1 . . . . . 92 ALA C . 26747 1 1006 . 1 . 1 92 92 ALA CA C 13 53.624 0.200 . 1 . . . . . 92 ALA CA . 26747 1 1007 . 1 . 1 92 92 ALA CB C 13 18.685 0.200 . 1 . . . . . 92 ALA CB . 26747 1 1008 . 1 . 1 92 92 ALA H H 1 7.863 0.020 . 1 . . . . . 92 ALA H . 26747 1 1009 . 1 . 1 92 92 ALA HA H 1 3.982 0.020 . 1 . . . . . 92 ALA HA . 26747 1 1010 . 1 . 1 92 92 ALA HB1 H 1 1.339 0.020 . 1 . . . . . 92 ALA HB1 . 26747 1 1011 . 1 . 1 92 92 ALA HB2 H 1 1.339 0.020 . 1 . . . . . 92 ALA HB2 . 26747 1 1012 . 1 . 1 92 92 ALA HB3 H 1 1.339 0.020 . 1 . . . . . 92 ALA HB3 . 26747 1 1013 . 1 . 1 92 92 ALA N N 15 120.761 0.200 . 1 . . . . . 92 ALA N . 26747 1 1014 . 1 . 1 93 93 LYS C C 13 177.352 0.200 . 1 . . . . . 93 LYS C . 26747 1 1015 . 1 . 1 93 93 LYS CA C 13 58.596 0.200 . 1 . . . . . 93 LYS CA . 26747 1 1016 . 1 . 1 93 93 LYS CB C 13 32.557 0.200 . 1 . . . . . 93 LYS CB . 26747 1 1017 . 1 . 1 93 93 LYS H H 1 7.964 0.020 . 1 . . . . . 93 LYS H . 26747 1 1018 . 1 . 1 93 93 LYS HA H 1 3.936 0.020 . 1 . . . . . 93 LYS HA . 26747 1 1019 . 1 . 1 93 93 LYS HB2 H 1 1.879 0.020 . 1 . . . . . 93 LYS HB2 . 26747 1 1020 . 1 . 1 93 93 LYS HB3 H 1 1.879 0.020 . 1 . . . . . 93 LYS HB3 . 26747 1 1021 . 1 . 1 93 93 LYS N N 15 117.849 0.200 . 1 . . . . . 93 LYS N . 26747 1 1022 . 1 . 1 94 94 LYS C C 13 177.755 0.200 . 1 . . . . . 94 LYS C . 26747 1 1023 . 1 . 1 94 94 LYS CA C 13 57.955 0.200 . 1 . . . . . 94 LYS CA . 26747 1 1024 . 1 . 1 94 94 LYS CB C 13 32.620 0.200 . 1 . . . . . 94 LYS CB . 26747 1 1025 . 1 . 1 94 94 LYS H H 1 7.715 0.020 . 1 . . . . . 94 LYS H . 26747 1 1026 . 1 . 1 94 94 LYS HA H 1 4.168 0.020 . 1 . . . . . 94 LYS HA . 26747 1 1027 . 1 . 1 94 94 LYS HB2 H 1 1.857 0.020 . 1 . . . . . 94 LYS HB2 . 26747 1 1028 . 1 . 1 94 94 LYS HB3 H 1 1.857 0.020 . 1 . . . . . 94 LYS HB3 . 26747 1 1029 . 1 . 1 94 94 LYS N N 15 118.114 0.200 . 1 . . . . . 94 LYS N . 26747 1 1030 . 1 . 1 95 95 ILE C C 13 176.996 0.200 . 1 . . . . . 95 ILE C . 26747 1 1031 . 1 . 1 95 95 ILE CA C 13 62.419 0.200 . 1 . . . . . 95 ILE CA . 26747 1 1032 . 1 . 1 95 95 ILE CB C 13 38.212 0.200 . 1 . . . . . 95 ILE CB . 26747 1 1033 . 1 . 1 95 95 ILE CD1 C 13 12.928 0.200 . 1 . . . . . 95 ILE CD1 . 26747 1 1034 . 1 . 1 95 95 ILE CG1 C 13 27.860 0.200 . 1 . . . . . 95 ILE CG1 . 26747 1 1035 . 1 . 1 95 95 ILE CG2 C 13 17.654 0.200 . 1 . . . . . 95 ILE CG2 . 26747 1 1036 . 1 . 1 95 95 ILE H H 1 7.606 0.020 . 1 . . . . . 95 ILE H . 26747 1 1037 . 1 . 1 95 95 ILE HA H 1 4.019 0.020 . 1 . . . . . 95 ILE HA . 26747 1 1038 . 1 . 1 95 95 ILE HB H 1 1.832 0.020 . 1 . . . . . 95 ILE HB . 26747 1 1039 . 1 . 1 95 95 ILE HD11 H 1 0.703 0.020 . 1 . . . . . 95 ILE HD11 . 26747 1 1040 . 1 . 1 95 95 ILE HD12 H 1 0.703 0.020 . 1 . . . . . 95 ILE HD12 . 26747 1 1041 . 1 . 1 95 95 ILE HD13 H 1 0.703 0.020 . 1 . . . . . 95 ILE HD13 . 26747 1 1042 . 1 . 1 95 95 ILE HG12 H 1 1.450 0.020 . 2 . . . . . 95 ILE HG12 . 26747 1 1043 . 1 . 1 95 95 ILE HG13 H 1 1.115 0.020 . 2 . . . . . 95 ILE HG13 . 26747 1 1044 . 1 . 1 95 95 ILE HG21 H 1 0.805 0.020 . 1 . . . . . 95 ILE HG21 . 26747 1 1045 . 1 . 1 95 95 ILE HG22 H 1 0.805 0.020 . 1 . . . . . 95 ILE HG22 . 26747 1 1046 . 1 . 1 95 95 ILE HG23 H 1 0.805 0.020 . 1 . . . . . 95 ILE HG23 . 26747 1 1047 . 1 . 1 95 95 ILE N N 15 118.289 0.200 . 1 . . . . . 95 ILE N . 26747 1 1048 . 1 . 1 96 96 LEU C C 13 177.429 0.200 . 1 . . . . . 96 LEU C . 26747 1 1049 . 1 . 1 96 96 LEU CA C 13 55.790 0.200 . 1 . . . . . 96 LEU CA . 26747 1 1050 . 1 . 1 96 96 LEU CB C 13 42.040 0.200 . 1 . . . . . 96 LEU CB . 26747 1 1051 . 1 . 1 96 96 LEU CD1 C 13 25.396 0.200 . 1 . . . . . 96 LEU CD1 . 26747 1 1052 . 1 . 1 96 96 LEU CG C 13 26.845 0.200 . 1 . . . . . 96 LEU CG . 26747 1 1053 . 1 . 1 96 96 LEU H H 1 7.926 0.020 . 1 . . . . . 96 LEU H . 26747 1 1054 . 1 . 1 96 96 LEU HA H 1 4.275 0.020 . 1 . . . . . 96 LEU HA . 26747 1 1055 . 1 . 1 96 96 LEU HB2 H 1 1.486 0.020 . 2 . . . . . 96 LEU HB2 . 26747 1 1056 . 1 . 1 96 96 LEU HB3 H 1 1.670 0.020 . 2 . . . . . 96 LEU HB3 . 26747 1 1057 . 1 . 1 96 96 LEU HD11 H 1 0.729 0.020 . 1 . . . . . 96 LEU HD11 . 26747 1 1058 . 1 . 1 96 96 LEU HD12 H 1 0.729 0.020 . 1 . . . . . 96 LEU HD12 . 26747 1 1059 . 1 . 1 96 96 LEU HD13 H 1 0.729 0.020 . 1 . . . . . 96 LEU HD13 . 26747 1 1060 . 1 . 1 96 96 LEU HG H 1 1.595 0.020 . 1 . . . . . 96 LEU HG . 26747 1 1061 . 1 . 1 96 96 LEU N N 15 121.433 0.200 . 1 . . . . . 96 LEU N . 26747 1 1062 . 1 . 1 97 97 ASP C C 13 175.738 0.200 . 1 . . . . . 97 ASP C . 26747 1 1063 . 1 . 1 97 97 ASP CA C 13 53.743 0.200 . 1 . . . . . 97 ASP CA . 26747 1 1064 . 1 . 1 97 97 ASP CB C 13 38.469 0.200 . 1 . . . . . 97 ASP CB . 26747 1 1065 . 1 . 1 97 97 ASP H H 1 8.054 0.020 . 1 . . . . . 97 ASP H . 26747 1 1066 . 1 . 1 97 97 ASP HA H 1 4.701 0.020 . 1 . . . . . 97 ASP HA . 26747 1 1067 . 1 . 1 97 97 ASP HB2 H 1 2.958 0.020 . 1 . . . . . 97 ASP HB2 . 26747 1 1068 . 1 . 1 97 97 ASP HB3 H 1 2.958 0.020 . 1 . . . . . 97 ASP HB3 . 26747 1 1069 . 1 . 1 97 97 ASP N N 15 117.772 0.200 . 1 . . . . . 97 ASP N . 26747 1 1070 . 1 . 1 98 98 ILE C C 13 176.670 0.200 . 1 . . . . . 98 ILE C . 26747 1 1071 . 1 . 1 98 98 ILE CA C 13 62.842 0.200 . 1 . . . . . 98 ILE CA . 26747 1 1072 . 1 . 1 98 98 ILE CB C 13 38.139 0.200 . 1 . . . . . 98 ILE CB . 26747 1 1073 . 1 . 1 98 98 ILE CD1 C 13 13.006 0.200 . 1 . . . . . 98 ILE CD1 . 26747 1 1074 . 1 . 1 98 98 ILE CG1 C 13 27.813 0.200 . 1 . . . . . 98 ILE CG1 . 26747 1 1075 . 1 . 1 98 98 ILE CG2 C 13 17.578 0.200 . 1 . . . . . 98 ILE CG2 . 26747 1 1076 . 1 . 1 98 98 ILE H H 1 7.740 0.020 . 1 . . . . . 98 ILE H . 26747 1 1077 . 1 . 1 98 98 ILE HA H 1 4.034 0.020 . 1 . . . . . 98 ILE HA . 26747 1 1078 . 1 . 1 98 98 ILE HB H 1 1.968 0.020 . 1 . . . . . 98 ILE HB . 26747 1 1079 . 1 . 1 98 98 ILE HD11 H 1 0.895 0.020 . 1 . . . . . 98 ILE HD11 . 26747 1 1080 . 1 . 1 98 98 ILE HD12 H 1 0.895 0.020 . 1 . . . . . 98 ILE HD12 . 26747 1 1081 . 1 . 1 98 98 ILE HD13 H 1 0.895 0.020 . 1 . . . . . 98 ILE HD13 . 26747 1 1082 . 1 . 1 98 98 ILE HG12 H 1 1.197 0.020 . 2 . . . . . 98 ILE HG12 . 26747 1 1083 . 1 . 1 98 98 ILE HG13 H 1 1.610 0.020 . 2 . . . . . 98 ILE HG13 . 26747 1 1084 . 1 . 1 98 98 ILE HG21 H 1 0.898 0.020 . 1 . . . . . 98 ILE HG21 . 26747 1 1085 . 1 . 1 98 98 ILE HG22 H 1 0.898 0.020 . 1 . . . . . 98 ILE HG22 . 26747 1 1086 . 1 . 1 98 98 ILE HG23 H 1 0.898 0.020 . 1 . . . . . 98 ILE HG23 . 26747 1 1087 . 1 . 1 98 98 ILE N N 15 120.268 0.200 . 1 . . . . . 98 ILE N . 26747 1 1088 . 1 . 1 99 99 LYS C C 13 177.615 0.200 . 1 . . . . . 99 LYS C . 26747 1 1089 . 1 . 1 99 99 LYS CA C 13 57.000 0.200 . 1 . . . . . 99 LYS CA . 26747 1 1090 . 1 . 1 99 99 LYS CB C 13 33.022 0.200 . 1 . . . . . 99 LYS CB . 26747 1 1091 . 1 . 1 99 99 LYS H H 1 8.196 0.020 . 1 . . . . . 99 LYS H . 26747 1 1092 . 1 . 1 99 99 LYS HA H 1 4.250 0.020 . 1 . . . . . 99 LYS HA . 26747 1 1093 . 1 . 1 99 99 LYS HB2 H 1 1.688 0.020 . 1 . . . . . 99 LYS HB2 . 26747 1 1094 . 1 . 1 99 99 LYS HB3 H 1 1.688 0.020 . 1 . . . . . 99 LYS HB3 . 26747 1 1095 . 1 . 1 99 99 LYS N N 15 121.714 0.200 . 1 . . . . . 99 LYS N . 26747 1 1096 . 1 . 1 100 100 GLY C C 13 174.909 0.200 . 1 . . . . . 100 GLY C . 26747 1 1097 . 1 . 1 100 100 GLY CA C 13 45.510 0.200 . 1 . . . . . 100 GLY CA . 26747 1 1098 . 1 . 1 100 100 GLY H H 1 8.101 0.020 . 1 . . . . . 100 GLY H . 26747 1 1099 . 1 . 1 100 100 GLY HA2 H 1 4.141 0.020 . 2 . . . . . 100 GLY HA2 . 26747 1 1100 . 1 . 1 100 100 GLY HA3 H 1 4.024 0.020 . 2 . . . . . 100 GLY HA3 . 26747 1 1101 . 1 . 1 100 100 GLY N N 15 108.326 0.200 . 1 . . . . . 100 GLY N . 26747 1 1102 . 1 . 1 101 101 ILE C C 13 176.567 0.200 . 1 . . . . . 101 ILE C . 26747 1 1103 . 1 . 1 101 101 ILE CA C 13 63.170 0.200 . 1 . . . . . 101 ILE CA . 26747 1 1104 . 1 . 1 101 101 ILE CB C 13 38.262 0.200 . 1 . . . . . 101 ILE CB . 26747 1 1105 . 1 . 1 101 101 ILE CD1 C 13 13.563 0.200 . 1 . . . . . 101 ILE CD1 . 26747 1 1106 . 1 . 1 101 101 ILE CG1 C 13 28.673 0.200 . 1 . . . . . 101 ILE CG1 . 26747 1 1107 . 1 . 1 101 101 ILE CG2 C 13 17.475 0.200 . 1 . . . . . 101 ILE CG2 . 26747 1 1108 . 1 . 1 101 101 ILE H H 1 8.102 0.020 . 1 . . . . . 101 ILE H . 26747 1 1109 . 1 . 1 101 101 ILE HA H 1 4.077 0.020 . 1 . . . . . 101 ILE HA . 26747 1 1110 . 1 . 1 101 101 ILE HB H 1 1.916 0.020 . 1 . . . . . 101 ILE HB . 26747 1 1111 . 1 . 1 101 101 ILE HD11 H 1 0.881 0.020 . 1 . . . . . 101 ILE HD11 . 26747 1 1112 . 1 . 1 101 101 ILE HD12 H 1 0.881 0.020 . 1 . . . . . 101 ILE HD12 . 26747 1 1113 . 1 . 1 101 101 ILE HD13 H 1 0.881 0.020 . 1 . . . . . 101 ILE HD13 . 26747 1 1114 . 1 . 1 101 101 ILE HG12 H 1 1.280 0.020 . 2 . . . . . 101 ILE HG12 . 26747 1 1115 . 1 . 1 101 101 ILE HG13 H 1 1.543 0.020 . 2 . . . . . 101 ILE HG13 . 26747 1 1116 . 1 . 1 101 101 ILE HG21 H 1 0.974 0.020 . 1 . . . . . 101 ILE HG21 . 26747 1 1117 . 1 . 1 101 101 ILE HG22 H 1 0.974 0.020 . 1 . . . . . 101 ILE HG22 . 26747 1 1118 . 1 . 1 101 101 ILE HG23 H 1 0.974 0.020 . 1 . . . . . 101 ILE HG23 . 26747 1 1119 . 1 . 1 101 101 ILE N N 15 120.495 0.200 . 1 . . . . . 101 ILE N . 26747 1 1120 . 1 . 1 102 102 ASP C C 13 177.377 0.200 . 1 . . . . . 102 ASP C . 26747 1 1121 . 1 . 1 102 102 ASP CA C 13 55.541 0.200 . 1 . . . . . 102 ASP CA . 26747 1 1122 . 1 . 1 102 102 ASP CB C 13 37.549 0.200 . 1 . . . . . 102 ASP CB . 26747 1 1123 . 1 . 1 102 102 ASP H H 1 8.488 0.020 . 1 . . . . . 102 ASP H . 26747 1 1124 . 1 . 1 102 102 ASP HA H 1 4.450 0.020 . 1 . . . . . 102 ASP HA . 26747 1 1125 . 1 . 1 102 102 ASP HB2 H 1 2.886 0.020 . 2 . . . . . 102 ASP HB2 . 26747 1 1126 . 1 . 1 102 102 ASP HB3 H 1 2.901 0.020 . 2 . . . . . 102 ASP HB3 . 26747 1 1127 . 1 . 1 102 102 ASP N N 15 119.651 0.200 . 1 . . . . . 102 ASP N . 26747 1 1128 . 1 . 1 103 103 TYR C C 13 178.087 0.200 . 1 . . . . . 103 TYR C . 26747 1 1129 . 1 . 1 103 103 TYR CA C 13 61.159 0.200 . 1 . . . . . 103 TYR CA . 26747 1 1130 . 1 . 1 103 103 TYR CB C 13 38.232 0.200 . 1 . . . . . 103 TYR CB . 26747 1 1131 . 1 . 1 103 103 TYR H H 1 7.935 0.020 . 1 . . . . . 103 TYR H . 26747 1 1132 . 1 . 1 103 103 TYR HA H 1 4.212 0.020 . 1 . . . . . 103 TYR HA . 26747 1 1133 . 1 . 1 103 103 TYR HB2 H 1 2.827 0.020 . 2 . . . . . 103 TYR HB2 . 26747 1 1134 . 1 . 1 103 103 TYR HB3 H 1 2.997 0.020 . 2 . . . . . 103 TYR HB3 . 26747 1 1135 . 1 . 1 103 103 TYR N N 15 121.229 0.200 . 1 . . . . . 103 TYR N . 26747 1 1136 . 1 . 1 104 104 TRP C C 13 177.942 0.200 . 1 . . . . . 104 TRP C . 26747 1 1137 . 1 . 1 104 104 TRP CA C 13 59.621 0.200 . 1 . . . . . 104 TRP CA . 26747 1 1138 . 1 . 1 104 104 TRP CB C 13 29.362 0.200 . 1 . . . . . 104 TRP CB . 26747 1 1139 . 1 . 1 104 104 TRP H H 1 7.787 0.020 . 1 . . . . . 104 TRP H . 26747 1 1140 . 1 . 1 104 104 TRP HA H 1 4.447 0.020 . 1 . . . . . 104 TRP HA . 26747 1 1141 . 1 . 1 104 104 TRP HB2 H 1 3.253 0.020 . 2 . . . . . 104 TRP HB2 . 26747 1 1142 . 1 . 1 104 104 TRP HB3 H 1 3.393 0.020 . 2 . . . . . 104 TRP HB3 . 26747 1 1143 . 1 . 1 104 104 TRP N N 15 121.308 0.200 . 1 . . . . . 104 TRP N . 26747 1 1144 . 1 . 1 105 105 LEU C C 13 178.168 0.200 . 1 . . . . . 105 LEU C . 26747 1 1145 . 1 . 1 105 105 LEU CA C 13 57.069 0.200 . 1 . . . . . 105 LEU CA . 26747 1 1146 . 1 . 1 105 105 LEU CB C 13 41.864 0.200 . 1 . . . . . 105 LEU CB . 26747 1 1147 . 1 . 1 105 105 LEU H H 1 8.177 0.020 . 1 . . . . . 105 LEU H . 26747 1 1148 . 1 . 1 105 105 LEU HA H 1 4.033 0.020 . 1 . . . . . 105 LEU HA . 26747 1 1149 . 1 . 1 105 105 LEU HB2 H 1 1.535 0.020 . 2 . . . . . 105 LEU HB2 . 26747 1 1150 . 1 . 1 105 105 LEU HB3 H 1 1.788 0.020 . 2 . . . . . 105 LEU HB3 . 26747 1 1151 . 1 . 1 105 105 LEU HD11 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD11 . 26747 1 1152 . 1 . 1 105 105 LEU HD12 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD12 . 26747 1 1153 . 1 . 1 105 105 LEU HD13 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD13 . 26747 1 1154 . 1 . 1 105 105 LEU HD21 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD21 . 26747 1 1155 . 1 . 1 105 105 LEU HD22 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD22 . 26747 1 1156 . 1 . 1 105 105 LEU HD23 H 1 0.912 0.020 . 1 . . . . . 105 LEU HD23 . 26747 1 1157 . 1 . 1 105 105 LEU N N 15 118.534 0.200 . 1 . . . . . 105 LEU N . 26747 1 1158 . 1 . 1 106 106 ALA C C 13 177.579 0.200 . 1 . . . . . 106 ALA C . 26747 1 1159 . 1 . 1 106 106 ALA CA C 13 52.687 0.200 . 1 . . . . . 106 ALA CA . 26747 1 1160 . 1 . 1 106 106 ALA CB C 13 18.792 0.200 . 1 . . . . . 106 ALA CB . 26747 1 1161 . 1 . 1 106 106 ALA H H 1 7.433 0.020 . 1 . . . . . 106 ALA H . 26747 1 1162 . 1 . 1 106 106 ALA HA H 1 4.237 0.020 . 1 . . . . . 106 ALA HA . 26747 1 1163 . 1 . 1 106 106 ALA HB1 H 1 1.249 0.020 . 1 . . . . . 106 ALA HB1 . 26747 1 1164 . 1 . 1 106 106 ALA HB2 H 1 1.249 0.020 . 1 . . . . . 106 ALA HB2 . 26747 1 1165 . 1 . 1 106 106 ALA HB3 H 1 1.249 0.020 . 1 . . . . . 106 ALA HB3 . 26747 1 1166 . 1 . 1 106 106 ALA N N 15 119.249 0.200 . 1 . . . . . 106 ALA N . 26747 1 1167 . 1 . 1 107 107 HIS C C 13 174.587 0.200 . 1 . . . . . 107 HIS C . 26747 1 1168 . 1 . 1 107 107 HIS CA C 13 55.500 0.200 . 1 . . . . . 107 HIS CA . 26747 1 1169 . 1 . 1 107 107 HIS CB C 13 28.416 0.200 . 1 . . . . . 107 HIS CB . 26747 1 1170 . 1 . 1 107 107 HIS H H 1 7.700 0.020 . 1 . . . . . 107 HIS H . 26747 1 1171 . 1 . 1 107 107 HIS HA H 1 4.706 0.020 . 1 . . . . . 107 HIS HA . 26747 1 1172 . 1 . 1 107 107 HIS HB2 H 1 3.317 0.020 . 1 . . . . . 107 HIS HB2 . 26747 1 1173 . 1 . 1 107 107 HIS HB3 H 1 3.317 0.020 . 1 . . . . . 107 HIS HB3 . 26747 1 1174 . 1 . 1 107 107 HIS N N 15 116.779 0.200 . 1 . . . . . 107 HIS N . 26747 1 1175 . 1 . 1 108 108 LYS C C 13 177.692 0.200 . 1 . . . . . 108 LYS C . 26747 1 1176 . 1 . 1 108 108 LYS CA C 13 58.696 0.200 . 1 . . . . . 108 LYS CA . 26747 1 1177 . 1 . 1 108 108 LYS CB C 13 32.620 0.200 . 1 . . . . . 108 LYS CB . 26747 1 1178 . 1 . 1 108 108 LYS H H 1 7.966 0.020 . 1 . . . . . 108 LYS H . 26747 1 1179 . 1 . 1 108 108 LYS HA H 1 4.123 0.020 . 1 . . . . . 108 LYS HA . 26747 1 1180 . 1 . 1 108 108 LYS HB2 H 1 1.772 0.020 . 1 . . . . . 108 LYS HB2 . 26747 1 1181 . 1 . 1 108 108 LYS HB3 H 1 1.772 0.020 . 1 . . . . . 108 LYS HB3 . 26747 1 1182 . 1 . 1 108 108 LYS N N 15 120.920 0.200 . 1 . . . . . 108 LYS N . 26747 1 1183 . 1 . 1 109 109 ALA C C 13 179.036 0.200 . 1 . . . . . 109 ALA C . 26747 1 1184 . 1 . 1 109 109 ALA CA C 13 54.225 0.200 . 1 . . . . . 109 ALA CA . 26747 1 1185 . 1 . 1 109 109 ALA CB C 13 18.572 0.200 . 1 . . . . . 109 ALA CB . 26747 1 1186 . 1 . 1 109 109 ALA H H 1 8.306 0.020 . 1 . . . . . 109 ALA H . 26747 1 1187 . 1 . 1 109 109 ALA HA H 1 4.238 0.020 . 1 . . . . . 109 ALA HA . 26747 1 1188 . 1 . 1 109 109 ALA HB1 H 1 1.435 0.020 . 1 . . . . . 109 ALA HB1 . 26747 1 1189 . 1 . 1 109 109 ALA HB2 H 1 1.435 0.020 . 1 . . . . . 109 ALA HB2 . 26747 1 1190 . 1 . 1 109 109 ALA HB3 H 1 1.435 0.020 . 1 . . . . . 109 ALA HB3 . 26747 1 1191 . 1 . 1 109 109 ALA N N 15 123.086 0.200 . 1 . . . . . 109 ALA N . 26747 1 1192 . 1 . 1 110 110 LEU C C 13 178.292 0.200 . 1 . . . . . 110 LEU C . 26747 1 1193 . 1 . 1 110 110 LEU CA C 13 56.492 0.200 . 1 . . . . . 110 LEU CA . 26747 1 1194 . 1 . 1 110 110 LEU CB C 13 42.207 0.200 . 1 . . . . . 110 LEU CB . 26747 1 1195 . 1 . 1 110 110 LEU CD1 C 13 24.302 0.200 . 2 . . . . . 110 LEU CD1 . 26747 1 1196 . 1 . 1 110 110 LEU CD2 C 13 24.560 0.200 . 2 . . . . . 110 LEU CD2 . 26747 1 1197 . 1 . 1 110 110 LEU CG C 13 27.048 0.200 . 1 . . . . . 110 LEU CG . 26747 1 1198 . 1 . 1 110 110 LEU H H 1 7.864 0.020 . 1 . . . . . 110 LEU H . 26747 1 1199 . 1 . 1 110 110 LEU HA H 1 4.305 0.020 . 1 . . . . . 110 LEU HA . 26747 1 1200 . 1 . 1 110 110 LEU HB2 H 1 1.829 0.020 . 1 . . . . . 110 LEU HB2 . 26747 1 1201 . 1 . 1 110 110 LEU HB3 H 1 1.829 0.020 . 1 . . . . . 110 LEU HB3 . 26747 1 1202 . 1 . 1 110 110 LEU HD11 H 1 0.955 0.020 . 2 . . . . . 110 LEU HD11 . 26747 1 1203 . 1 . 1 110 110 LEU HD12 H 1 0.955 0.020 . 2 . . . . . 110 LEU HD12 . 26747 1 1204 . 1 . 1 110 110 LEU HD13 H 1 0.955 0.020 . 2 . . . . . 110 LEU HD13 . 26747 1 1205 . 1 . 1 110 110 LEU HD21 H 1 0.980 0.020 . 2 . . . . . 110 LEU HD21 . 26747 1 1206 . 1 . 1 110 110 LEU HD22 H 1 0.980 0.020 . 2 . . . . . 110 LEU HD22 . 26747 1 1207 . 1 . 1 110 110 LEU HD23 H 1 0.980 0.020 . 2 . . . . . 110 LEU HD23 . 26747 1 1208 . 1 . 1 110 110 LEU HG H 1 1.764 0.020 . 1 . . . . . 110 LEU HG . 26747 1 1209 . 1 . 1 110 110 LEU N N 15 119.814 0.200 . 1 . . . . . 110 LEU N . 26747 1 1210 . 1 . 1 111 111 ALA C C 13 178.837 0.200 . 1 . . . . . 111 ALA C . 26747 1 1211 . 1 . 1 111 111 ALA CA C 13 54.277 0.200 . 1 . . . . . 111 ALA CA . 26747 1 1212 . 1 . 1 111 111 ALA CB C 13 18.771 0.200 . 1 . . . . . 111 ALA CB . 26747 1 1213 . 1 . 1 111 111 ALA H H 1 8.256 0.020 . 1 . . . . . 111 ALA H . 26747 1 1214 . 1 . 1 111 111 ALA HA H 1 4.027 0.020 . 1 . . . . . 111 ALA HA . 26747 1 1215 . 1 . 1 111 111 ALA HB1 H 1 1.495 0.020 . 1 . . . . . 111 ALA HB1 . 26747 1 1216 . 1 . 1 111 111 ALA HB2 H 1 1.495 0.020 . 1 . . . . . 111 ALA HB2 . 26747 1 1217 . 1 . 1 111 111 ALA HB3 H 1 1.495 0.020 . 1 . . . . . 111 ALA HB3 . 26747 1 1218 . 1 . 1 111 111 ALA N N 15 121.959 0.200 . 1 . . . . . 111 ALA N . 26747 1 1219 . 1 . 1 112 112 THR C C 13 175.631 0.200 . 1 . . . . . 112 THR C . 26747 1 1220 . 1 . 1 112 112 THR CA C 13 65.509 0.200 . 1 . . . . . 112 THR CA . 26747 1 1221 . 1 . 1 112 112 THR CB C 13 68.648 0.200 . 1 . . . . . 112 THR CB . 26747 1 1222 . 1 . 1 112 112 THR H H 1 7.990 0.020 . 1 . . . . . 112 THR H . 26747 1 1223 . 1 . 1 112 112 THR HA H 1 3.915 0.020 . 1 . . . . . 112 THR HA . 26747 1 1224 . 1 . 1 112 112 THR HB H 1 4.327 0.020 . 1 . . . . . 112 THR HB . 26747 1 1225 . 1 . 1 112 112 THR HG21 H 1 1.229 0.020 . 1 . . . . . 112 THR HG21 . 26747 1 1226 . 1 . 1 112 112 THR HG22 H 1 1.229 0.020 . 1 . . . . . 112 THR HG22 . 26747 1 1227 . 1 . 1 112 112 THR HG23 H 1 1.229 0.020 . 1 . . . . . 112 THR HG23 . 26747 1 1228 . 1 . 1 112 112 THR N N 15 112.415 0.200 . 1 . . . . . 112 THR N . 26747 1 1229 . 1 . 1 113 113 GLU C C 13 177.895 0.200 . 1 . . . . . 113 GLU C . 26747 1 1230 . 1 . 1 113 113 GLU CA C 13 58.280 0.200 . 1 . . . . . 113 GLU CA . 26747 1 1231 . 1 . 1 113 113 GLU CB C 13 28.266 0.200 . 1 . . . . . 113 GLU CB . 26747 1 1232 . 1 . 1 113 113 GLU CG C 13 32.995 0.200 . 1 . . . . . 113 GLU CG . 26747 1 1233 . 1 . 1 113 113 GLU H H 1 7.990 0.020 . 1 . . . . . 113 GLU H . 26747 1 1234 . 1 . 1 113 113 GLU HA H 1 4.173 0.020 . 1 . . . . . 113 GLU HA . 26747 1 1235 . 1 . 1 113 113 GLU HB2 H 1 2.191 0.020 . 1 . . . . . 113 GLU HB2 . 26747 1 1236 . 1 . 1 113 113 GLU HB3 H 1 2.191 0.020 . 1 . . . . . 113 GLU HB3 . 26747 1 1237 . 1 . 1 113 113 GLU HG2 H 1 2.507 0.020 . 2 . . . . . 113 GLU HG2 . 26747 1 1238 . 1 . 1 113 113 GLU HG3 H 1 2.611 0.020 . 2 . . . . . 113 GLU HG3 . 26747 1 1239 . 1 . 1 113 113 GLU N N 15 121.044 0.200 . 1 . . . . . 113 GLU N . 26747 1 1240 . 1 . 1 114 114 LYS C C 13 178.452 0.200 . 1 . . . . . 114 LYS C . 26747 1 1241 . 1 . 1 114 114 LYS CA C 13 58.126 0.200 . 1 . . . . . 114 LYS CA . 26747 1 1242 . 1 . 1 114 114 LYS CB C 13 32.074 0.200 . 1 . . . . . 114 LYS CB . 26747 1 1243 . 1 . 1 114 114 LYS CG C 13 24.859 0.200 . 1 . . . . . 114 LYS CG . 26747 1 1244 . 1 . 1 114 114 LYS H H 1 8.071 0.020 . 1 . . . . . 114 LYS H . 26747 1 1245 . 1 . 1 114 114 LYS HA H 1 4.089 0.020 . 1 . . . . . 114 LYS HA . 26747 1 1246 . 1 . 1 114 114 LYS HB2 H 1 1.634 0.020 . 2 . . . . . 114 LYS HB2 . 26747 1 1247 . 1 . 1 114 114 LYS HB3 H 1 1.794 0.020 . 2 . . . . . 114 LYS HB3 . 26747 1 1248 . 1 . 1 114 114 LYS HG2 H 1 1.445 0.020 . 1 . . . . . 114 LYS HG2 . 26747 1 1249 . 1 . 1 114 114 LYS HG3 H 1 1.445 0.020 . 1 . . . . . 114 LYS HG3 . 26747 1 1250 . 1 . 1 114 114 LYS N N 15 119.248 0.200 . 1 . . . . . 114 LYS N . 26747 1 1251 . 1 . 1 115 115 LEU C C 13 178.301 0.200 . 1 . . . . . 115 LEU C . 26747 1 1252 . 1 . 1 115 115 LEU CA C 13 57.653 0.200 . 1 . . . . . 115 LEU CA . 26747 1 1253 . 1 . 1 115 115 LEU CB C 13 41.998 0.200 . 1 . . . . . 115 LEU CB . 26747 1 1254 . 1 . 1 115 115 LEU CD1 C 13 24.699 0.200 . 1 . . . . . 115 LEU CD1 . 26747 1 1255 . 1 . 1 115 115 LEU CD2 C 13 24.699 0.200 . 1 . . . . . 115 LEU CD2 . 26747 1 1256 . 1 . 1 115 115 LEU CG C 13 27.162 0.200 . 1 . . . . . 115 LEU CG . 26747 1 1257 . 1 . 1 115 115 LEU H H 1 8.001 0.020 . 1 . . . . . 115 LEU H . 26747 1 1258 . 1 . 1 115 115 LEU HA H 1 4.160 0.020 . 1 . . . . . 115 LEU HA . 26747 1 1259 . 1 . 1 115 115 LEU HB2 H 1 1.698 0.020 . 1 . . . . . 115 LEU HB2 . 26747 1 1260 . 1 . 1 115 115 LEU HB3 H 1 1.698 0.020 . 1 . . . . . 115 LEU HB3 . 26747 1 1261 . 1 . 1 115 115 LEU HD11 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD11 . 26747 1 1262 . 1 . 1 115 115 LEU HD12 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD12 . 26747 1 1263 . 1 . 1 115 115 LEU HD13 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD13 . 26747 1 1264 . 1 . 1 115 115 LEU HD21 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD21 . 26747 1 1265 . 1 . 1 115 115 LEU HD22 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD22 . 26747 1 1266 . 1 . 1 115 115 LEU HD23 H 1 0.808 0.020 . 1 . . . . . 115 LEU HD23 . 26747 1 1267 . 1 . 1 115 115 LEU N N 15 120.444 0.200 . 1 . . . . . 115 LEU N . 26747 1 1268 . 1 . 1 116 116 GLU C C 13 178.007 0.200 . 1 . . . . . 116 GLU C . 26747 1 1269 . 1 . 1 116 116 GLU CA C 13 58.864 0.200 . 1 . . . . . 116 GLU CA . 26747 1 1270 . 1 . 1 116 116 GLU CB C 13 28.025 0.200 . 1 . . . . . 116 GLU CB . 26747 1 1271 . 1 . 1 116 116 GLU CG C 13 33.336 0.200 . 1 . . . . . 116 GLU CG . 26747 1 1272 . 1 . 1 116 116 GLU H H 1 8.232 0.020 . 1 . . . . . 116 GLU H . 26747 1 1273 . 1 . 1 116 116 GLU HA H 1 3.980 0.020 . 1 . . . . . 116 GLU HA . 26747 1 1274 . 1 . 1 116 116 GLU HB2 H 1 2.083 0.020 . 2 . . . . . 116 GLU HB2 . 26747 1 1275 . 1 . 1 116 116 GLU HB3 H 1 2.152 0.020 . 2 . . . . . 116 GLU HB3 . 26747 1 1276 . 1 . 1 116 116 GLU HG2 H 1 2.626 0.020 . 2 . . . . . 116 GLU HG2 . 26747 1 1277 . 1 . 1 116 116 GLU HG3 H 1 2.403 0.020 . 2 . . . . . 116 GLU HG3 . 26747 1 1278 . 1 . 1 116 116 GLU N N 15 117.712 0.200 . 1 . . . . . 116 GLU N . 26747 1 1279 . 1 . 1 117 117 GLN C C 13 177.649 0.200 . 1 . . . . . 117 GLN C . 26747 1 1280 . 1 . 1 117 117 GLN CA C 13 58.401 0.200 . 1 . . . . . 117 GLN CA . 26747 1 1281 . 1 . 1 117 117 GLN CB C 13 28.534 0.200 . 1 . . . . . 117 GLN CB . 26747 1 1282 . 1 . 1 117 117 GLN CG C 13 33.739 0.200 . 1 . . . . . 117 GLN CG . 26747 1 1283 . 1 . 1 117 117 GLN H H 1 7.981 0.020 . 1 . . . . . 117 GLN H . 26747 1 1284 . 1 . 1 117 117 GLN HA H 1 4.079 0.020 . 1 . . . . . 117 GLN HA . 26747 1 1285 . 1 . 1 117 117 GLN HB2 H 1 2.151 0.020 . 1 . . . . . 117 GLN HB2 . 26747 1 1286 . 1 . 1 117 117 GLN HB3 H 1 2.151 0.020 . 1 . . . . . 117 GLN HB3 . 26747 1 1287 . 1 . 1 117 117 GLN HG2 H 1 2.356 0.020 . 2 . . . . . 117 GLN HG2 . 26747 1 1288 . 1 . 1 117 117 GLN HG3 H 1 2.523 0.020 . 2 . . . . . 117 GLN HG3 . 26747 1 1289 . 1 . 1 117 117 GLN N N 15 118.857 0.200 . 1 . . . . . 117 GLN N . 26747 1 1290 . 1 . 1 118 118 TRP C C 13 178.010 0.200 . 1 . . . . . 118 TRP C . 26747 1 1291 . 1 . 1 118 118 TRP CA C 13 59.902 0.200 . 1 . . . . . 118 TRP CA . 26747 1 1292 . 1 . 1 118 118 TRP CB C 13 28.731 0.200 . 1 . . . . . 118 TRP CB . 26747 1 1293 . 1 . 1 118 118 TRP H H 1 7.993 0.020 . 1 . . . . . 118 TRP H . 26747 1 1294 . 1 . 1 118 118 TRP HA H 1 4.403 0.020 . 1 . . . . . 118 TRP HA . 26747 1 1295 . 1 . 1 118 118 TRP HB2 H 1 3.322 0.020 . 2 . . . . . 118 TRP HB2 . 26747 1 1296 . 1 . 1 118 118 TRP HB3 H 1 3.424 0.020 . 2 . . . . . 118 TRP HB3 . 26747 1 1297 . 1 . 1 118 118 TRP N N 15 120.559 0.200 . 1 . . . . . 118 TRP N . 26747 1 1298 . 1 . 1 119 119 LEU C C 13 178.023 0.200 . 1 . . . . . 119 LEU C . 26747 1 1299 . 1 . 1 119 119 LEU CA C 13 56.804 0.200 . 1 . . . . . 119 LEU CA . 26747 1 1300 . 1 . 1 119 119 LEU CB C 13 42.236 0.200 . 1 . . . . . 119 LEU CB . 26747 1 1301 . 1 . 1 119 119 LEU CD1 C 13 23.603 0.200 . 2 . . . . . 119 LEU CD1 . 26747 1 1302 . 1 . 1 119 119 LEU CD2 C 13 25.525 0.200 . 2 . . . . . 119 LEU CD2 . 26747 1 1303 . 1 . 1 119 119 LEU CG C 13 26.980 0.200 . 1 . . . . . 119 LEU CG . 26747 1 1304 . 1 . 1 119 119 LEU H H 1 8.226 0.020 . 1 . . . . . 119 LEU H . 26747 1 1305 . 1 . 1 119 119 LEU HA H 1 3.887 0.020 . 1 . . . . . 119 LEU HA . 26747 1 1306 . 1 . 1 119 119 LEU HB2 H 1 1.481 0.020 . 2 . . . . . 119 LEU HB2 . 26747 1 1307 . 1 . 1 119 119 LEU HB3 H 1 1.809 0.020 . 2 . . . . . 119 LEU HB3 . 26747 1 1308 . 1 . 1 119 119 LEU HD11 H 1 0.831 0.020 . 2 . . . . . 119 LEU HD11 . 26747 1 1309 . 1 . 1 119 119 LEU HD12 H 1 0.831 0.020 . 2 . . . . . 119 LEU HD12 . 26747 1 1310 . 1 . 1 119 119 LEU HD13 H 1 0.831 0.020 . 2 . . . . . 119 LEU HD13 . 26747 1 1311 . 1 . 1 119 119 LEU HD21 H 1 0.856 0.020 . 2 . . . . . 119 LEU HD21 . 26747 1 1312 . 1 . 1 119 119 LEU HD22 H 1 0.856 0.020 . 2 . . . . . 119 LEU HD22 . 26747 1 1313 . 1 . 1 119 119 LEU HD23 H 1 0.856 0.020 . 2 . . . . . 119 LEU HD23 . 26747 1 1314 . 1 . 1 119 119 LEU HG H 1 1.803 0.020 . 1 . . . . . 119 LEU HG . 26747 1 1315 . 1 . 1 119 119 LEU N N 15 118.812 0.200 . 1 . . . . . 119 LEU N . 26747 1 1316 . 1 . 1 120 120 ALA C C 13 178.544 0.200 . 1 . . . . . 120 ALA C . 26747 1 1317 . 1 . 1 120 120 ALA CA C 13 53.723 0.200 . 1 . . . . . 120 ALA CA . 26747 1 1318 . 1 . 1 120 120 ALA CB C 13 18.768 0.200 . 1 . . . . . 120 ALA CB . 26747 1 1319 . 1 . 1 120 120 ALA H H 1 7.824 0.020 . 1 . . . . . 120 ALA H . 26747 1 1320 . 1 . 1 120 120 ALA HA H 1 4.138 0.020 . 1 . . . . . 120 ALA HA . 26747 1 1321 . 1 . 1 120 120 ALA HB1 H 1 1.462 0.020 . 1 . . . . . 120 ALA HB1 . 26747 1 1322 . 1 . 1 120 120 ALA HB2 H 1 1.462 0.020 . 1 . . . . . 120 ALA HB2 . 26747 1 1323 . 1 . 1 120 120 ALA HB3 H 1 1.462 0.020 . 1 . . . . . 120 ALA HB3 . 26747 1 1324 . 1 . 1 120 120 ALA N N 15 120.307 0.200 . 1 . . . . . 120 ALA N . 26747 1 1325 . 1 . 1 121 121 GLU C C 13 176.282 0.200 . 1 . . . . . 121 GLU C . 26747 1 1326 . 1 . 1 121 121 GLU CA C 13 56.496 0.200 . 1 . . . . . 121 GLU CA . 26747 1 1327 . 1 . 1 121 121 GLU CB C 13 28.793 0.200 . 1 . . . . . 121 GLU CB . 26747 1 1328 . 1 . 1 121 121 GLU CG C 13 33.016 0.200 . 1 . . . . . 121 GLU CG . 26747 1 1329 . 1 . 1 121 121 GLU H H 1 7.614 0.020 . 1 . . . . . 121 GLU H . 26747 1 1330 . 1 . 1 121 121 GLU HA H 1 4.277 0.020 . 1 . . . . . 121 GLU HA . 26747 1 1331 . 1 . 1 121 121 GLU HB2 H 1 2.100 0.020 . 1 . . . . . 121 GLU HB2 . 26747 1 1332 . 1 . 1 121 121 GLU HB3 H 1 2.100 0.020 . 1 . . . . . 121 GLU HB3 . 26747 1 1333 . 1 . 1 121 121 GLU HG2 H 1 2.543 0.020 . 2 . . . . . 121 GLU HG2 . 26747 1 1334 . 1 . 1 121 121 GLU HG3 H 1 2.605 0.020 . 2 . . . . . 121 GLU HG3 . 26747 1 1335 . 1 . 1 121 121 GLU N N 15 115.766 0.200 . 1 . . . . . 121 GLU N . 26747 1 1336 . 1 . 1 122 122 LYS C C 13 176.278 0.200 . 1 . . . . . 122 LYS C . 26747 1 1337 . 1 . 1 122 122 LYS CA C 13 55.807 0.200 . 1 . . . . . 122 LYS CA . 26747 1 1338 . 1 . 1 122 122 LYS CB C 13 32.658 0.200 . 1 . . . . . 122 LYS CB . 26747 1 1339 . 1 . 1 122 122 LYS CD C 13 28.232 0.200 . 1 . . . . . 122 LYS CD . 26747 1 1340 . 1 . 1 122 122 LYS CE C 13 42.198 0.200 . 1 . . . . . 122 LYS CE . 26747 1 1341 . 1 . 1 122 122 LYS CG C 13 24.073 0.200 . 1 . . . . . 122 LYS CG . 26747 1 1342 . 1 . 1 122 122 LYS H H 1 7.811 0.020 . 1 . . . . . 122 LYS H . 26747 1 1343 . 1 . 1 122 122 LYS HA H 1 4.234 0.020 . 1 . . . . . 122 LYS HA . 26747 1 1344 . 1 . 1 122 122 LYS HB2 H 1 1.567 0.020 . 2 . . . . . 122 LYS HB2 . 26747 1 1345 . 1 . 1 122 122 LYS HB3 H 1 1.711 0.020 . 2 . . . . . 122 LYS HB3 . 26747 1 1346 . 1 . 1 122 122 LYS HD2 H 1 1.455 0.020 . 1 . . . . . 122 LYS HD2 . 26747 1 1347 . 1 . 1 122 122 LYS HD3 H 1 1.455 0.020 . 1 . . . . . 122 LYS HD3 . 26747 1 1348 . 1 . 1 122 122 LYS HE2 H 1 2.834 0.020 . 2 . . . . . 122 LYS HE2 . 26747 1 1349 . 1 . 1 122 122 LYS HE3 H 1 2.728 0.020 . 2 . . . . . 122 LYS HE3 . 26747 1 1350 . 1 . 1 122 122 LYS HG2 H 1 1.052 0.020 . 2 . . . . . 122 LYS HG2 . 26747 1 1351 . 1 . 1 122 122 LYS HG3 H 1 1.172 0.020 . 2 . . . . . 122 LYS HG3 . 26747 1 1352 . 1 . 1 122 122 LYS N N 15 119.058 0.200 . 1 . . . . . 122 LYS N . 26747 1 1353 . 1 . 1 123 123 LEU C C 13 178.930 0.200 . 1 . . . . . 123 LEU C . 26747 1 1354 . 1 . 1 123 123 LEU CA C 13 54.084 0.200 . 1 . . . . . 123 LEU CA . 26747 1 1355 . 1 . 1 123 123 LEU CB C 13 42.326 0.200 . 1 . . . . . 123 LEU CB . 26747 1 1356 . 1 . 1 123 123 LEU CD1 C 13 25.181 0.200 . 2 . . . . . 123 LEU CD1 . 26747 1 1357 . 1 . 1 123 123 LEU CD2 C 13 23.337 0.200 . 2 . . . . . 123 LEU CD2 . 26747 1 1358 . 1 . 1 123 123 LEU CG C 13 26.946 0.200 . 1 . . . . . 123 LEU CG . 26747 1 1359 . 1 . 1 123 123 LEU H H 1 7.775 0.020 . 1 . . . . . 123 LEU H . 26747 1 1360 . 1 . 1 123 123 LEU HA H 1 4.353 0.020 . 1 . . . . . 123 LEU HA . 26747 1 1361 . 1 . 1 123 123 LEU HB2 H 1 1.579 0.020 . 2 . . . . . 123 LEU HB2 . 26747 1 1362 . 1 . 1 123 123 LEU HB3 H 1 1.640 0.020 . 2 . . . . . 123 LEU HB3 . 26747 1 1363 . 1 . 1 123 123 LEU HD11 H 1 0.824 0.020 . 2 . . . . . 123 LEU HD11 . 26747 1 1364 . 1 . 1 123 123 LEU HD12 H 1 0.824 0.020 . 2 . . . . . 123 LEU HD12 . 26747 1 1365 . 1 . 1 123 123 LEU HD13 H 1 0.824 0.020 . 2 . . . . . 123 LEU HD13 . 26747 1 1366 . 1 . 1 123 123 LEU HD21 H 1 0.791 0.020 . 2 . . . . . 123 LEU HD21 . 26747 1 1367 . 1 . 1 123 123 LEU HD22 H 1 0.791 0.020 . 2 . . . . . 123 LEU HD22 . 26747 1 1368 . 1 . 1 123 123 LEU HD23 H 1 0.791 0.020 . 2 . . . . . 123 LEU HD23 . 26747 1 1369 . 1 . 1 123 123 LEU HG H 1 1.637 0.020 . 1 . . . . . 123 LEU HG . 26747 1 1370 . 1 . 1 123 123 LEU N N 15 122.341 0.200 . 1 . . . . . 123 LEU N . 26747 1 stop_ save_