data_6724 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6724 _Entry.Title ; Nuclear Magnetic Resonance Structure-Based Epitope Mapping and Modulation of Dust Mite Group 13 Allergen as a Hypoallergen ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-07-03 _Entry.Accession_date 2005-07-05 _Entry.Last_release_date 2006-04-05 _Entry.Original_release_date 2006-04-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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.Entry_ID 1 'Siew Leong' Chan . . . 6724 2 Yu-Keung Mok . . . 6724 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6724 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 397 6724 '15N chemical shifts' 130 6724 '1H chemical shifts' 741 6724 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 . . 2006-04-05 2005-07-03 original author . 6724 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6724 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Nuclear Magnetic Resonance Structure-Based Epitope Mapping and Modulation of Dust Mite Group 13 Allergen as a Hypoallergen ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Immunol.' _Citation.Journal_name_full . _Citation.Journal_volume 176 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 4852 _Citation.Page_last 4860 _Citation.Year 2006 _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.Entry_ID _Citation_author.Citation_ID 1 'Siew Leong' Chan . . . 6724 1 2 'Seow Theng' Ong . . . 6724 1 3 'Su Yin' Ong . . . 6724 1 4 'Fook Tim' Chew . . . 6724 1 5 'Yu Keung' Mok . . . 6724 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6724 _Assembly.ID 1 _Assembly.Name 'Der f 13' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _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 'Fatty_acid binding protein' 1 $Fatty_acid_binding_protein . . yes native no no . . . 6724 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Fatty_acid_binding_protein _Entity.Sf_category entity _Entity.Sf_framecode Fatty_acid_binding_protein _Entity.Entry_ID 6724 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Der f 13' _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 ; MASIEGKYKLEKSEKFDEFL DKLGVGFMVKTAAKTLKPTF EVAIENDQYIFRSLSTFKNT EAKFKLGEEFEEDRADGKRV KTVIQKEGDNKFVQTQFGDK EVKIIREFNGDEVVVTASCD GVTSVRTYKRI ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 131 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _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 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2A0A . "Solution Structure Of Der F 13, Group 13 Allergen From House Dust Mites" . . . . . 100.00 131 100.00 100.00 4.03e-86 . . . . 6724 1 2 no GB AAP35078 . "Der f 13 allergen [Dermatophagoides farinae]" . . . . . 100.00 131 100.00 100.00 4.03e-86 . . . . 6724 1 3 no GB AIO08854 . "Der f 13 allergen [Dermatophagoides farinae]" . . . . . 100.00 131 100.00 100.00 4.03e-86 . . . . 6724 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 6724 1 2 . ALA . 6724 1 3 . SER . 6724 1 4 . ILE . 6724 1 5 . GLU . 6724 1 6 . GLY . 6724 1 7 . LYS . 6724 1 8 . TYR . 6724 1 9 . LYS . 6724 1 10 . LEU . 6724 1 11 . GLU . 6724 1 12 . LYS . 6724 1 13 . SER . 6724 1 14 . GLU . 6724 1 15 . LYS . 6724 1 16 . PHE . 6724 1 17 . ASP . 6724 1 18 . GLU . 6724 1 19 . PHE . 6724 1 20 . LEU . 6724 1 21 . ASP . 6724 1 22 . LYS . 6724 1 23 . LEU . 6724 1 24 . GLY . 6724 1 25 . VAL . 6724 1 26 . GLY . 6724 1 27 . PHE . 6724 1 28 . MET . 6724 1 29 . VAL . 6724 1 30 . LYS . 6724 1 31 . THR . 6724 1 32 . ALA . 6724 1 33 . ALA . 6724 1 34 . LYS . 6724 1 35 . THR . 6724 1 36 . LEU . 6724 1 37 . LYS . 6724 1 38 . PRO . 6724 1 39 . THR . 6724 1 40 . PHE . 6724 1 41 . GLU . 6724 1 42 . VAL . 6724 1 43 . ALA . 6724 1 44 . ILE . 6724 1 45 . GLU . 6724 1 46 . ASN . 6724 1 47 . ASP . 6724 1 48 . GLN . 6724 1 49 . TYR . 6724 1 50 . ILE . 6724 1 51 . PHE . 6724 1 52 . ARG . 6724 1 53 . SER . 6724 1 54 . LEU . 6724 1 55 . SER . 6724 1 56 . THR . 6724 1 57 . PHE . 6724 1 58 . LYS . 6724 1 59 . ASN . 6724 1 60 . THR . 6724 1 61 . GLU . 6724 1 62 . ALA . 6724 1 63 . LYS . 6724 1 64 . PHE . 6724 1 65 . LYS . 6724 1 66 . LEU . 6724 1 67 . GLY . 6724 1 68 . GLU . 6724 1 69 . GLU . 6724 1 70 . PHE . 6724 1 71 . GLU . 6724 1 72 . GLU . 6724 1 73 . ASP . 6724 1 74 . ARG . 6724 1 75 . ALA . 6724 1 76 . ASP . 6724 1 77 . GLY . 6724 1 78 . LYS . 6724 1 79 . ARG . 6724 1 80 . VAL . 6724 1 81 . LYS . 6724 1 82 . THR . 6724 1 83 . VAL . 6724 1 84 . ILE . 6724 1 85 . GLN . 6724 1 86 . LYS . 6724 1 87 . GLU . 6724 1 88 . GLY . 6724 1 89 . ASP . 6724 1 90 . ASN . 6724 1 91 . LYS . 6724 1 92 . PHE . 6724 1 93 . VAL . 6724 1 94 . GLN . 6724 1 95 . THR . 6724 1 96 . GLN . 6724 1 97 . PHE . 6724 1 98 . GLY . 6724 1 99 . ASP . 6724 1 100 . LYS . 6724 1 101 . GLU . 6724 1 102 . VAL . 6724 1 103 . LYS . 6724 1 104 . ILE . 6724 1 105 . ILE . 6724 1 106 . ARG . 6724 1 107 . GLU . 6724 1 108 . PHE . 6724 1 109 . ASN . 6724 1 110 . GLY . 6724 1 111 . ASP . 6724 1 112 . GLU . 6724 1 113 . VAL . 6724 1 114 . VAL . 6724 1 115 . VAL . 6724 1 116 . THR . 6724 1 117 . ALA . 6724 1 118 . SER . 6724 1 119 . CYS . 6724 1 120 . ASP . 6724 1 121 . GLY . 6724 1 122 . VAL . 6724 1 123 . THR . 6724 1 124 . SER . 6724 1 125 . VAL . 6724 1 126 . ARG . 6724 1 127 . THR . 6724 1 128 . TYR . 6724 1 129 . LYS . 6724 1 130 . ARG . 6724 1 131 . ILE . 6724 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6724 1 . ALA 2 2 6724 1 . SER 3 3 6724 1 . ILE 4 4 6724 1 . GLU 5 5 6724 1 . GLY 6 6 6724 1 . LYS 7 7 6724 1 . TYR 8 8 6724 1 . LYS 9 9 6724 1 . LEU 10 10 6724 1 . GLU 11 11 6724 1 . LYS 12 12 6724 1 . SER 13 13 6724 1 . GLU 14 14 6724 1 . LYS 15 15 6724 1 . PHE 16 16 6724 1 . ASP 17 17 6724 1 . GLU 18 18 6724 1 . PHE 19 19 6724 1 . LEU 20 20 6724 1 . ASP 21 21 6724 1 . LYS 22 22 6724 1 . LEU 23 23 6724 1 . GLY 24 24 6724 1 . VAL 25 25 6724 1 . GLY 26 26 6724 1 . PHE 27 27 6724 1 . MET 28 28 6724 1 . VAL 29 29 6724 1 . LYS 30 30 6724 1 . THR 31 31 6724 1 . ALA 32 32 6724 1 . ALA 33 33 6724 1 . LYS 34 34 6724 1 . THR 35 35 6724 1 . LEU 36 36 6724 1 . LYS 37 37 6724 1 . PRO 38 38 6724 1 . THR 39 39 6724 1 . PHE 40 40 6724 1 . GLU 41 41 6724 1 . VAL 42 42 6724 1 . ALA 43 43 6724 1 . ILE 44 44 6724 1 . GLU 45 45 6724 1 . ASN 46 46 6724 1 . ASP 47 47 6724 1 . GLN 48 48 6724 1 . TYR 49 49 6724 1 . ILE 50 50 6724 1 . PHE 51 51 6724 1 . ARG 52 52 6724 1 . SER 53 53 6724 1 . LEU 54 54 6724 1 . SER 55 55 6724 1 . THR 56 56 6724 1 . PHE 57 57 6724 1 . LYS 58 58 6724 1 . ASN 59 59 6724 1 . THR 60 60 6724 1 . GLU 61 61 6724 1 . ALA 62 62 6724 1 . LYS 63 63 6724 1 . PHE 64 64 6724 1 . LYS 65 65 6724 1 . LEU 66 66 6724 1 . GLY 67 67 6724 1 . GLU 68 68 6724 1 . GLU 69 69 6724 1 . PHE 70 70 6724 1 . GLU 71 71 6724 1 . GLU 72 72 6724 1 . ASP 73 73 6724 1 . ARG 74 74 6724 1 . ALA 75 75 6724 1 . ASP 76 76 6724 1 . GLY 77 77 6724 1 . LYS 78 78 6724 1 . ARG 79 79 6724 1 . VAL 80 80 6724 1 . LYS 81 81 6724 1 . THR 82 82 6724 1 . VAL 83 83 6724 1 . ILE 84 84 6724 1 . GLN 85 85 6724 1 . LYS 86 86 6724 1 . GLU 87 87 6724 1 . GLY 88 88 6724 1 . ASP 89 89 6724 1 . ASN 90 90 6724 1 . LYS 91 91 6724 1 . PHE 92 92 6724 1 . VAL 93 93 6724 1 . GLN 94 94 6724 1 . THR 95 95 6724 1 . GLN 96 96 6724 1 . PHE 97 97 6724 1 . GLY 98 98 6724 1 . ASP 99 99 6724 1 . LYS 100 100 6724 1 . GLU 101 101 6724 1 . VAL 102 102 6724 1 . LYS 103 103 6724 1 . ILE 104 104 6724 1 . ILE 105 105 6724 1 . ARG 106 106 6724 1 . GLU 107 107 6724 1 . PHE 108 108 6724 1 . ASN 109 109 6724 1 . GLY 110 110 6724 1 . ASP 111 111 6724 1 . GLU 112 112 6724 1 . VAL 113 113 6724 1 . VAL 114 114 6724 1 . VAL 115 115 6724 1 . THR 116 116 6724 1 . ALA 117 117 6724 1 . SER 118 118 6724 1 . CYS 119 119 6724 1 . ASP 120 120 6724 1 . GLY 121 121 6724 1 . VAL 122 122 6724 1 . THR 123 123 6724 1 . SER 124 124 6724 1 . VAL 125 125 6724 1 . ARG 126 126 6724 1 . THR 127 127 6724 1 . TYR 128 128 6724 1 . LYS 129 129 6724 1 . ARG 130 130 6724 1 . ILE 131 131 6724 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 6724 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Fatty_acid_binding_protein . 6954 organism no . 'House Dust Mites' . . Eukaryota Metazoa Dermatophagoides farinae . . . . . . . . . . . . . . . . . . . . . 6724 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 6724 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Fatty_acid_binding_protein . 'recombinant technology' . 'Escherichia coli' BL21 . Escherichia coli BL21 . . . . . . . . . . . . . . . . . . . . . . 6724 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6724 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Der f 13' [U-15N] 1 $assembly 1 $Fatty_acid_binding_protein . protein 1 0.5 1.0 mM 0 . . . 6724 1 2 'acetate buffer' . . . . . . . 50 . . mM . . . . 6724 1 3 D2O . . . . . . . 10 . . % . . . . 6724 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6724 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Der f 13' [U-13C] 1 $assembly 1 $Fatty_acid_binding_protein . protein 1 0.5 1.0 mM 0 . . . 6724 2 2 'acetate buffer' . . . . . . . 50 . . mM . . . . 6724 2 3 D2O . . . . . . . 10 . . % . . . . 6724 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 6724 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Der f 13' '[U-13C; U-15N]' 1 $assembly 1 $Fatty_acid_binding_protein . protein 1 0.5 1.0 mM 0 . . . 6724 3 2 'acetate buffer' . . . . . . . 50 . . mM . . . . 6724 3 3 D2O . . . . . . . 10 . . % . . . . 6724 3 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6724 _Sample_condition_list.ID 1 _Sample_condition_list.Details '1mM protein solution in 50 mM acetate buffer, 10% D2O.' 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 4.5 0 pH 6724 1 temperature 298 0 K 6724 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 6724 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6724 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 HCCH-TOCSY no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 6724 1 2 HCCCONH no . . . . . . . . . . 3 $sample_3 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 6724 1 3 CBCACONH no . . . . . . . . . . 3 $sample_3 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 6724 1 4 HNCACB no . . . . . . . . . . 3 $sample_3 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 6724 1 5 1H15N_HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 6724 1 stop_ save_ save_HCCH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HCCH-TOCSY _NMR_spec_expt.Entry_ID 6724 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name HCCH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HCCCONH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HCCCONH _NMR_spec_expt.Entry_ID 6724 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HCCCONH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_CBCACONH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode CBCACONH _NMR_spec_expt.Entry_ID 6724 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name CBCACONH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCACB _NMR_spec_expt.Entry_ID 6724 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HSQC _NMR_spec_expt.Entry_ID 6724 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name 1H15N_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6724 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6724 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6724 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6724 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6724 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 6724 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 8.544 0.000 . . . . . . 1 MET HN . 6724 1 2 . 1 1 1 1 MET HA H 1 4.435 0.000 . . . . . . 1 MET HA . 6724 1 3 . 1 1 1 1 MET CA C 13 55.520 0.000 . . . . . . 1 MET CA . 6724 1 4 . 1 1 1 1 MET CB C 13 32.844 0.000 . . . . . . 1 MET CB . 6724 1 5 . 1 1 1 1 MET N N 15 122.603 0.000 . . . . . . 1 MET N . 6724 1 6 . 1 1 2 2 ALA H H 1 8.342 0.000 . . . . . . 2 ALA HN . 6724 1 7 . 1 1 2 2 ALA HA H 1 4.234 0.000 . . . . . . 2 ALA HA . 6724 1 8 . 1 1 2 2 ALA HB1 H 1 1.340 0.000 . . . . . . 2 ALA QB . 6724 1 9 . 1 1 2 2 ALA HB2 H 1 1.340 0.000 . . . . . . 2 ALA QB . 6724 1 10 . 1 1 2 2 ALA HB3 H 1 1.340 0.000 . . . . . . 2 ALA QB . 6724 1 11 . 1 1 2 2 ALA CA C 13 52.552 0.000 . . . . . . 2 ALA CA . 6724 1 12 . 1 1 2 2 ALA CB C 13 19.132 0.000 . . . . . . 2 ALA CB . 6724 1 13 . 1 1 2 2 ALA N N 15 124.807 0.000 . . . . . . 2 ALA N . 6724 1 14 . 1 1 3 3 SER H H 1 8.274 0.000 . . . . . . 3 SER HN . 6724 1 15 . 1 1 3 3 SER HA H 1 3.921 0.000 . . . . . . 3 SER HA . 6724 1 16 . 1 1 3 3 SER HB2 H 1 3.816 0.000 . . . . . . 3 SER QB . 6724 1 17 . 1 1 3 3 SER HB3 H 1 3.816 0.000 . . . . . . 3 SER QB . 6724 1 18 . 1 1 3 3 SER CA C 13 58.109 0.000 . . . . . . 3 SER CA . 6724 1 19 . 1 1 3 3 SER CB C 13 63.464 0.000 . . . . . . 3 SER CB . 6724 1 20 . 1 1 3 3 SER N N 15 115.024 0.000 . . . . . . 3 SER N . 6724 1 21 . 1 1 4 4 ILE H H 1 7.751 0.000 . . . . . . 4 ILE HN . 6724 1 22 . 1 1 4 4 ILE HA H 1 3.960 0.000 . . . . . . 4 ILE HA . 6724 1 23 . 1 1 4 4 ILE HB H 1 1.207 0.000 . . . . . . 4 ILE HB . 6724 1 24 . 1 1 4 4 ILE HG12 H 1 1.074 0.000 . . . . . . 4 ILE HG12 . 6724 1 25 . 1 1 4 4 ILE HG13 H 1 0.941 0.000 . . . . . . 4 ILE HG13 . 6724 1 26 . 1 1 4 4 ILE HG21 H 1 0.437 0.000 . . . . . . 4 ILE QG2 . 6724 1 27 . 1 1 4 4 ILE HG22 H 1 0.437 0.000 . . . . . . 4 ILE QG2 . 6724 1 28 . 1 1 4 4 ILE HG23 H 1 0.437 0.000 . . . . . . 4 ILE QG2 . 6724 1 29 . 1 1 4 4 ILE HD11 H 1 0.414 0.000 . . . . . . 4 ILE QD1 . 6724 1 30 . 1 1 4 4 ILE HD12 H 1 0.414 0.000 . . . . . . 4 ILE QD1 . 6724 1 31 . 1 1 4 4 ILE HD13 H 1 0.414 0.000 . . . . . . 4 ILE QD1 . 6724 1 32 . 1 1 4 4 ILE CA C 13 62.620 0.000 . . . . . . 4 ILE CA . 6724 1 33 . 1 1 4 4 ILE CB C 13 38.008 0.000 . . . . . . 4 ILE CB . 6724 1 34 . 1 1 4 4 ILE CG1 C 13 25.521 0.000 . . . . . . 4 ILE CG1 . 6724 1 35 . 1 1 4 4 ILE CG2 C 13 17.417 0.000 . . . . . . 4 ILE CG2 . 6724 1 36 . 1 1 4 4 ILE CD1 C 13 13.846 0.000 . . . . . . 4 ILE CD1 . 6724 1 37 . 1 1 4 4 ILE N N 15 117.395 0.000 . . . . . . 4 ILE N . 6724 1 38 . 1 1 5 5 GLU H H 1 7.979 0.000 . . . . . . 5 GLU HN . 6724 1 39 . 1 1 5 5 GLU HA H 1 3.758 0.000 . . . . . . 5 GLU HA . 6724 1 40 . 1 1 5 5 GLU CA C 13 57.590 0.000 . . . . . . 5 GLU CA . 6724 1 41 . 1 1 5 5 GLU CB C 13 30.426 0.000 . . . . . . 5 GLU CB . 6724 1 42 . 1 1 5 5 GLU CG C 13 37.446 0.000 . . . . . . 5 GLU CG . 6724 1 43 . 1 1 5 5 GLU N N 15 120.360 0.000 . . . . . . 5 GLU N . 6724 1 44 . 1 1 6 6 GLY H H 1 8.352 0.000 . . . . . . 6 GLY HN . 6724 1 45 . 1 1 6 6 GLY HA2 H 1 3.292 0.000 . . . . . . 6 GLY HA1 . 6724 1 46 . 1 1 6 6 GLY HA3 H 1 2.994 0.000 . . . . . . 6 GLY HA2 . 6724 1 47 . 1 1 6 6 GLY CA C 13 44.281 0.000 . . . . . . 6 GLY CA . 6724 1 48 . 1 1 6 6 GLY N N 15 108.332 0.000 . . . . . . 6 GLY N . 6724 1 49 . 1 1 7 7 LYS H H 1 8.023 0.000 . . . . . . 7 LYS HN . 6724 1 50 . 1 1 7 7 LYS HA H 1 4.910 0.000 . . . . . . 7 LYS HA . 6724 1 51 . 1 1 7 7 LYS HB2 H 1 1.507 0.000 . . . . . . 7 LYS QB . 6724 1 52 . 1 1 7 7 LYS HB3 H 1 1.507 0.000 . . . . . . 7 LYS QB . 6724 1 53 . 1 1 7 7 LYS HG2 H 1 1.059 0.000 . . . . . . 7 LYS QG . 6724 1 54 . 1 1 7 7 LYS HG3 H 1 1.059 0.000 . . . . . . 7 LYS QG . 6724 1 55 . 1 1 7 7 LYS HD2 H 1 1.382 0.000 . . . . . . 7 LYS QD . 6724 1 56 . 1 1 7 7 LYS HD3 H 1 1.382 0.000 . . . . . . 7 LYS QD . 6724 1 57 . 1 1 7 7 LYS HE2 H 1 2.755 0.000 . . . . . . 7 LYS QE . 6724 1 58 . 1 1 7 7 LYS HE3 H 1 2.755 0.000 . . . . . . 7 LYS QE . 6724 1 59 . 1 1 7 7 LYS CA C 13 55.133 0.000 . . . . . . 7 LYS CA . 6724 1 60 . 1 1 7 7 LYS CB C 13 35.870 0.000 . . . . . . 7 LYS CB . 6724 1 61 . 1 1 7 7 LYS CG C 13 25.749 0.000 . . . . . . 7 LYS CG . 6724 1 62 . 1 1 7 7 LYS CD C 13 29.655 0.000 . . . . . . 7 LYS CD . 6724 1 63 . 1 1 7 7 LYS CE C 13 42.009 0.000 . . . . . . 7 LYS CE . 6724 1 64 . 1 1 7 7 LYS N N 15 117.300 0.000 . . . . . . 7 LYS N . 6724 1 65 . 1 1 8 8 TYR H H 1 9.311 0.000 . . . . . . 8 TYR HN . 6724 1 66 . 1 1 8 8 TYR HA H 1 5.116 0.000 . . . . . . 8 TYR HA . 6724 1 67 . 1 1 8 8 TYR HB2 H 1 2.704 0.000 . . . . . . 8 TYR HB2 . 6724 1 68 . 1 1 8 8 TYR HB3 H 1 2.834 0.000 . . . . . . 8 TYR HB3 . 6724 1 69 . 1 1 8 8 TYR CA C 13 55.273 0.000 . . . . . . 8 TYR CA . 6724 1 70 . 1 1 8 8 TYR CB C 13 42.341 0.000 . . . . . . 8 TYR CB . 6724 1 71 . 1 1 8 8 TYR N N 15 119.066 0.000 . . . . . . 8 TYR N . 6724 1 72 . 1 1 9 9 LYS H H 1 9.495 0.000 . . . . . . 9 LYS HN . 6724 1 73 . 1 1 9 9 LYS HA H 1 5.243 0.000 . . . . . . 9 LYS HA . 6724 1 74 . 1 1 9 9 LYS HB2 H 1 1.844 0.000 . . . . . . 9 LYS QB . 6724 1 75 . 1 1 9 9 LYS HB3 H 1 1.844 0.000 . . . . . . 9 LYS QB . 6724 1 76 . 1 1 9 9 LYS HG2 H 1 1.366 0.000 . . . . . . 9 LYS HG2 . 6724 1 77 . 1 1 9 9 LYS HG3 H 1 1.446 0.000 . . . . . . 9 LYS HG3 . 6724 1 78 . 1 1 9 9 LYS HD2 H 1 1.632 0.000 . . . . . . 9 LYS QD . 6724 1 79 . 1 1 9 9 LYS HD3 H 1 1.632 0.000 . . . . . . 9 LYS QD . 6724 1 80 . 1 1 9 9 LYS HE2 H 1 2.933 0.000 . . . . . . 9 LYS QE . 6724 1 81 . 1 1 9 9 LYS HE3 H 1 2.933 0.000 . . . . . . 9 LYS QE . 6724 1 82 . 1 1 9 9 LYS CA C 13 54.998 0.000 . . . . . . 9 LYS CA . 6724 1 83 . 1 1 9 9 LYS CB C 13 35.852 0.000 . . . . . . 9 LYS CB . 6724 1 84 . 1 1 9 9 LYS CG C 13 24.685 0.000 . . . . . . 9 LYS CG . 6724 1 85 . 1 1 9 9 LYS CD C 13 29.611 0.000 . . . . . . 9 LYS CD . 6724 1 86 . 1 1 9 9 LYS CE C 13 42.264 0.000 . . . . . . 9 LYS CE . 6724 1 87 . 1 1 9 9 LYS N N 15 124.771 0.000 . . . . . . 9 LYS N . 6724 1 88 . 1 1 10 10 LEU H H 1 7.826 0.000 . . . . . . 10 LEU HN . 6724 1 89 . 1 1 10 10 LEU HA H 1 3.092 0.000 . . . . . . 10 LEU HA . 6724 1 90 . 1 1 10 10 LEU HB2 H 1 0.995 0.000 . . . . . . 10 LEU QB . 6724 1 91 . 1 1 10 10 LEU HB3 H 1 0.995 0.000 . . . . . . 10 LEU QB . 6724 1 92 . 1 1 10 10 LEU HG H 1 1.287 0.000 . . . . . . 10 LEU HG . 6724 1 93 . 1 1 10 10 LEU HD11 H 1 0.012 0.000 . . . . . . 10 LEU QD1 . 6724 1 94 . 1 1 10 10 LEU HD12 H 1 0.012 0.000 . . . . . . 10 LEU QD1 . 6724 1 95 . 1 1 10 10 LEU HD13 H 1 0.012 0.000 . . . . . . 10 LEU QD1 . 6724 1 96 . 1 1 10 10 LEU HD21 H 1 0.703 0.000 . . . . . . 10 LEU QD2 . 6724 1 97 . 1 1 10 10 LEU HD22 H 1 0.703 0.000 . . . . . . 10 LEU QD2 . 6724 1 98 . 1 1 10 10 LEU HD23 H 1 0.703 0.000 . . . . . . 10 LEU QD2 . 6724 1 99 . 1 1 10 10 LEU CA C 13 57.308 0.000 . . . . . . 10 LEU CA . 6724 1 100 . 1 1 10 10 LEU CB C 13 41.845 0.000 . . . . . . 10 LEU CB . 6724 1 101 . 1 1 10 10 LEU CG C 13 26.662 0.000 . . . . . . 10 LEU CG . 6724 1 102 . 1 1 10 10 LEU CD1 C 13 22.329 0.000 . . . . . . 10 LEU CD1 . 6724 1 103 . 1 1 10 10 LEU N N 15 128.132 0.000 . . . . . . 10 LEU N . 6724 1 104 . 1 1 11 11 GLU H H 1 9.317 0.000 . . . . . . 11 GLU HN . 6724 1 105 . 1 1 11 11 GLU HA H 1 4.420 0.000 . . . . . . 11 GLU HA . 6724 1 106 . 1 1 11 11 GLU HB2 H 1 1.818 0.000 . . . . . . 11 GLU QB . 6724 1 107 . 1 1 11 11 GLU HB3 H 1 1.818 0.000 . . . . . . 11 GLU QB . 6724 1 108 . 1 1 11 11 GLU HG2 H 1 2.136 0.000 . . . . . . 11 GLU HG2 . 6724 1 109 . 1 1 11 11 GLU HG3 H 1 2.216 0.000 . . . . . . 11 GLU HG3 . 6724 1 110 . 1 1 11 11 GLU CA C 13 56.188 0.000 . . . . . . 11 GLU CA . 6724 1 111 . 1 1 11 11 GLU CB C 13 31.817 0.000 . . . . . . 11 GLU CB . 6724 1 112 . 1 1 11 11 GLU CG C 13 34.808 0.000 . . . . . . 11 GLU CG . 6724 1 113 . 1 1 11 11 GLU N N 15 126.834 0.000 . . . . . . 11 GLU N . 6724 1 114 . 1 1 12 12 LYS H H 1 7.545 0.000 . . . . . . 12 LYS HN . 6724 1 115 . 1 1 12 12 LYS HA H 1 4.442 0.000 . . . . . . 12 LYS HA . 6724 1 116 . 1 1 12 12 LYS HB2 H 1 1.711 0.000 . . . . . . 12 LYS QB . 6724 1 117 . 1 1 12 12 LYS HB3 H 1 1.711 0.000 . . . . . . 12 LYS QB . 6724 1 118 . 1 1 12 12 LYS HG2 H 1 1.260 0.000 . . . . . . 12 LYS QG . 6724 1 119 . 1 1 12 12 LYS HG3 H 1 1.260 0.000 . . . . . . 12 LYS QG . 6724 1 120 . 1 1 12 12 LYS HD2 H 1 1.499 0.000 . . . . . . 12 LYS QD . 6724 1 121 . 1 1 12 12 LYS HD3 H 1 1.499 0.000 . . . . . . 12 LYS QD . 6724 1 122 . 1 1 12 12 LYS HE2 H 1 2.797 0.000 . . . . . . 12 LYS QE . 6724 1 123 . 1 1 12 12 LYS HE3 H 1 2.797 0.000 . . . . . . 12 LYS QE . 6724 1 124 . 1 1 12 12 LYS CA C 13 55.501 0.000 . . . . . . 12 LYS CA . 6724 1 125 . 1 1 12 12 LYS CB C 13 36.198 0.000 . . . . . . 12 LYS CB . 6724 1 126 . 1 1 12 12 LYS CG C 13 24.900 0.000 . . . . . . 12 LYS CG . 6724 1 127 . 1 1 12 12 LYS CD C 13 29.464 0.000 . . . . . . 12 LYS CD . 6724 1 128 . 1 1 12 12 LYS CE C 13 42.095 0.000 . . . . . . 12 LYS CE . 6724 1 129 . 1 1 12 12 LYS N N 15 117.358 0.000 . . . . . . 12 LYS N . 6724 1 130 . 1 1 13 13 SER H H 1 8.371 0.000 . . . . . . 13 SER HN . 6724 1 131 . 1 1 13 13 SER HA H 1 4.818 0.000 . . . . . . 13 SER HA . 6724 1 132 . 1 1 13 13 SER HB2 H 1 3.627 0.000 . . . . . . 13 SER HB2 . 6724 1 133 . 1 1 13 13 SER HB3 H 1 3.187 0.000 . . . . . . 13 SER HB3 . 6724 1 134 . 1 1 13 13 SER CA C 13 57.073 0.000 . . . . . . 13 SER CA . 6724 1 135 . 1 1 13 13 SER CB C 13 64.351 0.000 . . . . . . 13 SER CB . 6724 1 136 . 1 1 13 13 SER N N 15 115.577 0.000 . . . . . . 13 SER N . 6724 1 137 . 1 1 14 14 GLU H H 1 8.664 0.000 . . . . . . 14 GLU HN . 6724 1 138 . 1 1 14 14 GLU HA H 1 4.769 0.000 . . . . . . 14 GLU HA . 6724 1 139 . 1 1 14 14 GLU CA C 13 55.138 0.000 . . . . . . 14 GLU CA . 6724 1 140 . 1 1 14 14 GLU CB C 13 32.555 0.000 . . . . . . 14 GLU CB . 6724 1 141 . 1 1 14 14 GLU CG C 13 35.488 0.000 . . . . . . 14 GLU CG . 6724 1 142 . 1 1 14 14 GLU N N 15 127.171 0.000 . . . . . . 14 GLU N . 6724 1 143 . 1 1 15 15 LYS H H 1 9.375 0.000 . . . . . . 15 LYS HN . 6724 1 144 . 1 1 15 15 LYS HA H 1 4.207 0.000 . . . . . . 15 LYS HA . 6724 1 145 . 1 1 15 15 LYS HB2 H 1 2.189 0.000 . . . . . . 15 LYS QB . 6724 1 146 . 1 1 15 15 LYS HB3 H 1 2.189 0.000 . . . . . . 15 LYS QB . 6724 1 147 . 1 1 15 15 LYS HG2 H 1 1.685 0.000 . . . . . . 15 LYS QG . 6724 1 148 . 1 1 15 15 LYS HG3 H 1 1.685 0.000 . . . . . . 15 LYS QG . 6724 1 149 . 1 1 15 15 LYS HE2 H 1 2.986 0.000 . . . . . . 15 LYS QE . 6724 1 150 . 1 1 15 15 LYS HE3 H 1 2.986 0.000 . . . . . . 15 LYS QE . 6724 1 151 . 1 1 15 15 LYS CA C 13 57.594 0.000 . . . . . . 15 LYS CA . 6724 1 152 . 1 1 15 15 LYS CB C 13 30.072 0.000 . . . . . . 15 LYS CB . 6724 1 153 . 1 1 15 15 LYS CG C 13 26.170 0.000 . . . . . . 15 LYS CG . 6724 1 154 . 1 1 15 15 LYS CE C 13 42.290 0.000 . . . . . . 15 LYS CE . 6724 1 155 . 1 1 15 15 LYS N N 15 120.298 0.000 . . . . . . 15 LYS N . 6724 1 156 . 1 1 16 16 PHE H H 1 8.459 0.000 . . . . . . 16 PHE HN . 6724 1 157 . 1 1 16 16 PHE HA H 1 4.659 0.000 . . . . . . 16 PHE HA . 6724 1 158 . 1 1 16 16 PHE CA C 13 59.813 0.000 . . . . . . 16 PHE CA . 6724 1 159 . 1 1 16 16 PHE CB C 13 39.307 0.000 . . . . . . 16 PHE CB . 6724 1 160 . 1 1 16 16 PHE N N 15 120.463 0.000 . . . . . . 16 PHE N . 6724 1 161 . 1 1 17 17 ASP H H 1 8.410 0.000 . . . . . . 17 ASP HN . 6724 1 162 . 1 1 17 17 ASP HA H 1 3.915 0.000 . . . . . . 17 ASP HA . 6724 1 163 . 1 1 17 17 ASP HB2 H 1 2.508 0.000 . . . . . . 17 ASP QB . 6724 1 164 . 1 1 17 17 ASP HB3 H 1 2.508 0.000 . . . . . . 17 ASP QB . 6724 1 165 . 1 1 17 17 ASP CA C 13 57.431 0.000 . . . . . . 17 ASP CA . 6724 1 166 . 1 1 17 17 ASP CB C 13 39.698 0.000 . . . . . . 17 ASP CB . 6724 1 167 . 1 1 17 17 ASP N N 15 117.439 0.000 . . . . . . 17 ASP N . 6724 1 168 . 1 1 18 18 GLU H H 1 8.732 0.000 . . . . . . 18 GLU HN . 6724 1 169 . 1 1 18 18 GLU HA H 1 3.889 0.000 . . . . . . 18 GLU HA . 6724 1 170 . 1 1 18 18 GLU HB2 H 1 1.871 0.000 . . . . . . 18 GLU HB2 . 6724 1 171 . 1 1 18 18 GLU HB3 H 1 2.003 0.000 . . . . . . 18 GLU HB3 . 6724 1 172 . 1 1 18 18 GLU HG2 H 1 2.428 0.000 . . . . . . 18 GLU HG2 . 6724 1 173 . 1 1 18 18 GLU HG3 H 1 2.269 0.000 . . . . . . 18 GLU HG3 . 6724 1 174 . 1 1 18 18 GLU CA C 13 59.833 0.000 . . . . . . 18 GLU CA . 6724 1 175 . 1 1 18 18 GLU CB C 13 28.646 0.000 . . . . . . 18 GLU CB . 6724 1 176 . 1 1 18 18 GLU CG C 13 37.130 0.000 . . . . . . 18 GLU CG . 6724 1 177 . 1 1 18 18 GLU N N 15 119.848 0.000 . . . . . . 18 GLU N . 6724 1 178 . 1 1 19 19 PHE H H 1 7.716 0.000 . . . . . . 19 PHE HN . 6724 1 179 . 1 1 19 19 PHE HA H 1 3.809 0.000 . . . . . . 19 PHE HA . 6724 1 180 . 1 1 19 19 PHE HB2 H 1 2.906 0.000 . . . . . . 19 PHE HB2 . 6724 1 181 . 1 1 19 19 PHE HB3 H 1 3.225 0.000 . . . . . . 19 PHE HB3 . 6724 1 182 . 1 1 19 19 PHE CA C 13 61.519 0.000 . . . . . . 19 PHE CA . 6724 1 183 . 1 1 19 19 PHE CB C 13 39.747 0.000 . . . . . . 19 PHE CB . 6724 1 184 . 1 1 19 19 PHE N N 15 122.193 0.000 . . . . . . 19 PHE N . 6724 1 185 . 1 1 20 20 LEU H H 1 8.293 0.000 . . . . . . 20 LEU HN . 6724 1 186 . 1 1 20 20 LEU HA H 1 3.398 0.000 . . . . . . 20 LEU HA . 6724 1 187 . 1 1 20 20 LEU HB2 H 1 1.649 0.000 . . . . . . 20 LEU QB . 6724 1 188 . 1 1 20 20 LEU HB3 H 1 1.649 0.000 . . . . . . 20 LEU QB . 6724 1 189 . 1 1 20 20 LEU HG H 1 1.042 0.000 . . . . . . 20 LEU HG . 6724 1 190 . 1 1 20 20 LEU HD11 H 1 0.267 0.000 . . . . . . 20 LEU QD1 . 6724 1 191 . 1 1 20 20 LEU HD12 H 1 0.267 0.000 . . . . . . 20 LEU QD1 . 6724 1 192 . 1 1 20 20 LEU HD13 H 1 0.267 0.000 . . . . . . 20 LEU QD1 . 6724 1 193 . 1 1 20 20 LEU HD21 H 1 0.852 0.000 . . . . . . 20 LEU QD2 . 6724 1 194 . 1 1 20 20 LEU HD22 H 1 0.852 0.000 . . . . . . 20 LEU QD2 . 6724 1 195 . 1 1 20 20 LEU HD23 H 1 0.852 0.000 . . . . . . 20 LEU QD2 . 6724 1 196 . 1 1 20 20 LEU CA C 13 57.148 0.000 . . . . . . 20 LEU CA . 6724 1 197 . 1 1 20 20 LEU CB C 13 40.053 0.000 . . . . . . 20 LEU CB . 6724 1 198 . 1 1 20 20 LEU CG C 13 27.011 0.000 . . . . . . 20 LEU CG . 6724 1 199 . 1 1 20 20 LEU CD2 C 13 22.823 0.000 . . . . . . 20 LEU CD2 . 6724 1 200 . 1 1 20 20 LEU N N 15 119.356 0.000 . . . . . . 20 LEU N . 6724 1 201 . 1 1 21 21 ASP H H 1 7.913 0.000 . . . . . . 21 ASP HN . 6724 1 202 . 1 1 21 21 ASP HA H 1 4.260 0.000 . . . . . . 21 ASP HA . 6724 1 203 . 1 1 21 21 ASP HB2 H 1 2.561 0.000 . . . . . . 21 ASP HB2 . 6724 1 204 . 1 1 21 21 ASP HB3 H 1 2.641 0.000 . . . . . . 21 ASP HB3 . 6724 1 205 . 1 1 21 21 ASP CA C 13 56.813 0.000 . . . . . . 21 ASP CA . 6724 1 206 . 1 1 21 21 ASP CB C 13 40.117 0.000 . . . . . . 21 ASP CB . 6724 1 207 . 1 1 21 21 ASP N N 15 118.730 0.000 . . . . . . 21 ASP N . 6724 1 208 . 1 1 22 22 LYS H H 1 7.348 0.000 . . . . . . 22 LYS HN . 6724 1 209 . 1 1 22 22 LYS HA H 1 3.942 0.000 . . . . . . 22 LYS HA . 6724 1 210 . 1 1 22 22 LYS HB2 H 1 1.818 0.000 . . . . . . 22 LYS QB . 6724 1 211 . 1 1 22 22 LYS HB3 H 1 1.818 0.000 . . . . . . 22 LYS QB . 6724 1 212 . 1 1 22 22 LYS HG2 H 1 1.340 0.000 . . . . . . 22 LYS QG . 6724 1 213 . 1 1 22 22 LYS HG3 H 1 1.340 0.000 . . . . . . 22 LYS QG . 6724 1 214 . 1 1 22 22 LYS HD2 H 1 1.632 0.000 . . . . . . 22 LYS QD . 6724 1 215 . 1 1 22 22 LYS HD3 H 1 1.632 0.000 . . . . . . 22 LYS QD . 6724 1 216 . 1 1 22 22 LYS HE2 H 1 2.959 0.000 . . . . . . 22 LYS QE . 6724 1 217 . 1 1 22 22 LYS HE3 H 1 2.959 0.000 . . . . . . 22 LYS QE . 6724 1 218 . 1 1 22 22 LYS CA C 13 56.601 0.000 . . . . . . 22 LYS CA . 6724 1 219 . 1 1 22 22 LYS CB C 13 30.879 0.000 . . . . . . 22 LYS CB . 6724 1 220 . 1 1 22 22 LYS CG C 13 23.675 0.000 . . . . . . 22 LYS CG . 6724 1 221 . 1 1 22 22 LYS CD C 13 27.602 0.000 . . . . . . 22 LYS CD . 6724 1 222 . 1 1 22 22 LYS CE C 13 42.317 0.000 . . . . . . 22 LYS CE . 6724 1 223 . 1 1 22 22 LYS N N 15 119.627 0.000 . . . . . . 22 LYS N . 6724 1 224 . 1 1 23 23 LEU H H 1 7.522 0.000 . . . . . . 23 LEU HN . 6724 1 225 . 1 1 23 23 LEU HA H 1 3.756 0.000 . . . . . . 23 LEU HA . 6724 1 226 . 1 1 23 23 LEU HB2 H 1 1.207 0.000 . . . . . . 23 LEU HB2 . 6724 1 227 . 1 1 23 23 LEU HB3 H 1 1.340 0.000 . . . . . . 23 LEU HB3 . 6724 1 228 . 1 1 23 23 LEU HG H 1 0.862 0.000 . . . . . . 23 LEU HG . 6724 1 229 . 1 1 23 23 LEU HD21 H 1 0.437 0.000 . . . . . . 23 LEU QD2 . 6724 1 230 . 1 1 23 23 LEU HD22 H 1 0.437 0.000 . . . . . . 23 LEU QD2 . 6724 1 231 . 1 1 23 23 LEU HD23 H 1 0.437 0.000 . . . . . . 23 LEU QD2 . 6724 1 232 . 1 1 23 23 LEU CA C 13 56.324 0.000 . . . . . . 23 LEU CA . 6724 1 233 . 1 1 23 23 LEU CB C 13 42.596 0.000 . . . . . . 23 LEU CB . 6724 1 234 . 1 1 23 23 LEU CG C 13 27.192 0.000 . . . . . . 23 LEU CG . 6724 1 235 . 1 1 23 23 LEU CD1 C 13 24.860 0.000 . . . . . . 23 LEU CD1 . 6724 1 236 . 1 1 23 23 LEU CD2 C 13 25.449 0.000 . . . . . . 23 LEU CD2 . 6724 1 237 . 1 1 23 23 LEU N N 15 118.314 0.000 . . . . . . 23 LEU N . 6724 1 238 . 1 1 24 24 GLY H H 1 7.570 0.000 . . . . . . 24 GLY HN . 6724 1 239 . 1 1 24 24 GLY HA2 H 1 3.225 0.000 . . . . . . 24 GLY HA1 . 6724 1 240 . 1 1 24 24 GLY HA3 H 1 2.884 0.000 . . . . . . 24 GLY HA2 . 6724 1 241 . 1 1 24 24 GLY CA C 13 45.994 0.000 . . . . . . 24 GLY CA . 6724 1 242 . 1 1 24 24 GLY N N 15 106.294 0.000 . . . . . . 24 GLY N . 6724 1 243 . 1 1 25 25 VAL H H 1 6.777 0.000 . . . . . . 25 VAL HN . 6724 1 244 . 1 1 25 25 VAL HA H 1 4.240 0.000 . . . . . . 25 VAL HA . 6724 1 245 . 1 1 25 25 VAL HB H 1 2.010 0.000 . . . . . . 25 VAL HB . 6724 1 246 . 1 1 25 25 VAL HG11 H 1 0.897 0.000 . . . . . . 25 VAL QG1 . 6724 1 247 . 1 1 25 25 VAL HG12 H 1 0.897 0.000 . . . . . . 25 VAL QG1 . 6724 1 248 . 1 1 25 25 VAL HG13 H 1 0.897 0.000 . . . . . . 25 VAL QG1 . 6724 1 249 . 1 1 25 25 VAL HG21 H 1 0.736 0.000 . . . . . . 25 VAL QG2 . 6724 1 250 . 1 1 25 25 VAL HG22 H 1 0.736 0.000 . . . . . . 25 VAL QG2 . 6724 1 251 . 1 1 25 25 VAL HG23 H 1 0.736 0.000 . . . . . . 25 VAL QG2 . 6724 1 252 . 1 1 25 25 VAL CA C 13 60.682 0.000 . . . . . . 25 VAL CA . 6724 1 253 . 1 1 25 25 VAL CB C 13 32.942 0.000 . . . . . . 25 VAL CB . 6724 1 254 . 1 1 25 25 VAL CG1 C 13 22.268 0.000 . . . . . . 25 VAL CG1 . 6724 1 255 . 1 1 25 25 VAL CG2 C 13 20.932 0.000 . . . . . . 25 VAL CG2 . 6724 1 256 . 1 1 25 25 VAL N N 15 111.692 0.000 . . . . . . 25 VAL N . 6724 1 257 . 1 1 26 26 GLY H H 1 8.459 0.000 . . . . . . 26 GLY HN . 6724 1 258 . 1 1 26 26 GLY HA2 H 1 4.257 0.000 . . . . . . 26 GLY HA1 . 6724 1 259 . 1 1 26 26 GLY HA3 H 1 4.003 0.000 . . . . . . 26 GLY HA2 . 6724 1 260 . 1 1 26 26 GLY CA C 13 44.777 0.000 . . . . . . 26 GLY CA . 6724 1 261 . 1 1 26 26 GLY N N 15 107.232 0.000 . . . . . . 26 GLY N . 6724 1 262 . 1 1 27 27 PHE H H 1 8.523 0.000 . . . . . . 27 PHE HN . 6724 1 263 . 1 1 27 27 PHE HA H 1 4.021 0.000 . . . . . . 27 PHE HA . 6724 1 264 . 1 1 27 27 PHE HB2 H 1 2.959 0.000 . . . . . . 27 PHE HB2 . 6724 1 265 . 1 1 27 27 PHE HB3 H 1 3.198 0.000 . . . . . . 27 PHE HB3 . 6724 1 266 . 1 1 27 27 PHE CA C 13 61.552 0.000 . . . . . . 27 PHE CA . 6724 1 267 . 1 1 27 27 PHE CB C 13 39.274 0.000 . . . . . . 27 PHE CB . 6724 1 268 . 1 1 27 27 PHE N N 15 120.207 0.000 . . . . . . 27 PHE N . 6724 1 269 . 1 1 28 28 MET H H 1 8.714 0.000 . . . . . . 28 MET HN . 6724 1 270 . 1 1 28 28 MET HA H 1 3.995 0.000 . . . . . . 28 MET HA . 6724 1 271 . 1 1 28 28 MET HB2 H 1 2.003 0.000 . . . . . . 28 MET HB2 . 6724 1 272 . 1 1 28 28 MET HB3 H 1 2.110 0.000 . . . . . . 28 MET HB3 . 6724 1 273 . 1 1 28 28 MET CA C 13 58.609 0.000 . . . . . . 28 MET CA . 6724 1 274 . 1 1 28 28 MET CB C 13 31.310 0.000 . . . . . . 28 MET CB . 6724 1 275 . 1 1 28 28 MET CG C 13 32.414 0.000 . . . . . . 28 MET CG . 6724 1 276 . 1 1 28 28 MET N N 15 118.777 0.000 . . . . . . 28 MET N . 6724 1 277 . 1 1 29 29 VAL H H 1 7.332 0.000 . . . . . . 29 VAL HN . 6724 1 278 . 1 1 29 29 VAL HA H 1 3.114 0.000 . . . . . . 29 VAL HA . 6724 1 279 . 1 1 29 29 VAL HB H 1 1.949 0.000 . . . . . . 29 VAL HB . 6724 1 280 . 1 1 29 29 VAL HG11 H 1 0.643 0.000 . . . . . . 29 VAL QG1 . 6724 1 281 . 1 1 29 29 VAL HG12 H 1 0.643 0.000 . . . . . . 29 VAL QG1 . 6724 1 282 . 1 1 29 29 VAL HG13 H 1 0.643 0.000 . . . . . . 29 VAL QG1 . 6724 1 283 . 1 1 29 29 VAL HG21 H 1 1.043 0.000 . . . . . . 29 VAL QG2 . 6724 1 284 . 1 1 29 29 VAL HG22 H 1 1.043 0.000 . . . . . . 29 VAL QG2 . 6724 1 285 . 1 1 29 29 VAL HG23 H 1 1.043 0.000 . . . . . . 29 VAL QG2 . 6724 1 286 . 1 1 29 29 VAL CA C 13 65.321 0.000 . . . . . . 29 VAL CA . 6724 1 287 . 1 1 29 29 VAL CB C 13 30.948 0.000 . . . . . . 29 VAL CB . 6724 1 288 . 1 1 29 29 VAL CG2 C 13 22.451 0.000 . . . . . . 29 VAL CG2 . 6724 1 289 . 1 1 29 29 VAL N N 15 120.000 0.000 . . . . . . 29 VAL N . 6724 1 290 . 1 1 30 30 LYS H H 1 7.571 0.000 . . . . . . 30 LYS HN . 6724 1 291 . 1 1 30 30 LYS HA H 1 3.490 0.000 . . . . . . 30 LYS HA . 6724 1 292 . 1 1 30 30 LYS HB2 H 1 1.446 0.000 . . . . . . 30 LYS HB2 . 6724 1 293 . 1 1 30 30 LYS HB3 H 1 1.579 0.000 . . . . . . 30 LYS HB3 . 6724 1 294 . 1 1 30 30 LYS HG2 H 1 0.995 0.000 . . . . . . 30 LYS QG . 6724 1 295 . 1 1 30 30 LYS HG3 H 1 0.995 0.000 . . . . . . 30 LYS QG . 6724 1 296 . 1 1 30 30 LYS HD2 H 1 1.207 0.000 . . . . . . 30 LYS QD . 6724 1 297 . 1 1 30 30 LYS HD3 H 1 1.207 0.000 . . . . . . 30 LYS QD . 6724 1 298 . 1 1 30 30 LYS HE2 H 1 2.694 0.000 . . . . . . 30 LYS QE . 6724 1 299 . 1 1 30 30 LYS HE3 H 1 2.694 0.000 . . . . . . 30 LYS QE . 6724 1 300 . 1 1 30 30 LYS CA C 13 59.926 0.000 . . . . . . 30 LYS CA . 6724 1 301 . 1 1 30 30 LYS CB C 13 31.992 0.000 . . . . . . 30 LYS CB . 6724 1 302 . 1 1 30 30 LYS CG C 13 25.816 0.000 . . . . . . 30 LYS CG . 6724 1 303 . 1 1 30 30 LYS CD C 13 29.606 0.000 . . . . . . 30 LYS CD . 6724 1 304 . 1 1 30 30 LYS CE C 13 41.346 0.000 . . . . . . 30 LYS CE . 6724 1 305 . 1 1 30 30 LYS N N 15 117.985 0.000 . . . . . . 30 LYS N . 6724 1 306 . 1 1 31 31 THR H H 1 7.954 0.000 . . . . . . 31 THR HN . 6724 1 307 . 1 1 31 31 THR HA H 1 3.835 0.000 . . . . . . 31 THR HA . 6724 1 308 . 1 1 31 31 THR HB H 1 3.567 0.000 . . . . . . 31 THR HB . 6724 1 309 . 1 1 31 31 THR HG21 H 1 0.967 0.000 . . . . . . 31 THR QG2 . 6724 1 310 . 1 1 31 31 THR HG22 H 1 0.967 0.000 . . . . . . 31 THR QG2 . 6724 1 311 . 1 1 31 31 THR HG23 H 1 0.967 0.000 . . . . . . 31 THR QG2 . 6724 1 312 . 1 1 31 31 THR CA C 13 66.254 0.000 . . . . . . 31 THR CA . 6724 1 313 . 1 1 31 31 THR CB C 13 68.299 0.000 . . . . . . 31 THR CB . 6724 1 314 . 1 1 31 31 THR CG2 C 13 21.256 0.000 . . . . . . 31 THR CG2 . 6724 1 315 . 1 1 31 31 THR N N 15 114.195 0.000 . . . . . . 31 THR N . 6724 1 316 . 1 1 32 32 ALA H H 1 7.300 0.000 . . . . . . 32 ALA HN . 6724 1 317 . 1 1 32 32 ALA HA H 1 3.812 0.000 . . . . . . 32 ALA HA . 6724 1 318 . 1 1 32 32 ALA HB1 H 1 0.792 0.000 . . . . . . 32 ALA QB . 6724 1 319 . 1 1 32 32 ALA HB2 H 1 0.792 0.000 . . . . . . 32 ALA QB . 6724 1 320 . 1 1 32 32 ALA HB3 H 1 0.792 0.000 . . . . . . 32 ALA QB . 6724 1 321 . 1 1 32 32 ALA CA C 13 54.841 0.000 . . . . . . 32 ALA CA . 6724 1 322 . 1 1 32 32 ALA CB C 13 17.706 0.000 . . . . . . 32 ALA CB . 6724 1 323 . 1 1 32 32 ALA N N 15 125.331 0.000 . . . . . . 32 ALA N . 6724 1 324 . 1 1 33 33 ALA H H 1 8.048 0.000 . . . . . . 33 ALA HN . 6724 1 325 . 1 1 33 33 ALA HA H 1 3.871 0.000 . . . . . . 33 ALA HA . 6724 1 326 . 1 1 33 33 ALA HB1 H 1 1.350 0.000 . . . . . . 33 ALA QB . 6724 1 327 . 1 1 33 33 ALA HB2 H 1 1.350 0.000 . . . . . . 33 ALA QB . 6724 1 328 . 1 1 33 33 ALA HB3 H 1 1.350 0.000 . . . . . . 33 ALA QB . 6724 1 329 . 1 1 33 33 ALA CA C 13 54.172 0.000 . . . . . . 33 ALA CA . 6724 1 330 . 1 1 33 33 ALA CB C 13 19.434 0.000 . . . . . . 33 ALA CB . 6724 1 331 . 1 1 33 33 ALA N N 15 116.175 0.000 . . . . . . 33 ALA N . 6724 1 332 . 1 1 34 34 LYS H H 1 7.418 0.000 . . . . . . 34 LYS HN . 6724 1 333 . 1 1 34 34 LYS HA H 1 4.118 0.000 . . . . . . 34 LYS HA . 6724 1 334 . 1 1 34 34 LYS HB2 H 1 1.863 0.000 . . . . . . 34 LYS QB . 6724 1 335 . 1 1 34 34 LYS HB3 H 1 1.863 0.000 . . . . . . 34 LYS QB . 6724 1 336 . 1 1 34 34 LYS HG2 H 1 1.469 0.000 . . . . . . 34 LYS QG . 6724 1 337 . 1 1 34 34 LYS HG3 H 1 1.469 0.000 . . . . . . 34 LYS QG . 6724 1 338 . 1 1 34 34 LYS HD2 H 1 1.572 0.000 . . . . . . 34 LYS QD . 6724 1 339 . 1 1 34 34 LYS HD3 H 1 1.572 0.000 . . . . . . 34 LYS QD . 6724 1 340 . 1 1 34 34 LYS HE2 H 1 2.844 0.000 . . . . . . 34 LYS QE . 6724 1 341 . 1 1 34 34 LYS HE3 H 1 2.844 0.000 . . . . . . 34 LYS QE . 6724 1 342 . 1 1 34 34 LYS CA C 13 58.956 0.000 . . . . . . 34 LYS CA . 6724 1 343 . 1 1 34 34 LYS CB C 13 33.187 0.000 . . . . . . 34 LYS CB . 6724 1 344 . 1 1 34 34 LYS CG C 13 24.948 0.000 . . . . . . 34 LYS CG . 6724 1 345 . 1 1 34 34 LYS CD C 13 29.368 0.000 . . . . . . 34 LYS CD . 6724 1 346 . 1 1 34 34 LYS CE C 13 41.936 0.000 . . . . . . 34 LYS CE . 6724 1 347 . 1 1 34 34 LYS N N 15 115.365 0.000 . . . . . . 34 LYS N . 6724 1 348 . 1 1 35 35 THR H H 1 7.295 0.000 . . . . . . 35 THR HN . 6724 1 349 . 1 1 35 35 THR HA H 1 4.397 0.000 . . . . . . 35 THR HA . 6724 1 350 . 1 1 35 35 THR HG21 H 1 1.127 0.000 . . . . . . 35 THR QG2 . 6724 1 351 . 1 1 35 35 THR HG22 H 1 1.127 0.000 . . . . . . 35 THR QG2 . 6724 1 352 . 1 1 35 35 THR HG23 H 1 1.127 0.000 . . . . . . 35 THR QG2 . 6724 1 353 . 1 1 35 35 THR CA C 13 61.798 0.000 . . . . . . 35 THR CA . 6724 1 354 . 1 1 35 35 THR CB C 13 70.531 0.000 . . . . . . 35 THR CB . 6724 1 355 . 1 1 35 35 THR CG2 C 13 21.709 0.000 . . . . . . 35 THR CG2 . 6724 1 356 . 1 1 35 35 THR N N 15 106.107 0.000 . . . . . . 35 THR N . 6724 1 357 . 1 1 36 36 LEU H H 1 7.440 0.000 . . . . . . 36 LEU HN . 6724 1 358 . 1 1 36 36 LEU HA H 1 4.393 0.000 . . . . . . 36 LEU HA . 6724 1 359 . 1 1 36 36 LEU HB2 H 1 1.340 0.000 . . . . . . 36 LEU HB2 . 6724 1 360 . 1 1 36 36 LEU HB3 H 1 1.738 0.000 . . . . . . 36 LEU HB3 . 6724 1 361 . 1 1 36 36 LEU HD21 H 1 0.809 0.000 . . . . . . 36 LEU QD2 . 6724 1 362 . 1 1 36 36 LEU HD22 H 1 0.809 0.000 . . . . . . 36 LEU QD2 . 6724 1 363 . 1 1 36 36 LEU HD23 H 1 0.809 0.000 . . . . . . 36 LEU QD2 . 6724 1 364 . 1 1 36 36 LEU CA C 13 54.913 0.000 . . . . . . 36 LEU CA . 6724 1 365 . 1 1 36 36 LEU CB C 13 43.738 0.000 . . . . . . 36 LEU CB . 6724 1 366 . 1 1 36 36 LEU CG C 13 26.756 0.000 . . . . . . 36 LEU CG . 6724 1 367 . 1 1 36 36 LEU CD2 C 13 23.127 0.000 . . . . . . 36 LEU CD2 . 6724 1 368 . 1 1 36 36 LEU N N 15 121.433 0.000 . . . . . . 36 LEU N . 6724 1 369 . 1 1 37 37 LYS H H 1 8.900 0.000 . . . . . . 37 LYS HN . 6724 1 370 . 1 1 37 37 LYS CA C 13 52.807 0.000 . . . . . . 37 LYS CA . 6724 1 371 . 1 1 37 37 LYS CB C 13 32.715 0.000 . . . . . . 37 LYS CB . 6724 1 372 . 1 1 37 37 LYS N N 15 123.356 0.000 . . . . . . 37 LYS N . 6724 1 373 . 1 1 38 38 PRO HA H 1 4.683 0.000 . . . . . . 38 PRO HA . 6724 1 374 . 1 1 38 38 PRO HB2 H 1 1.657 0.000 . . . . . . 38 PRO HB2 . 6724 1 375 . 1 1 38 38 PRO HB3 H 1 2.216 0.000 . . . . . . 38 PRO HB3 . 6724 1 376 . 1 1 38 38 PRO HG2 H 1 2.056 0.000 . . . . . . 38 PRO QG . 6724 1 377 . 1 1 38 38 PRO HG3 H 1 2.056 0.000 . . . . . . 38 PRO QG . 6724 1 378 . 1 1 38 38 PRO HD2 H 1 3.329 0.000 . . . . . . 38 PRO HD2 . 6724 1 379 . 1 1 38 38 PRO HD3 H 1 3.542 0.000 . . . . . . 38 PRO HD3 . 6724 1 380 . 1 1 38 38 PRO CA C 13 62.506 0.000 . . . . . . 38 PRO CA . 6724 1 381 . 1 1 38 38 PRO CB C 13 33.189 0.000 . . . . . . 38 PRO CB . 6724 1 382 . 1 1 38 38 PRO CG C 13 27.277 0.000 . . . . . . 38 PRO CG . 6724 1 383 . 1 1 38 38 PRO CD C 13 51.195 0.000 . . . . . . 38 PRO CD . 6724 1 384 . 1 1 39 39 THR H H 1 8.781 0.000 . . . . . . 39 THR HN . 6724 1 385 . 1 1 39 39 THR HA H 1 5.210 0.000 . . . . . . 39 THR HA . 6724 1 386 . 1 1 39 39 THR HG21 H 1 1.119 0.000 . . . . . . 39 THR QG2 . 6724 1 387 . 1 1 39 39 THR HG22 H 1 1.119 0.000 . . . . . . 39 THR QG2 . 6724 1 388 . 1 1 39 39 THR HG23 H 1 1.119 0.000 . . . . . . 39 THR QG2 . 6724 1 389 . 1 1 39 39 THR CA C 13 61.570 0.000 . . . . . . 39 THR CA . 6724 1 390 . 1 1 39 39 THR CB C 13 70.873 0.000 . . . . . . 39 THR CB . 6724 1 391 . 1 1 39 39 THR CG2 C 13 21.689 0.000 . . . . . . 39 THR CG2 . 6724 1 392 . 1 1 39 39 THR N N 15 115.217 0.000 . . . . . . 39 THR N . 6724 1 393 . 1 1 40 40 PHE H H 1 9.745 0.000 . . . . . . 40 PHE HN . 6724 1 394 . 1 1 40 40 PHE HA H 1 5.608 0.000 . . . . . . 40 PHE HA . 6724 1 395 . 1 1 40 40 PHE HB2 H 1 2.073 0.000 . . . . . . 40 PHE HB2 . 6724 1 396 . 1 1 40 40 PHE HB3 H 1 2.368 0.000 . . . . . . 40 PHE HB3 . 6724 1 397 . 1 1 40 40 PHE CA C 13 54.580 0.000 . . . . . . 40 PHE CA . 6724 1 398 . 1 1 40 40 PHE CB C 13 42.029 0.000 . . . . . . 40 PHE CB . 6724 1 399 . 1 1 40 40 PHE N N 15 128.918 0.000 . . . . . . 40 PHE N . 6724 1 400 . 1 1 41 41 GLU H H 1 9.028 0.000 . . . . . . 41 GLU HN . 6724 1 401 . 1 1 41 41 GLU HA H 1 5.313 0.000 . . . . . . 41 GLU HA . 6724 1 402 . 1 1 41 41 GLU CA C 13 53.345 0.000 . . . . . . 41 GLU CA . 6724 1 403 . 1 1 41 41 GLU CB C 13 33.746 0.000 . . . . . . 41 GLU CB . 6724 1 404 . 1 1 41 41 GLU CG C 13 36.104 0.000 . . . . . . 41 GLU CG . 6724 1 405 . 1 1 41 41 GLU N N 15 128.076 0.000 . . . . . . 41 GLU N . 6724 1 406 . 1 1 42 42 VAL H H 1 8.613 0.000 . . . . . . 42 VAL HN . 6724 1 407 . 1 1 42 42 VAL HA H 1 5.083 0.000 . . . . . . 42 VAL HA . 6724 1 408 . 1 1 42 42 VAL HB H 1 2.057 0.000 . . . . . . 42 VAL HB . 6724 1 409 . 1 1 42 42 VAL HG21 H 1 0.464 0.000 . . . . . . 42 VAL QG2 . 6724 1 410 . 1 1 42 42 VAL HG22 H 1 0.464 0.000 . . . . . . 42 VAL QG2 . 6724 1 411 . 1 1 42 42 VAL HG23 H 1 0.464 0.000 . . . . . . 42 VAL QG2 . 6724 1 412 . 1 1 42 42 VAL CA C 13 60.371 0.000 . . . . . . 42 VAL CA . 6724 1 413 . 1 1 42 42 VAL CB C 13 34.148 0.000 . . . . . . 42 VAL CB . 6724 1 414 . 1 1 42 42 VAL CG1 C 13 21.144 0.000 . . . . . . 42 VAL CG1 . 6724 1 415 . 1 1 42 42 VAL CG2 C 13 22.498 0.000 . . . . . . 42 VAL CG2 . 6724 1 416 . 1 1 42 42 VAL N N 15 122.762 0.000 . . . . . . 42 VAL N . 6724 1 417 . 1 1 43 43 ALA H H 1 9.204 0.000 . . . . . . 43 ALA HN . 6724 1 418 . 1 1 43 43 ALA HA H 1 4.789 0.000 . . . . . . 43 ALA HA . 6724 1 419 . 1 1 43 43 ALA HB1 H 1 1.203 0.000 . . . . . . 43 ALA QB . 6724 1 420 . 1 1 43 43 ALA HB2 H 1 1.203 0.000 . . . . . . 43 ALA QB . 6724 1 421 . 1 1 43 43 ALA HB3 H 1 1.203 0.000 . . . . . . 43 ALA QB . 6724 1 422 . 1 1 43 43 ALA CA C 13 50.503 0.000 . . . . . . 43 ALA CA . 6724 1 423 . 1 1 43 43 ALA CB C 13 22.721 0.000 . . . . . . 43 ALA CB . 6724 1 424 . 1 1 43 43 ALA N N 15 131.235 0.000 . . . . . . 43 ALA N . 6724 1 425 . 1 1 44 44 ILE H H 1 8.105 0.000 . . . . . . 44 ILE HN . 6724 1 426 . 1 1 44 44 ILE HA H 1 4.234 0.000 . . . . . . 44 ILE HA . 6724 1 427 . 1 1 44 44 ILE HB H 1 1.234 0.000 . . . . . . 44 ILE HB . 6724 1 428 . 1 1 44 44 ILE HG12 H 1 0.384 0.000 . . . . . . 44 ILE QG1 . 6724 1 429 . 1 1 44 44 ILE HG13 H 1 0.384 0.000 . . . . . . 44 ILE QG1 . 6724 1 430 . 1 1 44 44 ILE HG21 H 1 0.225 0.000 . . . . . . 44 ILE QG2 . 6724 1 431 . 1 1 44 44 ILE HG22 H 1 0.225 0.000 . . . . . . 44 ILE QG2 . 6724 1 432 . 1 1 44 44 ILE HG23 H 1 0.225 0.000 . . . . . . 44 ILE QG2 . 6724 1 433 . 1 1 44 44 ILE HD11 H 1 0.543 0.000 . . . . . . 44 ILE QD1 . 6724 1 434 . 1 1 44 44 ILE HD12 H 1 0.543 0.000 . . . . . . 44 ILE QD1 . 6724 1 435 . 1 1 44 44 ILE HD13 H 1 0.543 0.000 . . . . . . 44 ILE QD1 . 6724 1 436 . 1 1 44 44 ILE CA C 13 60.446 0.000 . . . . . . 44 ILE CA . 6724 1 437 . 1 1 44 44 ILE CB C 13 40.505 0.000 . . . . . . 44 ILE CB . 6724 1 438 . 1 1 44 44 ILE CG1 C 13 27.502 0.000 . . . . . . 44 ILE CG1 . 6724 1 439 . 1 1 44 44 ILE CG2 C 13 16.728 0.000 . . . . . . 44 ILE CG2 . 6724 1 440 . 1 1 44 44 ILE CD1 C 13 13.847 0.000 . . . . . . 44 ILE CD1 . 6724 1 441 . 1 1 44 44 ILE N N 15 119.225 0.000 . . . . . . 44 ILE N . 6724 1 442 . 1 1 45 45 GLU H H 1 8.478 0.000 . . . . . . 45 GLU HN . 6724 1 443 . 1 1 45 45 GLU HA H 1 4.340 0.000 . . . . . . 45 GLU HA . 6724 1 444 . 1 1 45 45 GLU HB2 H 1 1.552 0.000 . . . . . . 45 GLU HB2 . 6724 1 445 . 1 1 45 45 GLU HB3 H 1 1.711 0.000 . . . . . . 45 GLU HB3 . 6724 1 446 . 1 1 45 45 GLU HG2 H 1 1.366 0.000 . . . . . . 45 GLU HG2 . 6724 1 447 . 1 1 45 45 GLU HG3 H 1 1.977 0.000 . . . . . . 45 GLU HG3 . 6724 1 448 . 1 1 45 45 GLU CA C 13 54.430 0.000 . . . . . . 45 GLU CA . 6724 1 449 . 1 1 45 45 GLU CB C 13 31.039 0.000 . . . . . . 45 GLU CB . 6724 1 450 . 1 1 45 45 GLU CG C 13 34.561 0.000 . . . . . . 45 GLU CG . 6724 1 451 . 1 1 45 45 GLU N N 15 127.090 0.000 . . . . . . 45 GLU N . 6724 1 452 . 1 1 46 46 ASN H H 1 9.212 0.000 . . . . . . 46 ASN HN . 6724 1 453 . 1 1 46 46 ASN HA H 1 3.995 0.000 . . . . . . 46 ASN HA . 6724 1 454 . 1 1 46 46 ASN HB2 H 1 2.827 0.000 . . . . . . 46 ASN HB2 . 6724 1 455 . 1 1 46 46 ASN HB3 H 1 2.827 0.000 . . . . . . 46 ASN HB3 . 6724 1 456 . 1 1 46 46 ASN CA C 13 55.244 0.000 . . . . . . 46 ASN CA . 6724 1 457 . 1 1 46 46 ASN CB C 13 36.735 0.000 . . . . . . 46 ASN CB . 6724 1 458 . 1 1 46 46 ASN N N 15 124.109 0.000 . . . . . . 46 ASN N . 6724 1 459 . 1 1 47 47 ASP H H 1 8.408 0.000 . . . . . . 47 ASP HN . 6724 1 460 . 1 1 47 47 ASP HA H 1 4.260 0.000 . . . . . . 47 ASP HA . 6724 1 461 . 1 1 47 47 ASP HB2 H 1 2.641 0.000 . . . . . . 47 ASP HB2 . 6724 1 462 . 1 1 47 47 ASP HB3 H 1 2.800 0.000 . . . . . . 47 ASP HB3 . 6724 1 463 . 1 1 47 47 ASP CA C 13 53.904 0.000 . . . . . . 47 ASP CA . 6724 1 464 . 1 1 47 47 ASP CB C 13 39.468 0.000 . . . . . . 47 ASP CB . 6724 1 465 . 1 1 47 47 ASP N N 15 117.872 0.000 . . . . . . 47 ASP N . 6724 1 466 . 1 1 48 48 GLN H H 1 7.810 0.000 . . . . . . 48 GLN HN . 6724 1 467 . 1 1 48 48 GLN HA H 1 4.426 0.000 . . . . . . 48 GLN HA . 6724 1 468 . 1 1 48 48 GLN HB2 H 1 1.738 0.000 . . . . . . 48 GLN QB . 6724 1 469 . 1 1 48 48 GLN HB3 H 1 1.738 0.000 . . . . . . 48 GLN QB . 6724 1 470 . 1 1 48 48 GLN HG2 H 1 2.030 0.000 . . . . . . 48 GLN QG . 6724 1 471 . 1 1 48 48 GLN HG3 H 1 2.030 0.000 . . . . . . 48 GLN QG . 6724 1 472 . 1 1 48 48 GLN CA C 13 54.434 0.000 . . . . . . 48 GLN CA . 6724 1 473 . 1 1 48 48 GLN CB C 13 31.325 0.000 . . . . . . 48 GLN CB . 6724 1 474 . 1 1 48 48 GLN CG C 13 34.929 0.000 . . . . . . 48 GLN CG . 6724 1 475 . 1 1 48 48 GLN N N 15 118.011 0.000 . . . . . . 48 GLN N . 6724 1 476 . 1 1 49 49 TYR H H 1 8.385 0.000 . . . . . . 49 TYR HN . 6724 1 477 . 1 1 49 49 TYR HA H 1 4.105 0.000 . . . . . . 49 TYR HA . 6724 1 478 . 1 1 49 49 TYR HB2 H 1 0.894 0.000 . . . . . . 49 TYR HB2 . 6724 1 479 . 1 1 49 49 TYR HB3 H 1 1.502 0.000 . . . . . . 49 TYR HB3 . 6724 1 480 . 1 1 49 49 TYR CA C 13 57.145 0.000 . . . . . . 49 TYR CA . 6724 1 481 . 1 1 49 49 TYR CB C 13 41.960 0.000 . . . . . . 49 TYR CB . 6724 1 482 . 1 1 49 49 TYR N N 15 122.643 0.000 . . . . . . 49 TYR N . 6724 1 483 . 1 1 50 50 ILE H H 1 8.509 0.000 . . . . . . 50 ILE HN . 6724 1 484 . 1 1 50 50 ILE HB H 1 1.526 0.000 . . . . . . 50 ILE HB . 6724 1 485 . 1 1 50 50 ILE HG12 H 1 1.154 0.000 . . . . . . 50 ILE QG1 . 6724 1 486 . 1 1 50 50 ILE HG13 H 1 1.154 0.000 . . . . . . 50 ILE QG1 . 6724 1 487 . 1 1 50 50 ILE HG21 H 1 0.623 0.000 . . . . . . 50 ILE QG2 . 6724 1 488 . 1 1 50 50 ILE HG22 H 1 0.623 0.000 . . . . . . 50 ILE QG2 . 6724 1 489 . 1 1 50 50 ILE HG23 H 1 0.623 0.000 . . . . . . 50 ILE QG2 . 6724 1 490 . 1 1 50 50 ILE HD11 H 1 0.517 0.000 . . . . . . 50 ILE QD1 . 6724 1 491 . 1 1 50 50 ILE HD12 H 1 0.517 0.000 . . . . . . 50 ILE QD1 . 6724 1 492 . 1 1 50 50 ILE HD13 H 1 0.517 0.000 . . . . . . 50 ILE QD1 . 6724 1 493 . 1 1 50 50 ILE CA C 13 60.282 0.000 . . . . . . 50 ILE CA . 6724 1 494 . 1 1 50 50 ILE CB C 13 40.837 0.000 . . . . . . 50 ILE CB . 6724 1 495 . 1 1 50 50 ILE CG1 C 13 27.850 0.000 . . . . . . 50 ILE CG1 . 6724 1 496 . 1 1 50 50 ILE CG2 C 13 18.437 0.000 . . . . . . 50 ILE CG2 . 6724 1 497 . 1 1 50 50 ILE CD1 C 13 14.077 0.000 . . . . . . 50 ILE CD1 . 6724 1 498 . 1 1 50 50 ILE N N 15 117.382 0.000 . . . . . . 50 ILE N . 6724 1 499 . 1 1 51 51 PHE H H 1 9.067 0.000 . . . . . . 51 PHE HN . 6724 1 500 . 1 1 51 51 PHE HA H 1 5.704 0.000 . . . . . . 51 PHE HA . 6724 1 501 . 1 1 51 51 PHE HB2 H 1 3.417 0.000 . . . . . . 51 PHE QB . 6724 1 502 . 1 1 51 51 PHE HB3 H 1 3.417 0.000 . . . . . . 51 PHE QB . 6724 1 503 . 1 1 51 51 PHE CA C 13 51.865 0.000 . . . . . . 51 PHE CA . 6724 1 504 . 1 1 51 51 PHE CB C 13 40.544 0.000 . . . . . . 51 PHE CB . 6724 1 505 . 1 1 51 51 PHE N N 15 124.372 0.000 . . . . . . 51 PHE N . 6724 1 506 . 1 1 52 52 ARG H H 1 9.491 0.000 . . . . . . 52 ARG HN . 6724 1 507 . 1 1 52 52 ARG HA H 1 5.226 0.000 . . . . . . 52 ARG HA . 6724 1 508 . 1 1 52 52 ARG HB2 H 1 1.636 0.000 . . . . . . 52 ARG HB2 . 6724 1 509 . 1 1 52 52 ARG HB3 H 1 1.795 0.000 . . . . . . 52 ARG HB3 . 6724 1 510 . 1 1 52 52 ARG HG2 H 1 1.529 0.000 . . . . . . 52 ARG QG . 6724 1 511 . 1 1 52 52 ARG HG3 H 1 1.529 0.000 . . . . . . 52 ARG QG . 6724 1 512 . 1 1 52 52 ARG HD2 H 1 3.046 0.000 . . . . . . 52 ARG HD2 . 6724 1 513 . 1 1 52 52 ARG HD3 H 1 3.177 0.000 . . . . . . 52 ARG HD3 . 6724 1 514 . 1 1 52 52 ARG CA C 13 54.667 0.000 . . . . . . 52 ARG CA . 6724 1 515 . 1 1 52 52 ARG CB C 13 34.006 0.000 . . . . . . 52 ARG CB . 6724 1 516 . 1 1 52 52 ARG CG C 13 28.641 0.000 . . . . . . 52 ARG CG . 6724 1 517 . 1 1 52 52 ARG CD C 13 43.367 0.000 . . . . . . 52 ARG CD . 6724 1 518 . 1 1 52 52 ARG N N 15 123.507 0.000 . . . . . . 52 ARG N . 6724 1 519 . 1 1 53 53 SER H H 1 8.124 0.000 . . . . . . 53 SER HN . 6724 1 520 . 1 1 53 53 SER HA H 1 5.375 0.000 . . . . . . 53 SER HA . 6724 1 521 . 1 1 53 53 SER HB2 H 1 3.650 0.000 . . . . . . 53 SER HB2 . 6724 1 522 . 1 1 53 53 SER HB3 H 1 3.995 0.000 . . . . . . 53 SER HB3 . 6724 1 523 . 1 1 53 53 SER CA C 13 56.977 0.000 . . . . . . 53 SER CA . 6724 1 524 . 1 1 53 53 SER CB C 13 63.837 0.000 . . . . . . 53 SER CB . 6724 1 525 . 1 1 53 53 SER N N 15 116.535 0.000 . . . . . . 53 SER N . 6724 1 526 . 1 1 54 54 LEU H H 1 9.386 0.000 . . . . . . 54 LEU HN . 6724 1 527 . 1 1 54 54 LEU HA H 1 5.407 0.000 . . . . . . 54 LEU HA . 6724 1 528 . 1 1 54 54 LEU HB2 H 1 1.472 0.000 . . . . . . 54 LEU HB2 . 6724 1 529 . 1 1 54 54 LEU HB3 H 1 1.788 0.000 . . . . . . 54 LEU HB3 . 6724 1 530 . 1 1 54 54 LEU HD21 H 1 0.754 0.000 . . . . . . 54 LEU QD2 . 6724 1 531 . 1 1 54 54 LEU HD22 H 1 0.754 0.000 . . . . . . 54 LEU QD2 . 6724 1 532 . 1 1 54 54 LEU HD23 H 1 0.754 0.000 . . . . . . 54 LEU QD2 . 6724 1 533 . 1 1 54 54 LEU CA C 13 53.500 0.000 . . . . . . 54 LEU CA . 6724 1 534 . 1 1 54 54 LEU CB C 13 43.013 0.000 . . . . . . 54 LEU CB . 6724 1 535 . 1 1 54 54 LEU CG C 13 27.188 0.000 . . . . . . 54 LEU CG . 6724 1 536 . 1 1 54 54 LEU CD1 C 13 25.371 0.000 . . . . . . 54 LEU CD1 . 6724 1 537 . 1 1 54 54 LEU CD2 C 13 24.033 0.000 . . . . . . 54 LEU CD2 . 6724 1 538 . 1 1 54 54 LEU N N 15 127.490 0.000 . . . . . . 54 LEU N . 6724 1 539 . 1 1 55 55 SER H H 1 8.476 0.000 . . . . . . 55 SER HN . 6724 1 540 . 1 1 55 55 SER HA H 1 4.795 0.000 . . . . . . 55 SER HA . 6724 1 541 . 1 1 55 55 SER HB2 H 1 4.100 0.000 . . . . . . 55 SER QB . 6724 1 542 . 1 1 55 55 SER HB3 H 1 4.100 0.000 . . . . . . 55 SER QB . 6724 1 543 . 1 1 55 55 SER CA C 13 58.340 0.000 . . . . . . 55 SER CA . 6724 1 544 . 1 1 55 55 SER CB C 13 66.796 0.000 . . . . . . 55 SER CB . 6724 1 545 . 1 1 55 55 SER N N 15 116.492 0.000 . . . . . . 55 SER N . 6724 1 546 . 1 1 56 56 THR H H 1 8.366 0.000 . . . . . . 56 THR HN . 6724 1 547 . 1 1 56 56 THR HA H 1 4.287 0.000 . . . . . . 56 THR HA . 6724 1 548 . 1 1 56 56 THR HB H 1 3.995 0.000 . . . . . . 56 THR HB . 6724 1 549 . 1 1 56 56 THR HG21 H 1 1.234 0.000 . . . . . . 56 THR QG2 . 6724 1 550 . 1 1 56 56 THR HG22 H 1 1.234 0.000 . . . . . . 56 THR QG2 . 6724 1 551 . 1 1 56 56 THR HG23 H 1 1.234 0.000 . . . . . . 56 THR QG2 . 6724 1 552 . 1 1 56 56 THR CA C 13 63.388 0.000 . . . . . . 56 THR CA . 6724 1 553 . 1 1 56 56 THR CB C 13 68.383 0.000 . . . . . . 56 THR CB . 6724 1 554 . 1 1 56 56 THR CG2 C 13 22.215 0.000 . . . . . . 56 THR CG2 . 6724 1 555 . 1 1 56 56 THR N N 15 108.740 0.000 . . . . . . 56 THR N . 6724 1 556 . 1 1 57 57 PHE H H 1 7.243 0.000 . . . . . . 57 PHE HN . 6724 1 557 . 1 1 57 57 PHE HA H 1 4.424 0.000 . . . . . . 57 PHE HA . 6724 1 558 . 1 1 57 57 PHE HB2 H 1 2.594 0.000 . . . . . . 57 PHE HB2 . 6724 1 559 . 1 1 57 57 PHE HB3 H 1 3.151 0.000 . . . . . . 57 PHE HB3 . 6724 1 560 . 1 1 57 57 PHE CA C 13 59.239 0.000 . . . . . . 57 PHE CA . 6724 1 561 . 1 1 57 57 PHE CB C 13 40.979 0.000 . . . . . . 57 PHE CB . 6724 1 562 . 1 1 57 57 PHE N N 15 120.428 0.000 . . . . . . 57 PHE N . 6724 1 563 . 1 1 58 58 LYS H H 1 6.882 0.000 . . . . . . 58 LYS HN . 6724 1 564 . 1 1 58 58 LYS HA H 1 3.995 0.000 . . . . . . 58 LYS HA . 6724 1 565 . 1 1 58 58 LYS HG2 H 1 1.021 0.000 . . . . . . 58 LYS QG . 6724 1 566 . 1 1 58 58 LYS HG3 H 1 1.021 0.000 . . . . . . 58 LYS QG . 6724 1 567 . 1 1 58 58 LYS HE2 H 1 2.667 0.000 . . . . . . 58 LYS QE . 6724 1 568 . 1 1 58 58 LYS HE3 H 1 2.667 0.000 . . . . . . 58 LYS QE . 6724 1 569 . 1 1 58 58 LYS CA C 13 56.220 0.000 . . . . . . 58 LYS CA . 6724 1 570 . 1 1 58 58 LYS CB C 13 35.829 0.000 . . . . . . 58 LYS CB . 6724 1 571 . 1 1 58 58 LYS CG C 13 24.329 0.000 . . . . . . 58 LYS CG . 6724 1 572 . 1 1 58 58 LYS CD C 13 28.677 0.000 . . . . . . 58 LYS CD . 6724 1 573 . 1 1 58 58 LYS CE C 13 41.804 0.000 . . . . . . 58 LYS CE . 6724 1 574 . 1 1 58 58 LYS N N 15 116.541 0.000 . . . . . . 58 LYS N . 6724 1 575 . 1 1 59 59 ASN H H 1 8.545 0.000 . . . . . . 59 ASN HN . 6724 1 576 . 1 1 59 59 ASN HA H 1 5.985 0.000 . . . . . . 59 ASN HA . 6724 1 577 . 1 1 59 59 ASN HB2 H 1 2.718 0.000 . . . . . . 59 ASN QB . 6724 1 578 . 1 1 59 59 ASN HB3 H 1 2.718 0.000 . . . . . . 59 ASN QB . 6724 1 579 . 1 1 59 59 ASN CA C 13 51.452 0.000 . . . . . . 59 ASN CA . 6724 1 580 . 1 1 59 59 ASN CB C 13 39.117 0.000 . . . . . . 59 ASN CB . 6724 1 581 . 1 1 59 59 ASN N N 15 124.409 0.000 . . . . . . 59 ASN N . 6724 1 582 . 1 1 60 60 THR H H 1 9.447 0.000 . . . . . . 60 THR HN . 6724 1 583 . 1 1 60 60 THR HA H 1 4.823 0.000 . . . . . . 60 THR HA . 6724 1 584 . 1 1 60 60 THR HG21 H 1 1.054 0.000 . . . . . . 60 THR QG2 . 6724 1 585 . 1 1 60 60 THR HG22 H 1 1.054 0.000 . . . . . . 60 THR QG2 . 6724 1 586 . 1 1 60 60 THR HG23 H 1 1.054 0.000 . . . . . . 60 THR QG2 . 6724 1 587 . 1 1 60 60 THR CA C 13 60.012 0.000 . . . . . . 60 THR CA . 6724 1 588 . 1 1 60 60 THR CB C 13 71.418 0.000 . . . . . . 60 THR CB . 6724 1 589 . 1 1 60 60 THR CG2 C 13 21.287 0.000 . . . . . . 60 THR CG2 . 6724 1 590 . 1 1 60 60 THR N N 15 114.400 0.000 . . . . . . 60 THR N . 6724 1 591 . 1 1 61 61 GLU H H 1 8.831 0.000 . . . . . . 61 GLU HN . 6724 1 592 . 1 1 61 61 GLU HA H 1 4.921 0.000 . . . . . . 61 GLU HA . 6724 1 593 . 1 1 61 61 GLU HB2 H 1 1.924 0.000 . . . . . . 61 GLU QB . 6724 1 594 . 1 1 61 61 GLU HB3 H 1 1.924 0.000 . . . . . . 61 GLU QB . 6724 1 595 . 1 1 61 61 GLU CA C 13 56.365 0.000 . . . . . . 61 GLU CA . 6724 1 596 . 1 1 61 61 GLU CB C 13 33.626 0.000 . . . . . . 61 GLU CB . 6724 1 597 . 1 1 61 61 GLU CG C 13 37.246 0.000 . . . . . . 61 GLU CG . 6724 1 598 . 1 1 61 61 GLU N N 15 121.034 0.000 . . . . . . 61 GLU N . 6724 1 599 . 1 1 62 62 ALA H H 1 8.951 0.000 . . . . . . 62 ALA HN . 6724 1 600 . 1 1 62 62 ALA HA H 1 4.907 0.000 . . . . . . 62 ALA HA . 6724 1 601 . 1 1 62 62 ALA HB1 H 1 1.534 0.000 . . . . . . 62 ALA QB . 6724 1 602 . 1 1 62 62 ALA HB2 H 1 1.534 0.000 . . . . . . 62 ALA QB . 6724 1 603 . 1 1 62 62 ALA HB3 H 1 1.534 0.000 . . . . . . 62 ALA QB . 6724 1 604 . 1 1 62 62 ALA CA C 13 50.949 0.000 . . . . . . 62 ALA CA . 6724 1 605 . 1 1 62 62 ALA CB C 13 20.602 0.000 . . . . . . 62 ALA CB . 6724 1 606 . 1 1 62 62 ALA N N 15 129.051 0.000 . . . . . . 62 ALA N . 6724 1 607 . 1 1 63 63 LYS H H 1 8.216 0.000 . . . . . . 63 LYS HN . 6724 1 608 . 1 1 63 63 LYS HA H 1 5.234 0.000 . . . . . . 63 LYS HA . 6724 1 609 . 1 1 63 63 LYS CA C 13 54.545 0.000 . . . . . . 63 LYS CA . 6724 1 610 . 1 1 63 63 LYS CB C 13 33.961 0.000 . . . . . . 63 LYS CB . 6724 1 611 . 1 1 63 63 LYS CG C 13 24.830 0.000 . . . . . . 63 LYS CG . 6724 1 612 . 1 1 63 63 LYS CD C 13 29.246 0.000 . . . . . . 63 LYS CD . 6724 1 613 . 1 1 63 63 LYS CE C 13 41.694 0.000 . . . . . . 63 LYS CE . 6724 1 614 . 1 1 63 63 LYS N N 15 124.308 0.000 . . . . . . 63 LYS N . 6724 1 615 . 1 1 64 64 PHE H H 1 8.448 0.000 . . . . . . 64 PHE HN . 6724 1 616 . 1 1 64 64 PHE HA H 1 4.607 0.000 . . . . . . 64 PHE HA . 6724 1 617 . 1 1 64 64 PHE HB2 H 1 1.290 0.000 . . . . . . 64 PHE HB2 . 6724 1 618 . 1 1 64 64 PHE HB3 H 1 2.432 0.000 . . . . . . 64 PHE HB3 . 6724 1 619 . 1 1 64 64 PHE CA C 13 55.688 0.000 . . . . . . 64 PHE CA . 6724 1 620 . 1 1 64 64 PHE CB C 13 41.790 0.000 . . . . . . 64 PHE CB . 6724 1 621 . 1 1 64 64 PHE N N 15 120.738 0.000 . . . . . . 64 PHE N . 6724 1 622 . 1 1 65 65 LYS H H 1 8.618 0.000 . . . . . . 65 LYS HN . 6724 1 623 . 1 1 65 65 LYS HA H 1 4.707 0.000 . . . . . . 65 LYS HA . 6724 1 624 . 1 1 65 65 LYS HB2 H 1 1.577 0.000 . . . . . . 65 LYS HB2 . 6724 1 625 . 1 1 65 65 LYS HB3 H 1 1.813 0.000 . . . . . . 65 LYS HB3 . 6724 1 626 . 1 1 65 65 LYS HG2 H 1 1.364 0.000 . . . . . . 65 LYS QG . 6724 1 627 . 1 1 65 65 LYS HG3 H 1 1.364 0.000 . . . . . . 65 LYS QG . 6724 1 628 . 1 1 65 65 LYS HD2 H 1 1.442 0.000 . . . . . . 65 LYS QD . 6724 1 629 . 1 1 65 65 LYS HD3 H 1 1.442 0.000 . . . . . . 65 LYS QD . 6724 1 630 . 1 1 65 65 LYS HE2 H 1 2.823 0.000 . . . . . . 65 LYS QE . 6724 1 631 . 1 1 65 65 LYS HE3 H 1 2.823 0.000 . . . . . . 65 LYS QE . 6724 1 632 . 1 1 65 65 LYS CA C 13 54.298 0.000 . . . . . . 65 LYS CA . 6724 1 633 . 1 1 65 65 LYS CB C 13 34.525 0.000 . . . . . . 65 LYS CB . 6724 1 634 . 1 1 65 65 LYS CG C 13 25.608 0.000 . . . . . . 65 LYS CG . 6724 1 635 . 1 1 65 65 LYS CD C 13 29.368 0.000 . . . . . . 65 LYS CD . 6724 1 636 . 1 1 65 65 LYS CE C 13 42.221 0.000 . . . . . . 65 LYS CE . 6724 1 637 . 1 1 65 65 LYS N N 15 117.344 0.000 . . . . . . 65 LYS N . 6724 1 638 . 1 1 66 66 LEU H H 1 9.043 0.000 . . . . . . 66 LEU HN . 6724 1 639 . 1 1 66 66 LEU HA H 1 4.311 0.000 . . . . . . 66 LEU HA . 6724 1 640 . 1 1 66 66 LEU HB2 H 1 1.600 0.000 . . . . . . 66 LEU HB2 . 6724 1 641 . 1 1 66 66 LEU HB3 H 1 1.817 0.000 . . . . . . 66 LEU HB3 . 6724 1 642 . 1 1 66 66 LEU HG H 1 0.938 0.000 . . . . . . 66 LEU HG . 6724 1 643 . 1 1 66 66 LEU HD21 H 1 0.620 0.000 . . . . . . 66 LEU QD2 . 6724 1 644 . 1 1 66 66 LEU HD22 H 1 0.620 0.000 . . . . . . 66 LEU QD2 . 6724 1 645 . 1 1 66 66 LEU HD23 H 1 0.620 0.000 . . . . . . 66 LEU QD2 . 6724 1 646 . 1 1 66 66 LEU CA C 13 56.129 0.000 . . . . . . 66 LEU CA . 6724 1 647 . 1 1 66 66 LEU CB C 13 40.666 0.000 . . . . . . 66 LEU CB . 6724 1 648 . 1 1 66 66 LEU CG C 13 26.573 0.000 . . . . . . 66 LEU CG . 6724 1 649 . 1 1 66 66 LEU CD2 C 13 22.829 0.000 . . . . . . 66 LEU CD2 . 6724 1 650 . 1 1 66 66 LEU N N 15 123.704 0.000 . . . . . . 66 LEU N . 6724 1 651 . 1 1 67 67 GLY H H 1 9.188 0.000 . . . . . . 67 GLY HN . 6724 1 652 . 1 1 67 67 GLY HA2 H 1 3.469 0.000 . . . . . . 67 GLY HA1 . 6724 1 653 . 1 1 67 67 GLY HA3 H 1 4.204 0.000 . . . . . . 67 GLY HA2 . 6724 1 654 . 1 1 67 67 GLY CA C 13 46.103 0.000 . . . . . . 67 GLY CA . 6724 1 655 . 1 1 67 67 GLY N N 15 108.656 0.000 . . . . . . 67 GLY N . 6724 1 656 . 1 1 68 68 GLU H H 1 7.514 0.000 . . . . . . 68 GLU HN . 6724 1 657 . 1 1 68 68 GLU HA H 1 4.738 0.000 . . . . . . 68 GLU HA . 6724 1 658 . 1 1 68 68 GLU HB2 H 1 1.366 0.000 . . . . . . 68 GLU HB2 . 6724 1 659 . 1 1 68 68 GLU HB3 H 1 0.729 0.000 . . . . . . 68 GLU HB3 . 6724 1 660 . 1 1 68 68 GLU HG2 H 1 1.950 0.000 . . . . . . 68 GLU HG2 . 6724 1 661 . 1 1 68 68 GLU HG3 H 1 2.269 0.000 . . . . . . 68 GLU HG3 . 6724 1 662 . 1 1 68 68 GLU CA C 13 54.854 0.000 . . . . . . 68 GLU CA . 6724 1 663 . 1 1 68 68 GLU CB C 13 30.623 0.000 . . . . . . 68 GLU CB . 6724 1 664 . 1 1 68 68 GLU CG C 13 35.371 0.000 . . . . . . 68 GLU CG . 6724 1 665 . 1 1 68 68 GLU N N 15 119.771 0.000 . . . . . . 68 GLU N . 6724 1 666 . 1 1 69 69 GLU H H 1 9.183 0.000 . . . . . . 69 GLU HN . 6724 1 667 . 1 1 69 69 GLU HA H 1 4.860 0.000 . . . . . . 69 GLU HA . 6724 1 668 . 1 1 69 69 GLU HB2 H 1 2.019 0.000 . . . . . . 69 GLU QB . 6724 1 669 . 1 1 69 69 GLU HB3 H 1 2.019 0.000 . . . . . . 69 GLU QB . 6724 1 670 . 1 1 69 69 GLU HG2 H 1 2.284 0.000 . . . . . . 69 GLU HG2 . 6724 1 671 . 1 1 69 69 GLU HG3 H 1 2.364 0.000 . . . . . . 69 GLU HG3 . 6724 1 672 . 1 1 69 69 GLU CA C 13 57.014 0.000 . . . . . . 69 GLU CA . 6724 1 673 . 1 1 69 69 GLU CB C 13 29.472 0.000 . . . . . . 69 GLU CB . 6724 1 674 . 1 1 69 69 GLU CG C 13 35.072 0.000 . . . . . . 69 GLU CG . 6724 1 675 . 1 1 69 69 GLU N N 15 130.882 0.000 . . . . . . 69 GLU N . 6724 1 676 . 1 1 70 70 PHE H H 1 9.383 0.000 . . . . . . 70 PHE HN . 6724 1 677 . 1 1 70 70 PHE HA H 1 5.061 0.000 . . . . . . 70 PHE HA . 6724 1 678 . 1 1 70 70 PHE HB2 H 1 3.231 0.000 . . . . . . 70 PHE HB2 . 6724 1 679 . 1 1 70 70 PHE HB3 H 1 3.340 0.000 . . . . . . 70 PHE HB3 . 6724 1 680 . 1 1 70 70 PHE CA C 13 55.374 0.000 . . . . . . 70 PHE CA . 6724 1 681 . 1 1 70 70 PHE CB C 13 41.121 0.000 . . . . . . 70 PHE CB . 6724 1 682 . 1 1 70 70 PHE N N 15 123.183 0.000 . . . . . . 70 PHE N . 6724 1 683 . 1 1 71 71 GLU H H 1 8.398 0.000 . . . . . . 71 GLU HN . 6724 1 684 . 1 1 71 71 GLU HA H 1 4.977 0.000 . . . . . . 71 GLU HA . 6724 1 685 . 1 1 71 71 GLU HB2 H 1 2.030 0.000 . . . . . . 71 GLU QB . 6724 1 686 . 1 1 71 71 GLU HB3 H 1 2.030 0.000 . . . . . . 71 GLU QB . 6724 1 687 . 1 1 71 71 GLU HG2 H 1 2.269 0.000 . . . . . . 71 GLU QG . 6724 1 688 . 1 1 71 71 GLU HG3 H 1 2.269 0.000 . . . . . . 71 GLU QG . 6724 1 689 . 1 1 71 71 GLU CA C 13 54.434 0.000 . . . . . . 71 GLU CA . 6724 1 690 . 1 1 71 71 GLU CB C 13 30.584 0.000 . . . . . . 71 GLU CB . 6724 1 691 . 1 1 71 71 GLU CG C 13 35.535 0.000 . . . . . . 71 GLU CG . 6724 1 692 . 1 1 71 71 GLU N N 15 116.992 0.000 . . . . . . 71 GLU N . 6724 1 693 . 1 1 72 72 GLU H H 1 9.107 0.000 . . . . . . 72 GLU HN . 6724 1 694 . 1 1 72 72 GLU HA H 1 4.685 0.000 . . . . . . 72 GLU HA . 6724 1 695 . 1 1 72 72 GLU HG2 H 1 1.685 0.000 . . . . . . 72 GLU HG2 . 6724 1 696 . 1 1 72 72 GLU HG3 H 1 2.249 0.000 . . . . . . 72 GLU HG3 . 6724 1 697 . 1 1 72 72 GLU CA C 13 54.012 0.000 . . . . . . 72 GLU CA . 6724 1 698 . 1 1 72 72 GLU CB C 13 33.425 0.000 . . . . . . 72 GLU CB . 6724 1 699 . 1 1 72 72 GLU CG C 13 35.238 0.000 . . . . . . 72 GLU CG . 6724 1 700 . 1 1 72 72 GLU N N 15 126.851 0.000 . . . . . . 72 GLU N . 6724 1 701 . 1 1 73 73 ASP H H 1 9.065 0.000 . . . . . . 73 ASP HN . 6724 1 702 . 1 1 73 73 ASP HA H 1 4.897 0.000 . . . . . . 73 ASP HA . 6724 1 703 . 1 1 73 73 ASP HB2 H 1 2.641 0.000 . . . . . . 73 ASP QB . 6724 1 704 . 1 1 73 73 ASP HB3 H 1 2.641 0.000 . . . . . . 73 ASP QB . 6724 1 705 . 1 1 73 73 ASP CA C 13 53.961 0.000 . . . . . . 73 ASP CA . 6724 1 706 . 1 1 73 73 ASP CB C 13 40.048 0.000 . . . . . . 73 ASP CB . 6724 1 707 . 1 1 73 73 ASP N N 15 126.828 0.000 . . . . . . 73 ASP N . 6724 1 708 . 1 1 74 74 ARG H H 1 8.729 0.000 . . . . . . 74 ARG HN . 6724 1 709 . 1 1 74 74 ARG CA C 13 56.418 0.000 . . . . . . 74 ARG CA . 6724 1 710 . 1 1 74 74 ARG CB C 13 33.910 0.000 . . . . . . 74 ARG CB . 6724 1 711 . 1 1 74 74 ARG CG C 13 27.046 0.000 . . . . . . 74 ARG CG . 6724 1 712 . 1 1 74 74 ARG CD C 13 45.685 0.000 . . . . . . 74 ARG CD . 6724 1 713 . 1 1 74 74 ARG N N 15 126.607 0.000 . . . . . . 74 ARG N . 6724 1 714 . 1 1 75 75 ALA H H 1 9.200 0.000 . . . . . . 75 ALA HN . 6724 1 715 . 1 1 75 75 ALA HA H 1 3.867 0.000 . . . . . . 75 ALA HA . 6724 1 716 . 1 1 75 75 ALA HB1 H 1 1.499 0.000 . . . . . . 75 ALA QB . 6724 1 717 . 1 1 75 75 ALA HB2 H 1 1.499 0.000 . . . . . . 75 ALA QB . 6724 1 718 . 1 1 75 75 ALA HB3 H 1 1.499 0.000 . . . . . . 75 ALA QB . 6724 1 719 . 1 1 75 75 ALA CA C 13 54.743 0.000 . . . . . . 75 ALA CA . 6724 1 720 . 1 1 75 75 ALA CB C 13 18.748 0.000 . . . . . . 75 ALA CB . 6724 1 721 . 1 1 75 75 ALA N N 15 124.532 0.000 . . . . . . 75 ALA N . 6724 1 722 . 1 1 76 76 ASP H H 1 8.504 0.000 . . . . . . 76 ASP HN . 6724 1 723 . 1 1 76 76 ASP HA H 1 4.392 0.000 . . . . . . 76 ASP HA . 6724 1 724 . 1 1 76 76 ASP HB2 H 1 2.218 0.000 . . . . . . 76 ASP HB2 . 6724 1 725 . 1 1 76 76 ASP HB3 H 1 2.935 0.000 . . . . . . 76 ASP HB3 . 6724 1 726 . 1 1 76 76 ASP CA C 13 53.443 0.000 . . . . . . 76 ASP CA . 6724 1 727 . 1 1 76 76 ASP CB C 13 39.375 0.000 . . . . . . 76 ASP CB . 6724 1 728 . 1 1 76 76 ASP N N 15 112.153 0.000 . . . . . . 76 ASP N . 6724 1 729 . 1 1 77 77 GLY H H 1 8.228 0.000 . . . . . . 77 GLY HN . 6724 1 730 . 1 1 77 77 GLY HA2 H 1 4.222 0.000 . . . . . . 77 GLY HA1 . 6724 1 731 . 1 1 77 77 GLY HA3 H 1 3.704 0.000 . . . . . . 77 GLY HA2 . 6724 1 732 . 1 1 77 77 GLY CA C 13 45.022 0.000 . . . . . . 77 GLY CA . 6724 1 733 . 1 1 77 77 GLY N N 15 107.477 0.000 . . . . . . 77 GLY N . 6724 1 734 . 1 1 78 78 LYS H H 1 6.936 0.000 . . . . . . 78 LYS HN . 6724 1 735 . 1 1 78 78 LYS HA H 1 4.361 0.000 . . . . . . 78 LYS HA . 6724 1 736 . 1 1 78 78 LYS HB2 H 1 1.924 0.000 . . . . . . 78 LYS QB . 6724 1 737 . 1 1 78 78 LYS HB3 H 1 1.924 0.000 . . . . . . 78 LYS QB . 6724 1 738 . 1 1 78 78 LYS HG2 H 1 1.154 0.000 . . . . . . 78 LYS HG2 . 6724 1 739 . 1 1 78 78 LYS HG3 H 1 1.287 0.000 . . . . . . 78 LYS HG3 . 6724 1 740 . 1 1 78 78 LYS HD2 H 1 1.499 0.000 . . . . . . 78 LYS HD2 . 6724 1 741 . 1 1 78 78 LYS HD3 H 1 1.685 0.000 . . . . . . 78 LYS HD3 . 6724 1 742 . 1 1 78 78 LYS HE2 H 1 2.880 0.000 . . . . . . 78 LYS QE . 6724 1 743 . 1 1 78 78 LYS HE3 H 1 2.880 0.000 . . . . . . 78 LYS QE . 6724 1 744 . 1 1 78 78 LYS CA C 13 55.017 0.000 . . . . . . 78 LYS CA . 6724 1 745 . 1 1 78 78 LYS CB C 13 33.871 0.000 . . . . . . 78 LYS CB . 6724 1 746 . 1 1 78 78 LYS CG C 13 25.610 0.000 . . . . . . 78 LYS CG . 6724 1 747 . 1 1 78 78 LYS CD C 13 28.543 0.000 . . . . . . 78 LYS CD . 6724 1 748 . 1 1 78 78 LYS CE C 13 42.326 0.000 . . . . . . 78 LYS CE . 6724 1 749 . 1 1 78 78 LYS N N 15 119.703 0.000 . . . . . . 78 LYS N . 6724 1 750 . 1 1 79 79 ARG H H 1 8.341 0.000 . . . . . . 79 ARG HN . 6724 1 751 . 1 1 79 79 ARG HA H 1 5.338 0.000 . . . . . . 79 ARG HA . 6724 1 752 . 1 1 79 79 ARG HB2 H 1 1.685 0.000 . . . . . . 79 ARG QB . 6724 1 753 . 1 1 79 79 ARG HB3 H 1 1.685 0.000 . . . . . . 79 ARG QB . 6724 1 754 . 1 1 79 79 ARG HG2 H 1 1.316 0.000 . . . . . . 79 ARG QG . 6724 1 755 . 1 1 79 79 ARG HG3 H 1 1.316 0.000 . . . . . . 79 ARG QG . 6724 1 756 . 1 1 79 79 ARG HD2 H 1 3.054 0.000 . . . . . . 79 ARG QD . 6724 1 757 . 1 1 79 79 ARG HD3 H 1 3.054 0.000 . . . . . . 79 ARG QD . 6724 1 758 . 1 1 79 79 ARG CA C 13 54.960 0.000 . . . . . . 79 ARG CA . 6724 1 759 . 1 1 79 79 ARG CB C 13 30.978 0.000 . . . . . . 79 ARG CB . 6724 1 760 . 1 1 79 79 ARG CG C 13 27.296 0.000 . . . . . . 79 ARG CG . 6724 1 761 . 1 1 79 79 ARG CD C 13 43.564 0.000 . . . . . . 79 ARG CD . 6724 1 762 . 1 1 79 79 ARG N N 15 124.534 0.000 . . . . . . 79 ARG N . 6724 1 763 . 1 1 80 80 VAL H H 1 8.899 0.000 . . . . . . 80 VAL HN . 6724 1 764 . 1 1 80 80 VAL HA H 1 4.765 0.000 . . . . . . 80 VAL HA . 6724 1 765 . 1 1 80 80 VAL HB H 1 2.057 0.000 . . . . . . 80 VAL HB . 6724 1 766 . 1 1 80 80 VAL HG21 H 1 0.676 0.000 . . . . . . 80 VAL QG2 . 6724 1 767 . 1 1 80 80 VAL HG22 H 1 0.676 0.000 . . . . . . 80 VAL QG2 . 6724 1 768 . 1 1 80 80 VAL HG23 H 1 0.676 0.000 . . . . . . 80 VAL QG2 . 6724 1 769 . 1 1 80 80 VAL CA C 13 58.400 0.000 . . . . . . 80 VAL CA . 6724 1 770 . 1 1 80 80 VAL CB C 13 34.522 0.000 . . . . . . 80 VAL CB . 6724 1 771 . 1 1 80 80 VAL CG1 C 13 21.206 0.000 . . . . . . 80 VAL CG1 . 6724 1 772 . 1 1 80 80 VAL CG2 C 13 18.870 0.000 . . . . . . 80 VAL CG2 . 6724 1 773 . 1 1 80 80 VAL N N 15 119.950 0.000 . . . . . . 80 VAL N . 6724 1 774 . 1 1 81 81 LYS H H 1 8.452 0.000 . . . . . . 81 LYS HN . 6724 1 775 . 1 1 81 81 LYS HA H 1 4.544 0.000 . . . . . . 81 LYS HA . 6724 1 776 . 1 1 81 81 LYS HB2 H 1 1.516 0.000 . . . . . . 81 LYS HB2 . 6724 1 777 . 1 1 81 81 LYS HB3 H 1 1.754 0.000 . . . . . . 81 LYS HB3 . 6724 1 778 . 1 1 81 81 LYS HG2 H 1 1.313 0.000 . . . . . . 81 LYS QG . 6724 1 779 . 1 1 81 81 LYS HG3 H 1 1.313 0.000 . . . . . . 81 LYS QG . 6724 1 780 . 1 1 81 81 LYS HE2 H 1 2.767 0.000 . . . . . . 81 LYS QE . 6724 1 781 . 1 1 81 81 LYS HE3 H 1 2.767 0.000 . . . . . . 81 LYS QE . 6724 1 782 . 1 1 81 81 LYS CA C 13 56.154 0.000 . . . . . . 81 LYS CA . 6724 1 783 . 1 1 81 81 LYS CB C 13 33.079 0.000 . . . . . . 81 LYS CB . 6724 1 784 . 1 1 81 81 LYS CG C 13 25.577 0.000 . . . . . . 81 LYS CG . 6724 1 785 . 1 1 81 81 LYS CD C 13 29.153 0.000 . . . . . . 81 LYS CD . 6724 1 786 . 1 1 81 81 LYS CE C 13 41.873 0.000 . . . . . . 81 LYS CE . 6724 1 787 . 1 1 81 81 LYS N N 15 124.157 0.000 . . . . . . 81 LYS N . 6724 1 788 . 1 1 82 82 THR H H 1 8.907 0.000 . . . . . . 82 THR HN . 6724 1 789 . 1 1 82 82 THR HA H 1 5.136 0.000 . . . . . . 82 THR HA . 6724 1 790 . 1 1 82 82 THR HG21 H 1 0.118 0.000 . . . . . . 82 THR QG2 . 6724 1 791 . 1 1 82 82 THR HG22 H 1 0.118 0.000 . . . . . . 82 THR QG2 . 6724 1 792 . 1 1 82 82 THR HG23 H 1 0.118 0.000 . . . . . . 82 THR QG2 . 6724 1 793 . 1 1 82 82 THR CA C 13 58.711 0.000 . . . . . . 82 THR CA . 6724 1 794 . 1 1 82 82 THR CB C 13 69.770 0.000 . . . . . . 82 THR CB . 6724 1 795 . 1 1 82 82 THR CG2 C 13 18.260 0.000 . . . . . . 82 THR CG2 . 6724 1 796 . 1 1 82 82 THR N N 15 118.756 0.000 . . . . . . 82 THR N . 6724 1 797 . 1 1 83 83 VAL H H 1 7.615 0.000 . . . . . . 83 VAL HN . 6724 1 798 . 1 1 83 83 VAL HA H 1 4.420 0.000 . . . . . . 83 VAL HA . 6724 1 799 . 1 1 83 83 VAL HB H 1 1.977 0.000 . . . . . . 83 VAL HB . 6724 1 800 . 1 1 83 83 VAL HG21 H 1 0.915 0.000 . . . . . . 83 VAL QG2 . 6724 1 801 . 1 1 83 83 VAL HG22 H 1 0.915 0.000 . . . . . . 83 VAL QG2 . 6724 1 802 . 1 1 83 83 VAL HG23 H 1 0.915 0.000 . . . . . . 83 VAL QG2 . 6724 1 803 . 1 1 83 83 VAL CA C 13 61.096 0.000 . . . . . . 83 VAL CA . 6724 1 804 . 1 1 83 83 VAL CB C 13 35.922 0.000 . . . . . . 83 VAL CB . 6724 1 805 . 1 1 83 83 VAL CG1 C 13 19.621 0.000 . . . . . . 83 VAL CG1 . 6724 1 806 . 1 1 83 83 VAL CG2 C 13 21.382 0.000 . . . . . . 83 VAL CG2 . 6724 1 807 . 1 1 83 83 VAL N N 15 121.986 0.000 . . . . . . 83 VAL N . 6724 1 808 . 1 1 84 84 ILE H H 1 9.504 0.000 . . . . . . 84 ILE HN . 6724 1 809 . 1 1 84 84 ILE HA H 1 4.820 0.000 . . . . . . 84 ILE HA . 6724 1 810 . 1 1 84 84 ILE HB H 1 1.127 0.000 . . . . . . 84 ILE HB . 6724 1 811 . 1 1 84 84 ILE HG21 H 1 0.543 0.000 . . . . . . 84 ILE QG2 . 6724 1 812 . 1 1 84 84 ILE HG22 H 1 0.543 0.000 . . . . . . 84 ILE QG2 . 6724 1 813 . 1 1 84 84 ILE HG23 H 1 0.543 0.000 . . . . . . 84 ILE QG2 . 6724 1 814 . 1 1 84 84 ILE HD11 H 1 -0.413 0.000 . . . . . . 84 ILE QD1 . 6724 1 815 . 1 1 84 84 ILE HD12 H 1 -0.413 0.000 . . . . . . 84 ILE QD1 . 6724 1 816 . 1 1 84 84 ILE HD13 H 1 -0.413 0.000 . . . . . . 84 ILE QD1 . 6724 1 817 . 1 1 84 84 ILE CA C 13 60.785 0.000 . . . . . . 84 ILE CA . 6724 1 818 . 1 1 84 84 ILE CB C 13 38.488 0.000 . . . . . . 84 ILE CB . 6724 1 819 . 1 1 84 84 ILE CG1 C 13 28.262 0.000 . . . . . . 84 ILE CG1 . 6724 1 820 . 1 1 84 84 ILE CG2 C 13 17.921 0.000 . . . . . . 84 ILE CG2 . 6724 1 821 . 1 1 84 84 ILE CD1 C 13 11.603 0.000 . . . . . . 84 ILE CD1 . 6724 1 822 . 1 1 84 84 ILE N N 15 127.721 0.000 . . . . . . 84 ILE N . 6724 1 823 . 1 1 85 85 GLN H H 1 8.678 0.000 . . . . . . 85 GLN HN . 6724 1 824 . 1 1 85 85 GLN HA H 1 4.818 0.000 . . . . . . 85 GLN HA . 6724 1 825 . 1 1 85 85 GLN HB2 H 1 1.366 0.000 . . . . . . 85 GLN HB2 . 6724 1 826 . 1 1 85 85 GLN HB3 H 1 1.791 0.000 . . . . . . 85 GLN HB3 . 6724 1 827 . 1 1 85 85 GLN HG2 H 1 2.030 0.000 . . . . . . 85 GLN HG2 . 6724 1 828 . 1 1 85 85 GLN HG3 H 1 2.296 0.000 . . . . . . 85 GLN HG3 . 6724 1 829 . 1 1 85 85 GLN CA C 13 53.298 0.000 . . . . . . 85 GLN CA . 6724 1 830 . 1 1 85 85 GLN CB C 13 32.791 0.000 . . . . . . 85 GLN CB . 6724 1 831 . 1 1 85 85 GLN N N 15 124.373 0.000 . . . . . . 85 GLN N . 6724 1 832 . 1 1 86 86 LYS H H 1 9.115 0.000 . . . . . . 86 LYS HN . 6724 1 833 . 1 1 86 86 LYS HA H 1 4.663 0.000 . . . . . . 86 LYS HA . 6724 1 834 . 1 1 86 86 LYS HB2 H 1 1.260 0.000 . . . . . . 86 LYS HB2 . 6724 1 835 . 1 1 86 86 LYS HB3 H 1 1.605 0.000 . . . . . . 86 LYS HB3 . 6724 1 836 . 1 1 86 86 LYS HG2 H 1 0.623 0.000 . . . . . . 86 LYS HG2 . 6724 1 837 . 1 1 86 86 LYS HG3 H 1 0.756 0.000 . . . . . . 86 LYS HG3 . 6724 1 838 . 1 1 86 86 LYS HE2 H 1 2.567 0.000 . . . . . . 86 LYS HE2 . 6724 1 839 . 1 1 86 86 LYS HE3 H 1 2.776 0.000 . . . . . . 86 LYS HE3 . 6724 1 840 . 1 1 86 86 LYS CA C 13 55.527 0.000 . . . . . . 86 LYS CA . 6724 1 841 . 1 1 86 86 LYS CB C 13 34.557 0.000 . . . . . . 86 LYS CB . 6724 1 842 . 1 1 86 86 LYS CG C 13 24.568 0.000 . . . . . . 86 LYS CG . 6724 1 843 . 1 1 86 86 LYS CD C 13 29.510 0.000 . . . . . . 86 LYS CD . 6724 1 844 . 1 1 86 86 LYS CE C 13 41.755 0.000 . . . . . . 86 LYS CE . 6724 1 845 . 1 1 86 86 LYS N N 15 124.535 0.000 . . . . . . 86 LYS N . 6724 1 846 . 1 1 87 87 GLU H H 1 8.493 0.000 . . . . . . 87 GLU HN . 6724 1 847 . 1 1 87 87 GLU HA H 1 4.439 0.000 . . . . . . 87 GLU HA . 6724 1 848 . 1 1 87 87 GLU HB2 H 1 1.366 0.000 . . . . . . 87 GLU HB2 . 6724 1 849 . 1 1 87 87 GLU HB3 H 1 1.844 0.000 . . . . . . 87 GLU HB3 . 6724 1 850 . 1 1 87 87 GLU HG2 H 1 1.526 0.000 . . . . . . 87 GLU HG2 . 6724 1 851 . 1 1 87 87 GLU HG3 H 1 2.057 0.000 . . . . . . 87 GLU HG3 . 6724 1 852 . 1 1 87 87 GLU CA C 13 54.763 0.000 . . . . . . 87 GLU CA . 6724 1 853 . 1 1 87 87 GLU CB C 13 31.107 0.000 . . . . . . 87 GLU CB . 6724 1 854 . 1 1 87 87 GLU CG C 13 35.193 0.000 . . . . . . 87 GLU CG . 6724 1 855 . 1 1 87 87 GLU N N 15 126.304 0.000 . . . . . . 87 GLU N . 6724 1 856 . 1 1 88 88 GLY H H 1 8.216 0.000 . . . . . . 88 GLY HN . 6724 1 857 . 1 1 88 88 GLY HA2 H 1 3.706 0.000 . . . . . . 88 GLY HA1 . 6724 1 858 . 1 1 88 88 GLY HA3 H 1 4.061 0.000 . . . . . . 88 GLY HA2 . 6724 1 859 . 1 1 88 88 GLY CA C 13 44.791 0.000 . . . . . . 88 GLY CA . 6724 1 860 . 1 1 88 88 GLY N N 15 111.038 0.000 . . . . . . 88 GLY N . 6724 1 861 . 1 1 89 89 ASP H H 1 8.512 0.000 . . . . . . 89 ASP HN . 6724 1 862 . 1 1 89 89 ASP HA H 1 4.381 0.000 . . . . . . 89 ASP HA . 6724 1 863 . 1 1 89 89 ASP HB2 H 1 2.495 0.000 . . . . . . 89 ASP HB2 . 6724 1 864 . 1 1 89 89 ASP HB3 H 1 2.651 0.000 . . . . . . 89 ASP HB3 . 6724 1 865 . 1 1 89 89 ASP CA C 13 56.183 0.000 . . . . . . 89 ASP CA . 6724 1 866 . 1 1 89 89 ASP CB C 13 41.107 0.000 . . . . . . 89 ASP CB . 6724 1 867 . 1 1 89 89 ASP N N 15 117.687 0.000 . . . . . . 89 ASP N . 6724 1 868 . 1 1 90 90 ASN H H 1 8.180 0.000 . . . . . . 90 ASN HN . 6724 1 869 . 1 1 90 90 ASN HA H 1 4.885 0.000 . . . . . . 90 ASN HA . 6724 1 870 . 1 1 90 90 ASN HB2 H 1 3.077 0.000 . . . . . . 90 ASN HB2 . 6724 1 871 . 1 1 90 90 ASN HB3 H 1 3.448 0.000 . . . . . . 90 ASN HB3 . 6724 1 872 . 1 1 90 90 ASN CA C 13 52.956 0.000 . . . . . . 90 ASN CA . 6724 1 873 . 1 1 90 90 ASN CB C 13 39.727 0.000 . . . . . . 90 ASN CB . 6724 1 874 . 1 1 90 90 ASN N N 15 113.785 0.000 . . . . . . 90 ASN N . 6724 1 875 . 1 1 91 91 LYS H H 1 7.039 0.000 . . . . . . 91 LYS HN . 6724 1 876 . 1 1 91 91 LYS HA H 1 5.545 0.000 . . . . . . 91 LYS HA . 6724 1 877 . 1 1 91 91 LYS HG2 H 1 0.968 0.000 . . . . . . 91 LYS HG2 . 6724 1 878 . 1 1 91 91 LYS HG3 H 1 1.207 0.000 . . . . . . 91 LYS HG3 . 6724 1 879 . 1 1 91 91 LYS HD2 H 1 1.552 0.000 . . . . . . 91 LYS QD . 6724 1 880 . 1 1 91 91 LYS HD3 H 1 1.552 0.000 . . . . . . 91 LYS QD . 6724 1 881 . 1 1 91 91 LYS HE2 H 1 2.706 0.000 . . . . . . 91 LYS HE2 . 6724 1 882 . 1 1 91 91 LYS HE3 H 1 2.764 0.000 . . . . . . 91 LYS HE3 . 6724 1 883 . 1 1 91 91 LYS CA C 13 55.306 0.000 . . . . . . 91 LYS CA . 6724 1 884 . 1 1 91 91 LYS CB C 13 35.140 0.000 . . . . . . 91 LYS CB . 6724 1 885 . 1 1 91 91 LYS CG C 13 25.663 0.000 . . . . . . 91 LYS CG . 6724 1 886 . 1 1 91 91 LYS CD C 13 29.555 0.000 . . . . . . 91 LYS CD . 6724 1 887 . 1 1 91 91 LYS CE C 13 41.826 0.000 . . . . . . 91 LYS CE . 6724 1 888 . 1 1 91 91 LYS N N 15 119.080 0.000 . . . . . . 91 LYS N . 6724 1 889 . 1 1 92 92 PHE H H 1 9.234 0.000 . . . . . . 92 PHE HN . 6724 1 890 . 1 1 92 92 PHE HA H 1 5.138 0.000 . . . . . . 92 PHE HA . 6724 1 891 . 1 1 92 92 PHE HB2 H 1 2.723 0.000 . . . . . . 92 PHE HB2 . 6724 1 892 . 1 1 92 92 PHE HB3 H 1 3.097 0.000 . . . . . . 92 PHE HB3 . 6724 1 893 . 1 1 92 92 PHE CA C 13 56.290 0.000 . . . . . . 92 PHE CA . 6724 1 894 . 1 1 92 92 PHE CB C 13 41.422 0.000 . . . . . . 92 PHE CB . 6724 1 895 . 1 1 92 92 PHE N N 15 123.569 0.000 . . . . . . 92 PHE N . 6724 1 896 . 1 1 93 93 VAL H H 1 9.819 0.000 . . . . . . 93 VAL HN . 6724 1 897 . 1 1 93 93 VAL HA H 1 4.366 0.000 . . . . . . 93 VAL HA . 6724 1 898 . 1 1 93 93 VAL HB H 1 1.950 0.000 . . . . . . 93 VAL HB . 6724 1 899 . 1 1 93 93 VAL HG21 H 1 0.756 0.000 . . . . . . 93 VAL QG2 . 6724 1 900 . 1 1 93 93 VAL HG22 H 1 0.756 0.000 . . . . . . 93 VAL QG2 . 6724 1 901 . 1 1 93 93 VAL HG23 H 1 0.756 0.000 . . . . . . 93 VAL QG2 . 6724 1 902 . 1 1 93 93 VAL CA C 13 62.603 0.000 . . . . . . 93 VAL CA . 6724 1 903 . 1 1 93 93 VAL CB C 13 33.326 0.000 . . . . . . 93 VAL CB . 6724 1 904 . 1 1 93 93 VAL CG2 C 13 20.672 0.000 . . . . . . 93 VAL CG2 . 6724 1 905 . 1 1 93 93 VAL N N 15 127.141 0.000 . . . . . . 93 VAL N . 6724 1 906 . 1 1 94 94 GLN H H 1 9.208 0.000 . . . . . . 94 GLN HN . 6724 1 907 . 1 1 94 94 GLN HA H 1 5.324 0.000 . . . . . . 94 GLN HA . 6724 1 908 . 1 1 94 94 GLN CA C 13 53.262 0.000 . . . . . . 94 GLN CA . 6724 1 909 . 1 1 94 94 GLN CB C 13 30.650 0.000 . . . . . . 94 GLN CB . 6724 1 910 . 1 1 94 94 GLN CG C 13 32.728 0.000 . . . . . . 94 GLN CG . 6724 1 911 . 1 1 94 94 GLN N N 15 130.354 0.000 . . . . . . 94 GLN N . 6724 1 912 . 1 1 95 95 THR H H 1 8.359 0.000 . . . . . . 95 THR HN . 6724 1 913 . 1 1 95 95 THR HA H 1 4.893 0.000 . . . . . . 95 THR HA . 6724 1 914 . 1 1 95 95 THR HB H 1 3.464 0.000 . . . . . . 95 THR HB . 6724 1 915 . 1 1 95 95 THR HG21 H 1 0.489 0.000 . . . . . . 95 THR QG2 . 6724 1 916 . 1 1 95 95 THR HG22 H 1 0.489 0.000 . . . . . . 95 THR QG2 . 6724 1 917 . 1 1 95 95 THR HG23 H 1 0.489 0.000 . . . . . . 95 THR QG2 . 6724 1 918 . 1 1 95 95 THR CA C 13 61.387 0.000 . . . . . . 95 THR CA . 6724 1 919 . 1 1 95 95 THR CB C 13 69.781 0.000 . . . . . . 95 THR CB . 6724 1 920 . 1 1 95 95 THR CG2 C 13 21.777 0.000 . . . . . . 95 THR CG2 . 6724 1 921 . 1 1 95 95 THR N N 15 122.253 0.000 . . . . . . 95 THR N . 6724 1 922 . 1 1 96 96 GLN H H 1 9.587 0.000 . . . . . . 96 GLN HN . 6724 1 923 . 1 1 96 96 GLN HA H 1 4.522 0.000 . . . . . . 96 GLN HA . 6724 1 924 . 1 1 96 96 GLN CA C 13 54.177 0.000 . . . . . . 96 GLN CA . 6724 1 925 . 1 1 96 96 GLN CB C 13 29.022 0.000 . . . . . . 96 GLN CB . 6724 1 926 . 1 1 96 96 GLN CG C 13 32.862 0.000 . . . . . . 96 GLN CG . 6724 1 927 . 1 1 96 96 GLN N N 15 127.782 0.000 . . . . . . 96 GLN N . 6724 1 928 . 1 1 97 97 PHE H H 1 8.624 0.000 . . . . . . 97 PHE HN . 6724 1 929 . 1 1 97 97 PHE HA H 1 4.654 0.000 . . . . . . 97 PHE HA . 6724 1 930 . 1 1 97 97 PHE HB2 H 1 2.635 0.000 . . . . . . 97 PHE HB2 . 6724 1 931 . 1 1 97 97 PHE HB3 H 1 3.243 0.000 . . . . . . 97 PHE HB3 . 6724 1 932 . 1 1 97 97 PHE CA C 13 57.185 0.000 . . . . . . 97 PHE CA . 6724 1 933 . 1 1 97 97 PHE CB C 13 39.267 0.000 . . . . . . 97 PHE CB . 6724 1 934 . 1 1 97 97 PHE N N 15 123.256 0.000 . . . . . . 97 PHE N . 6724 1 935 . 1 1 98 98 GLY H H 1 7.999 0.000 . . . . . . 98 GLY HN . 6724 1 936 . 1 1 98 98 GLY HA2 H 1 3.198 0.000 . . . . . . 98 GLY HA1 . 6724 1 937 . 1 1 98 98 GLY HA3 H 1 3.085 0.000 . . . . . . 98 GLY HA2 . 6724 1 938 . 1 1 98 98 GLY CA C 13 44.615 0.000 . . . . . . 98 GLY CA . 6724 1 939 . 1 1 98 98 GLY N N 15 108.596 0.000 . . . . . . 98 GLY N . 6724 1 940 . 1 1 99 99 ASP H H 1 8.497 0.000 . . . . . . 99 ASP HN . 6724 1 941 . 1 1 99 99 ASP HA H 1 4.184 0.000 . . . . . . 99 ASP HA . 6724 1 942 . 1 1 99 99 ASP HB2 H 1 2.510 0.000 . . . . . . 99 ASP HB2 . 6724 1 943 . 1 1 99 99 ASP HB3 H 1 2.618 0.000 . . . . . . 99 ASP HB3 . 6724 1 944 . 1 1 99 99 ASP CA C 13 57.030 0.000 . . . . . . 99 ASP CA . 6724 1 945 . 1 1 99 99 ASP CB C 13 39.994 0.000 . . . . . . 99 ASP CB . 6724 1 946 . 1 1 99 99 ASP N N 15 121.494 0.000 . . . . . . 99 ASP N . 6724 1 947 . 1 1 100 100 LYS H H 1 7.290 0.000 . . . . . . 100 LYS HN . 6724 1 948 . 1 1 100 100 LYS HA H 1 4.332 0.000 . . . . . . 100 LYS HA . 6724 1 949 . 1 1 100 100 LYS HB2 H 1 1.366 0.000 . . . . . . 100 LYS QB . 6724 1 950 . 1 1 100 100 LYS HB3 H 1 1.366 0.000 . . . . . . 100 LYS QB . 6724 1 951 . 1 1 100 100 LYS HG2 H 1 1.234 0.000 . . . . . . 100 LYS QG . 6724 1 952 . 1 1 100 100 LYS HG3 H 1 1.234 0.000 . . . . . . 100 LYS QG . 6724 1 953 . 1 1 100 100 LYS HD2 H 1 1.446 0.000 . . . . . . 100 LYS QD . 6724 1 954 . 1 1 100 100 LYS HD3 H 1 1.446 0.000 . . . . . . 100 LYS QD . 6724 1 955 . 1 1 100 100 LYS HE2 H 1 2.817 0.000 . . . . . . 100 LYS QE . 6724 1 956 . 1 1 100 100 LYS HE3 H 1 2.817 0.000 . . . . . . 100 LYS QE . 6724 1 957 . 1 1 100 100 LYS CA C 13 54.477 0.000 . . . . . . 100 LYS CA . 6724 1 958 . 1 1 100 100 LYS CB C 13 34.580 0.000 . . . . . . 100 LYS CB . 6724 1 959 . 1 1 100 100 LYS CG C 13 24.697 0.000 . . . . . . 100 LYS CG . 6724 1 960 . 1 1 100 100 LYS CD C 13 29.422 0.000 . . . . . . 100 LYS CD . 6724 1 961 . 1 1 100 100 LYS CE C 13 42.438 0.000 . . . . . . 100 LYS CE . 6724 1 962 . 1 1 100 100 LYS N N 15 115.291 0.000 . . . . . . 100 LYS N . 6724 1 963 . 1 1 101 101 GLU H H 1 8.549 0.000 . . . . . . 101 GLU HN . 6724 1 964 . 1 1 101 101 GLU HA H 1 4.392 0.000 . . . . . . 101 GLU HA . 6724 1 965 . 1 1 101 101 GLU HB2 H 1 1.946 0.000 . . . . . . 101 GLU QB . 6724 1 966 . 1 1 101 101 GLU HB3 H 1 1.946 0.000 . . . . . . 101 GLU QB . 6724 1 967 . 1 1 101 101 GLU HG2 H 1 2.211 0.000 . . . . . . 101 GLU QG . 6724 1 968 . 1 1 101 101 GLU HG3 H 1 2.211 0.000 . . . . . . 101 GLU QG . 6724 1 969 . 1 1 101 101 GLU CA C 13 56.699 0.000 . . . . . . 101 GLU CA . 6724 1 970 . 1 1 101 101 GLU CB C 13 30.515 0.000 . . . . . . 101 GLU CB . 6724 1 971 . 1 1 101 101 GLU CG C 13 36.553 0.000 . . . . . . 101 GLU CG . 6724 1 972 . 1 1 101 101 GLU N N 15 123.985 0.000 . . . . . . 101 GLU N . 6724 1 973 . 1 1 102 102 VAL H H 1 8.299 0.000 . . . . . . 102 VAL HN . 6724 1 974 . 1 1 102 102 VAL HA H 1 4.732 0.000 . . . . . . 102 VAL HA . 6724 1 975 . 1 1 102 102 VAL HB H 1 1.965 0.000 . . . . . . 102 VAL HB . 6724 1 976 . 1 1 102 102 VAL HG11 H 1 0.888 0.000 . . . . . . 102 VAL QG1 . 6724 1 977 . 1 1 102 102 VAL HG12 H 1 0.888 0.000 . . . . . . 102 VAL QG1 . 6724 1 978 . 1 1 102 102 VAL HG13 H 1 0.888 0.000 . . . . . . 102 VAL QG1 . 6724 1 979 . 1 1 102 102 VAL CA C 13 60.750 0.000 . . . . . . 102 VAL CA . 6724 1 980 . 1 1 102 102 VAL CB C 13 35.255 0.000 . . . . . . 102 VAL CB . 6724 1 981 . 1 1 102 102 VAL CG1 C 13 22.172 0.000 . . . . . . 102 VAL CG1 . 6724 1 982 . 1 1 102 102 VAL CG2 C 13 22.872 0.000 . . . . . . 102 VAL CG2 . 6724 1 983 . 1 1 102 102 VAL N N 15 126.147 0.000 . . . . . . 102 VAL N . 6724 1 984 . 1 1 103 103 LYS H H 1 8.466 0.000 . . . . . . 103 LYS HN . 6724 1 985 . 1 1 103 103 LYS HA H 1 5.250 0.000 . . . . . . 103 LYS HA . 6724 1 986 . 1 1 103 103 LYS HB2 H 1 1.632 0.000 . . . . . . 103 LYS QB . 6724 1 987 . 1 1 103 103 LYS HB3 H 1 1.632 0.000 . . . . . . 103 LYS QB . 6724 1 988 . 1 1 103 103 LYS HG2 H 1 1.234 0.000 . . . . . . 103 LYS QG . 6724 1 989 . 1 1 103 103 LYS HG3 H 1 1.234 0.000 . . . . . . 103 LYS QG . 6724 1 990 . 1 1 103 103 LYS HD2 H 1 1.499 0.000 . . . . . . 103 LYS QD . 6724 1 991 . 1 1 103 103 LYS HD3 H 1 1.499 0.000 . . . . . . 103 LYS QD . 6724 1 992 . 1 1 103 103 LYS HE2 H 1 2.731 0.000 . . . . . . 103 LYS QE . 6724 1 993 . 1 1 103 103 LYS HE3 H 1 2.731 0.000 . . . . . . 103 LYS QE . 6724 1 994 . 1 1 103 103 LYS CA C 13 54.178 0.000 . . . . . . 103 LYS CA . 6724 1 995 . 1 1 103 103 LYS CB C 13 34.668 0.000 . . . . . . 103 LYS CB . 6724 1 996 . 1 1 103 103 LYS CG C 13 24.842 0.000 . . . . . . 103 LYS CG . 6724 1 997 . 1 1 103 103 LYS CD C 13 28.917 0.000 . . . . . . 103 LYS CD . 6724 1 998 . 1 1 103 103 LYS CE C 13 41.815 0.000 . . . . . . 103 LYS CE . 6724 1 999 . 1 1 103 103 LYS N N 15 127.627 0.000 . . . . . . 103 LYS N . 6724 1 1000 . 1 1 104 104 ILE H H 1 9.405 0.000 . . . . . . 104 ILE HN . 6724 1 1001 . 1 1 104 104 ILE HA H 1 4.818 0.000 . . . . . . 104 ILE HA . 6724 1 1002 . 1 1 104 104 ILE HB H 1 1.605 0.000 . . . . . . 104 ILE HB . 6724 1 1003 . 1 1 104 104 ILE HG12 H 1 1.260 0.000 . . . . . . 104 ILE QG1 . 6724 1 1004 . 1 1 104 104 ILE HG13 H 1 1.260 0.000 . . . . . . 104 ILE QG1 . 6724 1 1005 . 1 1 104 104 ILE HG21 H 1 0.437 0.000 . . . . . . 104 ILE QG2 . 6724 1 1006 . 1 1 104 104 ILE HG22 H 1 0.437 0.000 . . . . . . 104 ILE QG2 . 6724 1 1007 . 1 1 104 104 ILE HG23 H 1 0.437 0.000 . . . . . . 104 ILE QG2 . 6724 1 1008 . 1 1 104 104 ILE HD11 H 1 0.570 0.000 . . . . . . 104 ILE QD1 . 6724 1 1009 . 1 1 104 104 ILE HD12 H 1 0.570 0.000 . . . . . . 104 ILE QD1 . 6724 1 1010 . 1 1 104 104 ILE HD13 H 1 0.570 0.000 . . . . . . 104 ILE QD1 . 6724 1 1011 . 1 1 104 104 ILE CA C 13 60.499 0.000 . . . . . . 104 ILE CA . 6724 1 1012 . 1 1 104 104 ILE CB C 13 41.466 0.000 . . . . . . 104 ILE CB . 6724 1 1013 . 1 1 104 104 ILE CG1 C 13 28.133 0.000 . . . . . . 104 ILE CG1 . 6724 1 1014 . 1 1 104 104 ILE CG2 C 13 19.521 0.000 . . . . . . 104 ILE CG2 . 6724 1 1015 . 1 1 104 104 ILE CD1 C 13 14.795 0.000 . . . . . . 104 ILE CD1 . 6724 1 1016 . 1 1 104 104 ILE N N 15 124.269 0.000 . . . . . . 104 ILE N . 6724 1 1017 . 1 1 105 105 ILE H H 1 9.636 0.000 . . . . . . 105 ILE HN . 6724 1 1018 . 1 1 105 105 ILE HA H 1 4.679 0.000 . . . . . . 105 ILE HA . 6724 1 1019 . 1 1 105 105 ILE HB H 1 1.897 0.000 . . . . . . 105 ILE HB . 6724 1 1020 . 1 1 105 105 ILE HG12 H 1 1.499 0.000 . . . . . . 105 ILE QG1 . 6724 1 1021 . 1 1 105 105 ILE HG13 H 1 1.499 0.000 . . . . . . 105 ILE QG1 . 6724 1 1022 . 1 1 105 105 ILE HG21 H 1 0.995 0.000 . . . . . . 105 ILE QG2 . 6724 1 1023 . 1 1 105 105 ILE HG22 H 1 0.995 0.000 . . . . . . 105 ILE QG2 . 6724 1 1024 . 1 1 105 105 ILE HG23 H 1 0.995 0.000 . . . . . . 105 ILE QG2 . 6724 1 1025 . 1 1 105 105 ILE HD11 H 1 0.782 0.000 . . . . . . 105 ILE QD1 . 6724 1 1026 . 1 1 105 105 ILE HD12 H 1 0.782 0.000 . . . . . . 105 ILE QD1 . 6724 1 1027 . 1 1 105 105 ILE HD13 H 1 0.782 0.000 . . . . . . 105 ILE QD1 . 6724 1 1028 . 1 1 105 105 ILE CA C 13 60.450 0.000 . . . . . . 105 ILE CA . 6724 1 1029 . 1 1 105 105 ILE CB C 13 39.560 0.000 . . . . . . 105 ILE CB . 6724 1 1030 . 1 1 105 105 ILE CG1 C 13 28.234 0.000 . . . . . . 105 ILE CG1 . 6724 1 1031 . 1 1 105 105 ILE CG2 C 13 18.319 0.000 . . . . . . 105 ILE CG2 . 6724 1 1032 . 1 1 105 105 ILE CD1 C 13 13.607 0.000 . . . . . . 105 ILE CD1 . 6724 1 1033 . 1 1 105 105 ILE N N 15 132.965 0.000 . . . . . . 105 ILE N . 6724 1 1034 . 1 1 106 106 ARG H H 1 8.870 0.000 . . . . . . 106 ARG HN . 6724 1 1035 . 1 1 106 106 ARG HA H 1 4.844 0.000 . . . . . . 106 ARG HA . 6724 1 1036 . 1 1 106 106 ARG CA C 13 54.862 0.000 . . . . . . 106 ARG CA . 6724 1 1037 . 1 1 106 106 ARG CB C 13 32.737 0.000 . . . . . . 106 ARG CB . 6724 1 1038 . 1 1 106 106 ARG CG C 13 29.874 0.000 . . . . . . 106 ARG CG . 6724 1 1039 . 1 1 106 106 ARG CD C 13 43.755 0.000 . . . . . . 106 ARG CD . 6724 1 1040 . 1 1 106 106 ARG N N 15 124.930 0.000 . . . . . . 106 ARG N . 6724 1 1041 . 1 1 107 107 GLU H H 1 8.651 0.000 . . . . . . 107 GLU HN . 6724 1 1042 . 1 1 107 107 GLU HA H 1 5.055 0.000 . . . . . . 107 GLU HA . 6724 1 1043 . 1 1 107 107 GLU HB2 H 1 1.376 0.000 . . . . . . 107 GLU HB2 . 6724 1 1044 . 1 1 107 107 GLU HB3 H 1 1.705 0.000 . . . . . . 107 GLU HB3 . 6724 1 1045 . 1 1 107 107 GLU HG2 H 1 1.844 0.000 . . . . . . 107 GLU HG2 . 6724 1 1046 . 1 1 107 107 GLU HG3 H 1 2.027 0.000 . . . . . . 107 GLU HG3 . 6724 1 1047 . 1 1 107 107 GLU CA C 13 54.639 0.000 . . . . . . 107 GLU CA . 6724 1 1048 . 1 1 107 107 GLU CB C 13 31.949 0.000 . . . . . . 107 GLU CB . 6724 1 1049 . 1 1 107 107 GLU CG C 13 36.580 0.000 . . . . . . 107 GLU CG . 6724 1 1050 . 1 1 107 107 GLU N N 15 124.378 0.000 . . . . . . 107 GLU N . 6724 1 1051 . 1 1 108 108 PHE H H 1 8.889 0.000 . . . . . . 108 PHE HN . 6724 1 1052 . 1 1 108 108 PHE HA H 1 4.446 0.000 . . . . . . 108 PHE HA . 6724 1 1053 . 1 1 108 108 PHE HB2 H 1 2.986 0.000 . . . . . . 108 PHE HB2 . 6724 1 1054 . 1 1 108 108 PHE HB3 H 1 3.304 0.000 . . . . . . 108 PHE HB3 . 6724 1 1055 . 1 1 108 108 PHE CA C 13 58.013 0.000 . . . . . . 108 PHE CA . 6724 1 1056 . 1 1 108 108 PHE CB C 13 39.458 0.000 . . . . . . 108 PHE CB . 6724 1 1057 . 1 1 108 108 PHE N N 15 125.724 0.000 . . . . . . 108 PHE N . 6724 1 1058 . 1 1 109 109 ASN H H 1 8.723 0.000 . . . . . . 109 ASN HN . 6724 1 1059 . 1 1 109 109 ASN HA H 1 5.053 0.000 . . . . . . 109 ASN HA . 6724 1 1060 . 1 1 109 109 ASN HB2 H 1 2.690 0.000 . . . . . . 109 ASN HB2 . 6724 1 1061 . 1 1 109 109 ASN HB3 H 1 2.796 0.000 . . . . . . 109 ASN HB3 . 6724 1 1062 . 1 1 109 109 ASN CA C 13 51.871 0.000 . . . . . . 109 ASN CA . 6724 1 1063 . 1 1 109 109 ASN CB C 13 40.255 0.000 . . . . . . 109 ASN CB . 6724 1 1064 . 1 1 109 109 ASN N N 15 123.972 0.000 . . . . . . 109 ASN N . 6724 1 1065 . 1 1 110 110 GLY H H 1 8.799 0.000 . . . . . . 110 GLY HN . 6724 1 1066 . 1 1 110 110 GLY HA2 H 1 3.644 0.000 . . . . . . 110 GLY HA1 . 6724 1 1067 . 1 1 110 110 GLY HA3 H 1 4.208 0.000 . . . . . . 110 GLY HA2 . 6724 1 1068 . 1 1 110 110 GLY CA C 13 47.511 0.000 . . . . . . 110 GLY CA . 6724 1 1069 . 1 1 110 110 GLY N N 15 113.101 0.000 . . . . . . 110 GLY N . 6724 1 1070 . 1 1 111 111 ASP H H 1 8.823 0.000 . . . . . . 111 ASP HN . 6724 1 1071 . 1 1 111 111 ASP HA H 1 4.817 0.000 . . . . . . 111 ASP HA . 6724 1 1072 . 1 1 111 111 ASP HB2 H 1 2.758 0.000 . . . . . . 111 ASP HB2 . 6724 1 1073 . 1 1 111 111 ASP HB3 H 1 2.986 0.000 . . . . . . 111 ASP HB3 . 6724 1 1074 . 1 1 111 111 ASP CA C 13 54.499 0.000 . . . . . . 111 ASP CA . 6724 1 1075 . 1 1 111 111 ASP CB C 13 41.108 0.000 . . . . . . 111 ASP CB . 6724 1 1076 . 1 1 111 111 ASP N N 15 125.657 0.000 . . . . . . 111 ASP N . 6724 1 1077 . 1 1 112 112 GLU H H 1 7.855 0.000 . . . . . . 112 GLU HN . 6724 1 1078 . 1 1 112 112 GLU HA H 1 5.471 0.000 . . . . . . 112 GLU HA . 6724 1 1079 . 1 1 112 112 GLU HB2 H 1 1.366 0.000 . . . . . . 112 GLU HB2 . 6724 1 1080 . 1 1 112 112 GLU HB3 H 1 1.939 0.000 . . . . . . 112 GLU HB3 . 6724 1 1081 . 1 1 112 112 GLU HG2 H 1 2.207 0.000 . . . . . . 112 GLU HG2 . 6724 1 1082 . 1 1 112 112 GLU HG3 H 1 3.800 0.000 . . . . . . 112 GLU HG3 . 6724 1 1083 . 1 1 112 112 GLU CA C 13 54.337 0.000 . . . . . . 112 GLU CA . 6724 1 1084 . 1 1 112 112 GLU CB C 13 33.582 0.000 . . . . . . 112 GLU CB . 6724 1 1085 . 1 1 112 112 GLU CG C 13 35.572 0.000 . . . . . . 112 GLU CG . 6724 1 1086 . 1 1 112 112 GLU N N 15 118.029 0.000 . . . . . . 112 GLU N . 6724 1 1087 . 1 1 113 113 VAL H H 1 8.530 0.000 . . . . . . 113 VAL HN . 6724 1 1088 . 1 1 113 113 VAL HA H 1 4.505 0.000 . . . . . . 113 VAL HA . 6724 1 1089 . 1 1 113 113 VAL HB H 1 1.051 0.000 . . . . . . 113 VAL HB . 6724 1 1090 . 1 1 113 113 VAL HG11 H 1 -0.382 0.000 . . . . . . 113 VAL QG1 . 6724 1 1091 . 1 1 113 113 VAL HG12 H 1 -0.382 0.000 . . . . . . 113 VAL QG1 . 6724 1 1092 . 1 1 113 113 VAL HG13 H 1 -0.382 0.000 . . . . . . 113 VAL QG1 . 6724 1 1093 . 1 1 113 113 VAL HG21 H 1 -0.487 0.000 . . . . . . 113 VAL QG2 . 6724 1 1094 . 1 1 113 113 VAL HG22 H 1 -0.487 0.000 . . . . . . 113 VAL QG2 . 6724 1 1095 . 1 1 113 113 VAL HG23 H 1 -0.487 0.000 . . . . . . 113 VAL QG2 . 6724 1 1096 . 1 1 113 113 VAL CA C 13 59.706 0.000 . . . . . . 113 VAL CA . 6724 1 1097 . 1 1 113 113 VAL CB C 13 34.396 0.000 . . . . . . 113 VAL CB . 6724 1 1098 . 1 1 113 113 VAL CG1 C 13 19.260 0.000 . . . . . . 113 VAL CG1 . 6724 1 1099 . 1 1 113 113 VAL CG2 C 13 20.346 0.000 . . . . . . 113 VAL CG2 . 6724 1 1100 . 1 1 113 113 VAL N N 15 120.762 0.000 . . . . . . 113 VAL N . 6724 1 1101 . 1 1 114 114 VAL H H 1 8.496 0.000 . . . . . . 114 VAL HN . 6724 1 1102 . 1 1 114 114 VAL HA H 1 4.205 0.000 . . . . . . 114 VAL HA . 6724 1 1103 . 1 1 114 114 VAL HB H 1 1.791 0.000 . . . . . . 114 VAL HB . 6724 1 1104 . 1 1 114 114 VAL HG11 H 1 0.756 0.000 . . . . . . 114 VAL QG1 . 6724 1 1105 . 1 1 114 114 VAL HG12 H 1 0.756 0.000 . . . . . . 114 VAL QG1 . 6724 1 1106 . 1 1 114 114 VAL HG13 H 1 0.756 0.000 . . . . . . 114 VAL QG1 . 6724 1 1107 . 1 1 114 114 VAL HG21 H 1 0.649 0.000 . . . . . . 114 VAL QG2 . 6724 1 1108 . 1 1 114 114 VAL HG22 H 1 0.649 0.000 . . . . . . 114 VAL QG2 . 6724 1 1109 . 1 1 114 114 VAL HG23 H 1 0.649 0.000 . . . . . . 114 VAL QG2 . 6724 1 1110 . 1 1 114 114 VAL CA C 13 61.972 0.000 . . . . . . 114 VAL CA . 6724 1 1111 . 1 1 114 114 VAL CB C 13 32.943 0.000 . . . . . . 114 VAL CB . 6724 1 1112 . 1 1 114 114 VAL CG2 C 13 21.251 0.000 . . . . . . 114 VAL CG2 . 6724 1 1113 . 1 1 114 114 VAL N N 15 127.501 0.000 . . . . . . 114 VAL N . 6724 1 1114 . 1 1 115 115 VAL H H 1 9.510 0.000 . . . . . . 115 VAL HN . 6724 1 1115 . 1 1 115 115 VAL HA H 1 4.739 0.000 . . . . . . 115 VAL HA . 6724 1 1116 . 1 1 115 115 VAL HB H 1 2.087 0.000 . . . . . . 115 VAL HB . 6724 1 1117 . 1 1 115 115 VAL HG21 H 1 0.362 0.000 . . . . . . 115 VAL QG2 . 6724 1 1118 . 1 1 115 115 VAL HG22 H 1 0.362 0.000 . . . . . . 115 VAL QG2 . 6724 1 1119 . 1 1 115 115 VAL HG23 H 1 0.362 0.000 . . . . . . 115 VAL QG2 . 6724 1 1120 . 1 1 115 115 VAL CA C 13 61.831 0.000 . . . . . . 115 VAL CA . 6724 1 1121 . 1 1 115 115 VAL CB C 13 32.190 0.000 . . . . . . 115 VAL CB . 6724 1 1122 . 1 1 115 115 VAL CG2 C 13 20.676 0.000 . . . . . . 115 VAL CG2 . 6724 1 1123 . 1 1 115 115 VAL N N 15 132.668 0.000 . . . . . . 115 VAL N . 6724 1 1124 . 1 1 116 116 THR H H 1 9.298 0.000 . . . . . . 116 THR HN . 6724 1 1125 . 1 1 116 116 THR HA H 1 4.954 0.000 . . . . . . 116 THR HA . 6724 1 1126 . 1 1 116 116 THR HB H 1 3.849 0.000 . . . . . . 116 THR HB . 6724 1 1127 . 1 1 116 116 THR HG21 H 1 0.950 0.000 . . . . . . 116 THR QG2 . 6724 1 1128 . 1 1 116 116 THR HG22 H 1 0.950 0.000 . . . . . . 116 THR QG2 . 6724 1 1129 . 1 1 116 116 THR HG23 H 1 0.950 0.000 . . . . . . 116 THR QG2 . 6724 1 1130 . 1 1 116 116 THR CA C 13 61.225 0.000 . . . . . . 116 THR CA . 6724 1 1131 . 1 1 116 116 THR CB C 13 69.250 0.000 . . . . . . 116 THR CB . 6724 1 1132 . 1 1 116 116 THR CG2 C 13 21.490 0.000 . . . . . . 116 THR CG2 . 6724 1 1133 . 1 1 116 116 THR N N 15 125.057 0.000 . . . . . . 116 THR N . 6724 1 1134 . 1 1 117 117 ALA H H 1 9.106 0.000 . . . . . . 117 ALA HN . 6724 1 1135 . 1 1 117 117 ALA HA H 1 5.403 0.000 . . . . . . 117 ALA HA . 6724 1 1136 . 1 1 117 117 ALA HB1 H 1 0.492 0.000 . . . . . . 117 ALA QB . 6724 1 1137 . 1 1 117 117 ALA HB2 H 1 0.492 0.000 . . . . . . 117 ALA QB . 6724 1 1138 . 1 1 117 117 ALA HB3 H 1 0.492 0.000 . . . . . . 117 ALA QB . 6724 1 1139 . 1 1 117 117 ALA CA C 13 49.456 0.000 . . . . . . 117 ALA CA . 6724 1 1140 . 1 1 117 117 ALA CB C 13 21.113 0.000 . . . . . . 117 ALA CB . 6724 1 1141 . 1 1 117 117 ALA N N 15 132.910 0.000 . . . . . . 117 ALA N . 6724 1 1142 . 1 1 118 118 SER H H 1 9.445 0.000 . . . . . . 118 SER HN . 6724 1 1143 . 1 1 118 118 SER HA H 1 5.994 0.000 . . . . . . 118 SER HA . 6724 1 1144 . 1 1 118 118 SER HB2 H 1 3.543 0.000 . . . . . . 118 SER HB2 . 6724 1 1145 . 1 1 118 118 SER HB3 H 1 3.703 0.000 . . . . . . 118 SER HB3 . 6724 1 1146 . 1 1 118 118 SER CA C 13 56.502 0.000 . . . . . . 118 SER CA . 6724 1 1147 . 1 1 118 118 SER CB C 13 66.853 0.000 . . . . . . 118 SER CB . 6724 1 1148 . 1 1 118 118 SER N N 15 116.235 0.000 . . . . . . 118 SER N . 6724 1 1149 . 1 1 119 119 CYS H H 1 8.791 0.000 . . . . . . 119 CYS HN . 6724 1 1150 . 1 1 119 119 CYS HA H 1 4.446 0.000 . . . . . . 119 CYS HA . 6724 1 1151 . 1 1 119 119 CYS HB2 H 1 2.006 0.000 . . . . . . 119 CYS HB2 . 6724 1 1152 . 1 1 119 119 CYS HB3 H 1 2.831 0.000 . . . . . . 119 CYS HB3 . 6724 1 1153 . 1 1 119 119 CYS CA C 13 59.020 0.000 . . . . . . 119 CYS CA . 6724 1 1154 . 1 1 119 119 CYS CB C 13 29.410 0.000 . . . . . . 119 CYS CB . 6724 1 1155 . 1 1 119 119 CYS N N 15 122.664 0.000 . . . . . . 119 CYS N . 6724 1 1156 . 1 1 120 120 ASP H H 1 9.603 0.000 . . . . . . 120 ASP HN . 6724 1 1157 . 1 1 120 120 ASP HA H 1 4.253 0.000 . . . . . . 120 ASP HA . 6724 1 1158 . 1 1 120 120 ASP HB2 H 1 2.341 0.000 . . . . . . 120 ASP HB2 . 6724 1 1159 . 1 1 120 120 ASP HB3 H 1 2.928 0.000 . . . . . . 120 ASP HB3 . 6724 1 1160 . 1 1 120 120 ASP CA C 13 54.783 0.000 . . . . . . 120 ASP CA . 6724 1 1161 . 1 1 120 120 ASP CB C 13 40.603 0.000 . . . . . . 120 ASP CB . 6724 1 1162 . 1 1 120 120 ASP N N 15 128.749 0.000 . . . . . . 120 ASP N . 6724 1 1163 . 1 1 121 121 GLY H H 1 8.587 0.000 . . . . . . 121 GLY HN . 6724 1 1164 . 1 1 121 121 GLY HA2 H 1 3.525 0.000 . . . . . . 121 GLY HA1 . 6724 1 1165 . 1 1 121 121 GLY HA3 H 1 4.155 0.000 . . . . . . 121 GLY HA2 . 6724 1 1166 . 1 1 121 121 GLY CA C 13 45.390 0.000 . . . . . . 121 GLY CA . 6724 1 1167 . 1 1 121 121 GLY N N 15 102.493 0.000 . . . . . . 121 GLY N . 6724 1 1168 . 1 1 122 122 VAL H H 1 7.981 0.000 . . . . . . 122 VAL HN . 6724 1 1169 . 1 1 122 122 VAL HA H 1 4.181 0.000 . . . . . . 122 VAL HA . 6724 1 1170 . 1 1 122 122 VAL HB H 1 2.057 0.000 . . . . . . 122 VAL HB . 6724 1 1171 . 1 1 122 122 VAL HG11 H 1 0.835 0.000 . . . . . . 122 VAL QG1 . 6724 1 1172 . 1 1 122 122 VAL HG12 H 1 0.835 0.000 . . . . . . 122 VAL QG1 . 6724 1 1173 . 1 1 122 122 VAL HG13 H 1 0.835 0.000 . . . . . . 122 VAL QG1 . 6724 1 1174 . 1 1 122 122 VAL CA C 13 62.087 0.000 . . . . . . 122 VAL CA . 6724 1 1175 . 1 1 122 122 VAL CB C 13 33.126 0.000 . . . . . . 122 VAL CB . 6724 1 1176 . 1 1 122 122 VAL CG1 C 13 21.080 0.000 . . . . . . 122 VAL CG1 . 6724 1 1177 . 1 1 122 122 VAL CG2 C 13 22.153 0.000 . . . . . . 122 VAL CG2 . 6724 1 1178 . 1 1 122 122 VAL N N 15 123.000 0.000 . . . . . . 122 VAL N . 6724 1 1179 . 1 1 123 123 THR H H 1 8.322 0.000 . . . . . . 123 THR HN . 6724 1 1180 . 1 1 123 123 THR HA H 1 5.065 0.000 . . . . . . 123 THR HA . 6724 1 1181 . 1 1 123 123 THR HG21 H 1 0.901 0.000 . . . . . . 123 THR QG2 . 6724 1 1182 . 1 1 123 123 THR HG22 H 1 0.901 0.000 . . . . . . 123 THR QG2 . 6724 1 1183 . 1 1 123 123 THR HG23 H 1 0.901 0.000 . . . . . . 123 THR QG2 . 6724 1 1184 . 1 1 123 123 THR CA C 13 61.650 0.000 . . . . . . 123 THR CA . 6724 1 1185 . 1 1 123 123 THR CB C 13 70.771 0.000 . . . . . . 123 THR CB . 6724 1 1186 . 1 1 123 123 THR CG2 C 13 22.456 0.000 . . . . . . 123 THR CG2 . 6724 1 1187 . 1 1 123 123 THR N N 15 122.912 0.000 . . . . . . 123 THR N . 6724 1 1188 . 1 1 124 124 SER H H 1 9.304 0.000 . . . . . . 124 SER HN . 6724 1 1189 . 1 1 124 124 SER HA H 1 4.924 0.000 . . . . . . 124 SER HA . 6724 1 1190 . 1 1 124 124 SER HB2 H 1 3.145 0.000 . . . . . . 124 SER HB2 . 6724 1 1191 . 1 1 124 124 SER HB3 H 1 3.729 0.000 . . . . . . 124 SER HB3 . 6724 1 1192 . 1 1 124 124 SER CA C 13 55.157 0.000 . . . . . . 124 SER CA . 6724 1 1193 . 1 1 124 124 SER CB C 13 66.184 0.000 . . . . . . 124 SER CB . 6724 1 1194 . 1 1 124 124 SER N N 15 121.142 0.000 . . . . . . 124 SER N . 6724 1 1195 . 1 1 125 125 VAL H H 1 7.687 0.000 . . . . . . 125 VAL HN . 6724 1 1196 . 1 1 125 125 VAL HA H 1 4.951 0.000 . . . . . . 125 VAL HA . 6724 1 1197 . 1 1 125 125 VAL HB H 1 1.685 0.000 . . . . . . 125 VAL HB . 6724 1 1198 . 1 1 125 125 VAL HG11 H 1 0.623 0.000 . . . . . . 125 VAL QG1 . 6724 1 1199 . 1 1 125 125 VAL HG12 H 1 0.623 0.000 . . . . . . 125 VAL QG1 . 6724 1 1200 . 1 1 125 125 VAL HG13 H 1 0.623 0.000 . . . . . . 125 VAL QG1 . 6724 1 1201 . 1 1 125 125 VAL HG21 H 1 0.729 0.000 . . . . . . 125 VAL QG2 . 6724 1 1202 . 1 1 125 125 VAL HG22 H 1 0.729 0.000 . . . . . . 125 VAL QG2 . 6724 1 1203 . 1 1 125 125 VAL HG23 H 1 0.729 0.000 . . . . . . 125 VAL QG2 . 6724 1 1204 . 1 1 125 125 VAL CA C 13 61.185 0.000 . . . . . . 125 VAL CA . 6724 1 1205 . 1 1 125 125 VAL CB C 13 34.330 0.000 . . . . . . 125 VAL CB . 6724 1 1206 . 1 1 125 125 VAL CG1 C 13 21.012 0.000 . . . . . . 125 VAL CG1 . 6724 1 1207 . 1 1 125 125 VAL N N 15 123.791 0.000 . . . . . . 125 VAL N . 6724 1 1208 . 1 1 126 126 ARG H H 1 9.675 0.000 . . . . . . 126 ARG HN . 6724 1 1209 . 1 1 126 126 ARG HA H 1 4.765 0.000 . . . . . . 126 ARG HA . 6724 1 1210 . 1 1 126 126 ARG HB2 H 1 1.871 0.000 . . . . . . 126 ARG HB2 . 6724 1 1211 . 1 1 126 126 ARG HB3 H 1 2.110 0.000 . . . . . . 126 ARG HB3 . 6724 1 1212 . 1 1 126 126 ARG HG2 H 1 1.346 0.000 . . . . . . 126 ARG HG2 . 6724 1 1213 . 1 1 126 126 ARG HG3 H 1 1.074 0.000 . . . . . . 126 ARG HG3 . 6724 1 1214 . 1 1 126 126 ARG CA C 13 54.210 0.000 . . . . . . 126 ARG CA . 6724 1 1215 . 1 1 126 126 ARG CB C 13 33.524 0.000 . . . . . . 126 ARG CB . 6724 1 1216 . 1 1 126 126 ARG CG C 13 27.010 0.000 . . . . . . 126 ARG CG . 6724 1 1217 . 1 1 126 126 ARG CD C 13 43.905 0.000 . . . . . . 126 ARG CD . 6724 1 1218 . 1 1 126 126 ARG N N 15 131.722 0.000 . . . . . . 126 ARG N . 6724 1 1219 . 1 1 127 127 THR H H 1 8.670 0.000 . . . . . . 127 THR HN . 6724 1 1220 . 1 1 127 127 THR HA H 1 5.004 0.000 . . . . . . 127 THR HA . 6724 1 1221 . 1 1 127 127 THR HB H 1 3.756 0.000 . . . . . . 127 THR HB . 6724 1 1222 . 1 1 127 127 THR HG21 H 1 1.021 0.000 . . . . . . 127 THR QG2 . 6724 1 1223 . 1 1 127 127 THR HG22 H 1 1.021 0.000 . . . . . . 127 THR QG2 . 6724 1 1224 . 1 1 127 127 THR HG23 H 1 1.021 0.000 . . . . . . 127 THR QG2 . 6724 1 1225 . 1 1 127 127 THR CA C 13 61.632 0.000 . . . . . . 127 THR CA . 6724 1 1226 . 1 1 127 127 THR CB C 13 70.068 0.000 . . . . . . 127 THR CB . 6724 1 1227 . 1 1 127 127 THR CG2 C 13 21.397 0.000 . . . . . . 127 THR CG2 . 6724 1 1228 . 1 1 127 127 THR N N 15 118.508 0.000 . . . . . . 127 THR N . 6724 1 1229 . 1 1 128 128 TYR H H 1 9.420 0.000 . . . . . . 128 TYR HN . 6724 1 1230 . 1 1 128 128 TYR HA H 1 4.951 0.000 . . . . . . 128 TYR HA . 6724 1 1231 . 1 1 128 128 TYR HB2 H 1 2.641 0.000 . . . . . . 128 TYR QB . 6724 1 1232 . 1 1 128 128 TYR HB3 H 1 2.641 0.000 . . . . . . 128 TYR QB . 6724 1 1233 . 1 1 128 128 TYR CA C 13 56.718 0.000 . . . . . . 128 TYR CA . 6724 1 1234 . 1 1 128 128 TYR CB C 13 41.874 0.000 . . . . . . 128 TYR CB . 6724 1 1235 . 1 1 128 128 TYR N N 15 126.909 0.000 . . . . . . 128 TYR N . 6724 1 1236 . 1 1 129 129 LYS H H 1 8.981 0.000 . . . . . . 129 LYS HN . 6724 1 1237 . 1 1 129 129 LYS HA H 1 5.398 0.000 . . . . . . 129 LYS HA . 6724 1 1238 . 1 1 129 129 LYS HB2 H 1 1.859 0.000 . . . . . . 129 LYS QB . 6724 1 1239 . 1 1 129 129 LYS HB3 H 1 1.859 0.000 . . . . . . 129 LYS QB . 6724 1 1240 . 1 1 129 129 LYS HG2 H 1 1.465 0.000 . . . . . . 129 LYS QG . 6724 1 1241 . 1 1 129 129 LYS HG3 H 1 1.465 0.000 . . . . . . 129 LYS QG . 6724 1 1242 . 1 1 129 129 LYS HD2 H 1 1.678 0.000 . . . . . . 129 LYS QD . 6724 1 1243 . 1 1 129 129 LYS HD3 H 1 1.678 0.000 . . . . . . 129 LYS QD . 6724 1 1244 . 1 1 129 129 LYS HE2 H 1 2.951 0.000 . . . . . . 129 LYS QE . 6724 1 1245 . 1 1 129 129 LYS HE3 H 1 2.951 0.000 . . . . . . 129 LYS QE . 6724 1 1246 . 1 1 129 129 LYS CA C 13 54.414 0.000 . . . . . . 129 LYS CA . 6724 1 1247 . 1 1 129 129 LYS CB C 13 36.081 0.000 . . . . . . 129 LYS CB . 6724 1 1248 . 1 1 129 129 LYS CG C 13 24.780 0.000 . . . . . . 129 LYS CG . 6724 1 1249 . 1 1 129 129 LYS CD C 13 29.066 0.000 . . . . . . 129 LYS CD . 6724 1 1250 . 1 1 129 129 LYS CE C 13 42.163 0.000 . . . . . . 129 LYS CE . 6724 1 1251 . 1 1 129 129 LYS N N 15 121.440 0.000 . . . . . . 129 LYS N . 6724 1 1252 . 1 1 130 130 ARG H H 1 9.233 0.000 . . . . . . 130 ARG HN . 6724 1 1253 . 1 1 130 130 ARG HA H 1 4.154 0.000 . . . . . . 130 ARG HA . 6724 1 1254 . 1 1 130 130 ARG HB2 H 1 1.605 0.000 . . . . . . 130 ARG HB2 . 6724 1 1255 . 1 1 130 130 ARG HB3 H 1 1.765 0.000 . . . . . . 130 ARG HB3 . 6724 1 1256 . 1 1 130 130 ARG HG2 H 1 1.234 0.000 . . . . . . 130 ARG QG . 6724 1 1257 . 1 1 130 130 ARG HG3 H 1 1.234 0.000 . . . . . . 130 ARG QG . 6724 1 1258 . 1 1 130 130 ARG HD2 H 1 2.986 0.000 . . . . . . 130 ARG HD2 . 6724 1 1259 . 1 1 130 130 ARG HD3 H 1 3.278 0.000 . . . . . . 130 ARG HD3 . 6724 1 1260 . 1 1 130 130 ARG CA C 13 57.982 0.000 . . . . . . 130 ARG CA . 6724 1 1261 . 1 1 130 130 ARG CB C 13 31.336 0.000 . . . . . . 130 ARG CB . 6724 1 1262 . 1 1 130 130 ARG CG C 13 26.790 0.000 . . . . . . 130 ARG CG . 6724 1 1263 . 1 1 130 130 ARG CD C 13 43.405 0.000 . . . . . . 130 ARG CD . 6724 1 1264 . 1 1 130 130 ARG N N 15 128.919 0.000 . . . . . . 130 ARG N . 6724 1 1265 . 1 1 131 131 ILE H H 1 8.252 0.000 . . . . . . 131 ILE HN . 6724 1 1266 . 1 1 131 131 ILE CA C 13 63.292 0.000 . . . . . . 131 ILE CA . 6724 1 1267 . 1 1 131 131 ILE CB C 13 39.660 0.000 . . . . . . 131 ILE CB . 6724 1 1268 . 1 1 131 131 ILE N N 15 129.759 0.000 . . . . . . 131 ILE N . 6724 1 stop_ save_