data_11152 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11152 _Entry.Title ; Solution structure of the fibronectin type III domain of human Integrin beta-4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-04-15 _Entry.Accession_date 2010-04-15 _Entry.Last_release_date 2011-05-05 _Entry.Original_release_date 2011-05-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 H. Abe . . . 11152 2 A. Sasagawa . . . 11152 3 N. Tochio . . . 11152 4 S. Koshiba . . . 11152 5 M. Inoue . . . 11152 6 T. Kigawa . . . 11152 7 S. Yokoyama . . . 11152 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11152 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11152 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 471 11152 '15N chemical shifts' 113 11152 '1H chemical shifts' 740 11152 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 . . 2011-05-05 2010-04-15 original author . 11152 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2YRZ 'BMRB Entry Tracking System' 11152 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11152 _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 'Solution structure of the fibronectin type III domain of human Integrin beta-4' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _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 . _Citation.Page_last . _Citation.Year . _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 H. Abe . . . 11152 1 2 A. Sasagawa . . . 11152 1 3 N. Tochio . . . 11152 1 4 S. Koshiba . . . 11152 1 5 M. Inoue . . . 11152 1 6 T. Kigawa . . . 11152 1 7 S. Yokoyama . . . 11152 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11152 _Assembly.ID 1 _Assembly.Name 'Integrin beta-4' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 fn3 1 $entity_1 A . yes native no no . . . 11152 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2yrz . . . . . . 11152 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11152 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name fn3 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGSHDSRLTAGVPDT PTRLVFSALGPTSLRVSWQE PRCERPLQGYSVEYQLLNGG ELHRLNIPNPAQTSVVVEDL LPNHSYVFRVRAQSQEGWGR EREGVITIESQVSGPSSG ; _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 118 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _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 2015-11-26 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 2YRZ . "Solution Structure Of The Fibronectin Type Iii Domain Of Human Integrin Beta-4" . . . . . 100.00 118 100.00 100.00 2.13e-77 . . . . 11152 1 2 no PDB 4WTW . "Crystal Structure Of The Third Fniii Domain Of Integrin Beta4" . . . . . 77.97 96 100.00 100.00 2.58e-59 . . . . 11152 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID fn3 . 11152 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 . GLY . 11152 1 2 . SER . 11152 1 3 . SER . 11152 1 4 . GLY . 11152 1 5 . SER . 11152 1 6 . SER . 11152 1 7 . GLY . 11152 1 8 . SER . 11152 1 9 . HIS . 11152 1 10 . ASP . 11152 1 11 . SER . 11152 1 12 . ARG . 11152 1 13 . LEU . 11152 1 14 . THR . 11152 1 15 . ALA . 11152 1 16 . GLY . 11152 1 17 . VAL . 11152 1 18 . PRO . 11152 1 19 . ASP . 11152 1 20 . THR . 11152 1 21 . PRO . 11152 1 22 . THR . 11152 1 23 . ARG . 11152 1 24 . LEU . 11152 1 25 . VAL . 11152 1 26 . PHE . 11152 1 27 . SER . 11152 1 28 . ALA . 11152 1 29 . LEU . 11152 1 30 . GLY . 11152 1 31 . PRO . 11152 1 32 . THR . 11152 1 33 . SER . 11152 1 34 . LEU . 11152 1 35 . ARG . 11152 1 36 . VAL . 11152 1 37 . SER . 11152 1 38 . TRP . 11152 1 39 . GLN . 11152 1 40 . GLU . 11152 1 41 . PRO . 11152 1 42 . ARG . 11152 1 43 . CYS . 11152 1 44 . GLU . 11152 1 45 . ARG . 11152 1 46 . PRO . 11152 1 47 . LEU . 11152 1 48 . GLN . 11152 1 49 . GLY . 11152 1 50 . TYR . 11152 1 51 . SER . 11152 1 52 . VAL . 11152 1 53 . GLU . 11152 1 54 . TYR . 11152 1 55 . GLN . 11152 1 56 . LEU . 11152 1 57 . LEU . 11152 1 58 . ASN . 11152 1 59 . GLY . 11152 1 60 . GLY . 11152 1 61 . GLU . 11152 1 62 . LEU . 11152 1 63 . HIS . 11152 1 64 . ARG . 11152 1 65 . LEU . 11152 1 66 . ASN . 11152 1 67 . ILE . 11152 1 68 . PRO . 11152 1 69 . ASN . 11152 1 70 . PRO . 11152 1 71 . ALA . 11152 1 72 . GLN . 11152 1 73 . THR . 11152 1 74 . SER . 11152 1 75 . VAL . 11152 1 76 . VAL . 11152 1 77 . VAL . 11152 1 78 . GLU . 11152 1 79 . ASP . 11152 1 80 . LEU . 11152 1 81 . LEU . 11152 1 82 . PRO . 11152 1 83 . ASN . 11152 1 84 . HIS . 11152 1 85 . SER . 11152 1 86 . TYR . 11152 1 87 . VAL . 11152 1 88 . PHE . 11152 1 89 . ARG . 11152 1 90 . VAL . 11152 1 91 . ARG . 11152 1 92 . ALA . 11152 1 93 . GLN . 11152 1 94 . SER . 11152 1 95 . GLN . 11152 1 96 . GLU . 11152 1 97 . GLY . 11152 1 98 . TRP . 11152 1 99 . GLY . 11152 1 100 . ARG . 11152 1 101 . GLU . 11152 1 102 . ARG . 11152 1 103 . GLU . 11152 1 104 . GLY . 11152 1 105 . VAL . 11152 1 106 . ILE . 11152 1 107 . THR . 11152 1 108 . ILE . 11152 1 109 . GLU . 11152 1 110 . SER . 11152 1 111 . GLN . 11152 1 112 . VAL . 11152 1 113 . SER . 11152 1 114 . GLY . 11152 1 115 . PRO . 11152 1 116 . SER . 11152 1 117 . SER . 11152 1 118 . GLY . 11152 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11152 1 . SER 2 2 11152 1 . SER 3 3 11152 1 . GLY 4 4 11152 1 . SER 5 5 11152 1 . SER 6 6 11152 1 . GLY 7 7 11152 1 . SER 8 8 11152 1 . HIS 9 9 11152 1 . ASP 10 10 11152 1 . SER 11 11 11152 1 . ARG 12 12 11152 1 . LEU 13 13 11152 1 . THR 14 14 11152 1 . ALA 15 15 11152 1 . GLY 16 16 11152 1 . VAL 17 17 11152 1 . PRO 18 18 11152 1 . ASP 19 19 11152 1 . THR 20 20 11152 1 . PRO 21 21 11152 1 . THR 22 22 11152 1 . ARG 23 23 11152 1 . LEU 24 24 11152 1 . VAL 25 25 11152 1 . PHE 26 26 11152 1 . SER 27 27 11152 1 . ALA 28 28 11152 1 . LEU 29 29 11152 1 . GLY 30 30 11152 1 . PRO 31 31 11152 1 . THR 32 32 11152 1 . SER 33 33 11152 1 . LEU 34 34 11152 1 . ARG 35 35 11152 1 . VAL 36 36 11152 1 . SER 37 37 11152 1 . TRP 38 38 11152 1 . GLN 39 39 11152 1 . GLU 40 40 11152 1 . PRO 41 41 11152 1 . ARG 42 42 11152 1 . CYS 43 43 11152 1 . GLU 44 44 11152 1 . ARG 45 45 11152 1 . PRO 46 46 11152 1 . LEU 47 47 11152 1 . GLN 48 48 11152 1 . GLY 49 49 11152 1 . TYR 50 50 11152 1 . SER 51 51 11152 1 . VAL 52 52 11152 1 . GLU 53 53 11152 1 . TYR 54 54 11152 1 . GLN 55 55 11152 1 . LEU 56 56 11152 1 . LEU 57 57 11152 1 . ASN 58 58 11152 1 . GLY 59 59 11152 1 . GLY 60 60 11152 1 . GLU 61 61 11152 1 . LEU 62 62 11152 1 . HIS 63 63 11152 1 . ARG 64 64 11152 1 . LEU 65 65 11152 1 . ASN 66 66 11152 1 . ILE 67 67 11152 1 . PRO 68 68 11152 1 . ASN 69 69 11152 1 . PRO 70 70 11152 1 . ALA 71 71 11152 1 . GLN 72 72 11152 1 . THR 73 73 11152 1 . SER 74 74 11152 1 . VAL 75 75 11152 1 . VAL 76 76 11152 1 . VAL 77 77 11152 1 . GLU 78 78 11152 1 . ASP 79 79 11152 1 . LEU 80 80 11152 1 . LEU 81 81 11152 1 . PRO 82 82 11152 1 . ASN 83 83 11152 1 . HIS 84 84 11152 1 . SER 85 85 11152 1 . TYR 86 86 11152 1 . VAL 87 87 11152 1 . PHE 88 88 11152 1 . ARG 89 89 11152 1 . VAL 90 90 11152 1 . ARG 91 91 11152 1 . ALA 92 92 11152 1 . GLN 93 93 11152 1 . SER 94 94 11152 1 . GLN 95 95 11152 1 . GLU 96 96 11152 1 . GLY 97 97 11152 1 . TRP 98 98 11152 1 . GLY 99 99 11152 1 . ARG 100 100 11152 1 . GLU 101 101 11152 1 . ARG 102 102 11152 1 . GLU 103 103 11152 1 . GLY 104 104 11152 1 . VAL 105 105 11152 1 . ILE 106 106 11152 1 . THR 107 107 11152 1 . ILE 108 108 11152 1 . GLU 109 109 11152 1 . SER 110 110 11152 1 . GLN 111 111 11152 1 . VAL 112 112 11152 1 . SER 113 113 11152 1 . GLY 114 114 11152 1 . PRO 115 115 11152 1 . SER 116 116 11152 1 . SER 117 117 11152 1 . GLY 118 118 11152 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 11152 _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 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11152 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 11152 _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 $entity_1 . 'cell free synthesis' 'E. coli - cell free' . . 562 Escherichia coli . . . . . . . . . . . . . . . . P050322-10 . . . . . . 11152 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11152 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.21mM sample {U-15N,13C;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 90% H2O, 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 fn3 '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.21 . . mM . . . . 11152 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11152 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11152 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11152 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11152 1 6 H2O . . . . . . solvent 90 . . % . . . . 11152 1 7 D2O . . . . . . solvent 10 . . % . . . . 11152 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11152 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 0.1 mM 11152 1 pH 7.0 0.05 pH 11152 1 pressure 1 0.001 atm 11152 1 temperature 296 0.1 K 11152 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11152 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11152 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11152 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11152 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11152 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11152 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11152 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11152 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11152 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11152 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11152 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11152 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11152 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11152 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11152 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11152 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11152 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 900 . . . 11152 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 11152 _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 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11152 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11152 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11152 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 . . . . . . . . . 11152 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11152 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11152 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11152 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11152 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11152 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11152 1 2 $NMRPipe . . 11152 1 3 $NMRVIEW . . 11152 1 4 $Kujira . . 11152 1 5 $CYANA . . 11152 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 9 9 HIS HA H 1 4.599 0.030 . 1 . . . . 9 HIS HA . 11152 1 2 . 1 1 9 9 HIS HB2 H 1 3.133 0.030 . 2 . . . . 9 HIS HB2 . 11152 1 3 . 1 1 9 9 HIS HB3 H 1 3.055 0.030 . 2 . . . . 9 HIS HB3 . 11152 1 4 . 1 1 9 9 HIS HD2 H 1 6.999 0.030 . 1 . . . . 9 HIS HD2 . 11152 1 5 . 1 1 9 9 HIS HE1 H 1 7.841 0.030 . 1 . . . . 9 HIS HE1 . 11152 1 6 . 1 1 9 9 HIS C C 13 175.204 0.300 . 1 . . . . 9 HIS C . 11152 1 7 . 1 1 9 9 HIS CA C 13 56.639 0.300 . 1 . . . . 9 HIS CA . 11152 1 8 . 1 1 9 9 HIS CB C 13 30.786 0.300 . 1 . . . . 9 HIS CB . 11152 1 9 . 1 1 9 9 HIS CD2 C 13 119.925 0.300 . 1 . . . . 9 HIS CD2 . 11152 1 10 . 1 1 9 9 HIS CE1 C 13 138.334 0.300 . 1 . . . . 9 HIS CE1 . 11152 1 11 . 1 1 10 10 ASP H H 1 8.249 0.030 . 1 . . . . 10 ASP H . 11152 1 12 . 1 1 10 10 ASP HA H 1 4.590 0.030 . 1 . . . . 10 ASP HA . 11152 1 13 . 1 1 10 10 ASP HB2 H 1 2.700 0.030 . 2 . . . . 10 ASP HB2 . 11152 1 14 . 1 1 10 10 ASP HB3 H 1 2.584 0.030 . 2 . . . . 10 ASP HB3 . 11152 1 15 . 1 1 10 10 ASP C C 13 176.524 0.300 . 1 . . . . 10 ASP C . 11152 1 16 . 1 1 10 10 ASP CA C 13 54.280 0.300 . 1 . . . . 10 ASP CA . 11152 1 17 . 1 1 10 10 ASP CB C 13 41.209 0.300 . 1 . . . . 10 ASP CB . 11152 1 18 . 1 1 10 10 ASP N N 15 121.721 0.300 . 1 . . . . 10 ASP N . 11152 1 19 . 1 1 11 11 SER H H 1 8.362 0.030 . 1 . . . . 11 SER H . 11152 1 20 . 1 1 11 11 SER HA H 1 4.372 0.030 . 1 . . . . 11 SER HA . 11152 1 21 . 1 1 11 11 SER HB2 H 1 3.931 0.030 . 2 . . . . 11 SER HB2 . 11152 1 22 . 1 1 11 11 SER HB3 H 1 3.874 0.030 . 2 . . . . 11 SER HB3 . 11152 1 23 . 1 1 11 11 SER C C 13 174.900 0.300 . 1 . . . . 11 SER C . 11152 1 24 . 1 1 11 11 SER CA C 13 58.957 0.300 . 1 . . . . 11 SER CA . 11152 1 25 . 1 1 11 11 SER CB C 13 63.627 0.300 . 1 . . . . 11 SER CB . 11152 1 26 . 1 1 11 11 SER N N 15 117.672 0.300 . 1 . . . . 11 SER N . 11152 1 27 . 1 1 12 12 ARG H H 1 8.323 0.030 . 1 . . . . 12 ARG H . 11152 1 28 . 1 1 12 12 ARG HA H 1 4.280 0.030 . 1 . . . . 12 ARG HA . 11152 1 29 . 1 1 12 12 ARG HB2 H 1 1.854 0.030 . 2 . . . . 12 ARG HB2 . 11152 1 30 . 1 1 12 12 ARG HB3 H 1 1.791 0.030 . 2 . . . . 12 ARG HB3 . 11152 1 31 . 1 1 12 12 ARG HD2 H 1 3.188 0.030 . 1 . . . . 12 ARG HD2 . 11152 1 32 . 1 1 12 12 ARG HD3 H 1 3.188 0.030 . 1 . . . . 12 ARG HD3 . 11152 1 33 . 1 1 12 12 ARG HG2 H 1 1.623 0.030 . 1 . . . . 12 ARG HG2 . 11152 1 34 . 1 1 12 12 ARG HG3 H 1 1.623 0.030 . 1 . . . . 12 ARG HG3 . 11152 1 35 . 1 1 12 12 ARG C C 13 176.718 0.300 . 1 . . . . 12 ARG C . 11152 1 36 . 1 1 12 12 ARG CA C 13 56.645 0.300 . 1 . . . . 12 ARG CA . 11152 1 37 . 1 1 12 12 ARG CB C 13 30.478 0.300 . 1 . . . . 12 ARG CB . 11152 1 38 . 1 1 12 12 ARG CD C 13 43.399 0.300 . 1 . . . . 12 ARG CD . 11152 1 39 . 1 1 12 12 ARG CG C 13 27.051 0.300 . 1 . . . . 12 ARG CG . 11152 1 40 . 1 1 12 12 ARG N N 15 122.414 0.300 . 1 . . . . 12 ARG N . 11152 1 41 . 1 1 13 13 LEU H H 1 8.226 0.030 . 1 . . . . 13 LEU H . 11152 1 42 . 1 1 13 13 LEU HA H 1 4.371 0.030 . 1 . . . . 13 LEU HA . 11152 1 43 . 1 1 13 13 LEU HB2 H 1 1.682 0.030 . 2 . . . . 13 LEU HB2 . 11152 1 44 . 1 1 13 13 LEU HB3 H 1 1.603 0.030 . 2 . . . . 13 LEU HB3 . 11152 1 45 . 1 1 13 13 LEU HD11 H 1 0.921 0.030 . 1 . . . . 13 LEU HD1 . 11152 1 46 . 1 1 13 13 LEU HD12 H 1 0.921 0.030 . 1 . . . . 13 LEU HD1 . 11152 1 47 . 1 1 13 13 LEU HD13 H 1 0.921 0.030 . 1 . . . . 13 LEU HD1 . 11152 1 48 . 1 1 13 13 LEU HD21 H 1 0.854 0.030 . 1 . . . . 13 LEU HD2 . 11152 1 49 . 1 1 13 13 LEU HD22 H 1 0.854 0.030 . 1 . . . . 13 LEU HD2 . 11152 1 50 . 1 1 13 13 LEU HD23 H 1 0.854 0.030 . 1 . . . . 13 LEU HD2 . 11152 1 51 . 1 1 13 13 LEU HG H 1 1.622 0.030 . 1 . . . . 13 LEU HG . 11152 1 52 . 1 1 13 13 LEU C C 13 177.916 0.300 . 1 . . . . 13 LEU C . 11152 1 53 . 1 1 13 13 LEU CA C 13 55.591 0.300 . 1 . . . . 13 LEU CA . 11152 1 54 . 1 1 13 13 LEU CB C 13 42.210 0.300 . 1 . . . . 13 LEU CB . 11152 1 55 . 1 1 13 13 LEU CD1 C 13 25.017 0.300 . 2 . . . . 13 LEU CD1 . 11152 1 56 . 1 1 13 13 LEU CD2 C 13 23.430 0.300 . 2 . . . . 13 LEU CD2 . 11152 1 57 . 1 1 13 13 LEU CG C 13 27.039 0.300 . 1 . . . . 13 LEU CG . 11152 1 58 . 1 1 13 13 LEU N N 15 122.508 0.300 . 1 . . . . 13 LEU N . 11152 1 59 . 1 1 14 14 THR H H 1 7.968 0.030 . 1 . . . . 14 THR H . 11152 1 60 . 1 1 14 14 THR HA H 1 4.297 0.030 . 1 . . . . 14 THR HA . 11152 1 61 . 1 1 14 14 THR HB H 1 4.230 0.030 . 1 . . . . 14 THR HB . 11152 1 62 . 1 1 14 14 THR HG21 H 1 1.182 0.030 . 1 . . . . 14 THR HG2 . 11152 1 63 . 1 1 14 14 THR HG22 H 1 1.182 0.030 . 1 . . . . 14 THR HG2 . 11152 1 64 . 1 1 14 14 THR HG23 H 1 1.182 0.030 . 1 . . . . 14 THR HG2 . 11152 1 65 . 1 1 14 14 THR C C 13 174.478 0.300 . 1 . . . . 14 THR C . 11152 1 66 . 1 1 14 14 THR CA C 13 61.850 0.300 . 1 . . . . 14 THR CA . 11152 1 67 . 1 1 14 14 THR CB C 13 69.711 0.300 . 1 . . . . 14 THR CB . 11152 1 68 . 1 1 14 14 THR CG2 C 13 21.698 0.300 . 1 . . . . 14 THR CG2 . 11152 1 69 . 1 1 14 14 THR N N 15 114.548 0.300 . 1 . . . . 14 THR N . 11152 1 70 . 1 1 15 15 ALA H H 1 8.269 0.030 . 1 . . . . 15 ALA H . 11152 1 71 . 1 1 15 15 ALA HA H 1 4.268 0.030 . 1 . . . . 15 ALA HA . 11152 1 72 . 1 1 15 15 ALA HB1 H 1 1.386 0.030 . 1 . . . . 15 ALA HB . 11152 1 73 . 1 1 15 15 ALA HB2 H 1 1.386 0.030 . 1 . . . . 15 ALA HB . 11152 1 74 . 1 1 15 15 ALA HB3 H 1 1.386 0.030 . 1 . . . . 15 ALA HB . 11152 1 75 . 1 1 15 15 ALA C C 13 178.125 0.300 . 1 . . . . 15 ALA C . 11152 1 76 . 1 1 15 15 ALA CA C 13 53.214 0.300 . 1 . . . . 15 ALA CA . 11152 1 77 . 1 1 15 15 ALA CB C 13 19.000 0.300 . 1 . . . . 15 ALA CB . 11152 1 78 . 1 1 15 15 ALA N N 15 125.385 0.300 . 1 . . . . 15 ALA N . 11152 1 79 . 1 1 16 16 GLY H H 1 8.500 0.030 . 1 . . . . 16 GLY H . 11152 1 80 . 1 1 16 16 GLY HA2 H 1 3.821 0.030 . 2 . . . . 16 GLY HA2 . 11152 1 81 . 1 1 16 16 GLY HA3 H 1 3.698 0.030 . 2 . . . . 16 GLY HA3 . 11152 1 82 . 1 1 16 16 GLY C C 13 173.754 0.300 . 1 . . . . 16 GLY C . 11152 1 83 . 1 1 16 16 GLY CA C 13 45.976 0.300 . 1 . . . . 16 GLY CA . 11152 1 84 . 1 1 16 16 GLY N N 15 107.031 0.300 . 1 . . . . 16 GLY N . 11152 1 85 . 1 1 17 17 VAL H H 1 7.433 0.030 . 1 . . . . 17 VAL H . 11152 1 86 . 1 1 17 17 VAL HA H 1 4.148 0.030 . 1 . . . . 17 VAL HA . 11152 1 87 . 1 1 17 17 VAL HB H 1 1.918 0.030 . 1 . . . . 17 VAL HB . 11152 1 88 . 1 1 17 17 VAL HG11 H 1 0.805 0.030 . 1 . . . . 17 VAL HG1 . 11152 1 89 . 1 1 17 17 VAL HG12 H 1 0.805 0.030 . 1 . . . . 17 VAL HG1 . 11152 1 90 . 1 1 17 17 VAL HG13 H 1 0.805 0.030 . 1 . . . . 17 VAL HG1 . 11152 1 91 . 1 1 17 17 VAL C C 13 174.359 0.300 . 1 . . . . 17 VAL C . 11152 1 92 . 1 1 17 17 VAL CA C 13 59.709 0.300 . 1 . . . . 17 VAL CA . 11152 1 93 . 1 1 17 17 VAL CB C 13 32.308 0.300 . 1 . . . . 17 VAL CB . 11152 1 94 . 1 1 17 17 VAL CG1 C 13 20.750 0.300 . 1 . . . . 17 VAL CG1 . 11152 1 95 . 1 1 17 17 VAL CG2 C 13 20.750 0.300 . 1 . . . . 17 VAL CG2 . 11152 1 96 . 1 1 17 17 VAL N N 15 119.481 0.300 . 1 . . . . 17 VAL N . 11152 1 97 . 1 1 18 18 PRO HA H 1 4.435 0.030 . 1 . . . . 18 PRO HA . 11152 1 98 . 1 1 18 18 PRO HB2 H 1 2.093 0.030 . 2 . . . . 18 PRO HB2 . 11152 1 99 . 1 1 18 18 PRO HB3 H 1 2.029 0.030 . 2 . . . . 18 PRO HB3 . 11152 1 100 . 1 1 18 18 PRO HD2 H 1 3.463 0.030 . 2 . . . . 18 PRO HD2 . 11152 1 101 . 1 1 18 18 PRO HD3 H 1 3.918 0.030 . 2 . . . . 18 PRO HD3 . 11152 1 102 . 1 1 18 18 PRO HG2 H 1 1.806 0.030 . 2 . . . . 18 PRO HG2 . 11152 1 103 . 1 1 18 18 PRO HG3 H 1 1.655 0.030 . 2 . . . . 18 PRO HG3 . 11152 1 104 . 1 1 18 18 PRO C C 13 175.449 0.300 . 1 . . . . 18 PRO C . 11152 1 105 . 1 1 18 18 PRO CA C 13 63.473 0.300 . 1 . . . . 18 PRO CA . 11152 1 106 . 1 1 18 18 PRO CB C 13 33.612 0.300 . 1 . . . . 18 PRO CB . 11152 1 107 . 1 1 18 18 PRO CD C 13 51.101 0.300 . 1 . . . . 18 PRO CD . 11152 1 108 . 1 1 18 18 PRO CG C 13 28.639 0.300 . 1 . . . . 18 PRO CG . 11152 1 109 . 1 1 19 19 ASP H H 1 8.132 0.030 . 1 . . . . 19 ASP H . 11152 1 110 . 1 1 19 19 ASP HA H 1 4.694 0.030 . 1 . . . . 19 ASP HA . 11152 1 111 . 1 1 19 19 ASP HB2 H 1 2.978 0.030 . 2 . . . . 19 ASP HB2 . 11152 1 112 . 1 1 19 19 ASP HB3 H 1 2.770 0.030 . 2 . . . . 19 ASP HB3 . 11152 1 113 . 1 1 19 19 ASP C C 13 174.892 0.300 . 1 . . . . 19 ASP C . 11152 1 114 . 1 1 19 19 ASP CA C 13 53.072 0.300 . 1 . . . . 19 ASP CA . 11152 1 115 . 1 1 19 19 ASP CB C 13 41.911 0.300 . 1 . . . . 19 ASP CB . 11152 1 116 . 1 1 19 19 ASP N N 15 118.619 0.300 . 1 . . . . 19 ASP N . 11152 1 117 . 1 1 20 20 THR H H 1 8.778 0.030 . 1 . . . . 20 THR H . 11152 1 118 . 1 1 20 20 THR HA H 1 4.507 0.030 . 1 . . . . 20 THR HA . 11152 1 119 . 1 1 20 20 THR HB H 1 3.989 0.030 . 1 . . . . 20 THR HB . 11152 1 120 . 1 1 20 20 THR HG21 H 1 1.235 0.030 . 1 . . . . 20 THR HG2 . 11152 1 121 . 1 1 20 20 THR HG22 H 1 1.235 0.030 . 1 . . . . 20 THR HG2 . 11152 1 122 . 1 1 20 20 THR HG23 H 1 1.235 0.030 . 1 . . . . 20 THR HG2 . 11152 1 123 . 1 1 20 20 THR C C 13 174.589 0.300 . 1 . . . . 20 THR C . 11152 1 124 . 1 1 20 20 THR CA C 13 60.474 0.300 . 1 . . . . 20 THR CA . 11152 1 125 . 1 1 20 20 THR CB C 13 69.964 0.300 . 1 . . . . 20 THR CB . 11152 1 126 . 1 1 20 20 THR CG2 C 13 21.692 0.300 . 1 . . . . 20 THR CG2 . 11152 1 127 . 1 1 20 20 THR N N 15 115.208 0.300 . 1 . . . . 20 THR N . 11152 1 128 . 1 1 21 21 PRO HA H 1 4.610 0.030 . 1 . . . . 21 PRO HA . 11152 1 129 . 1 1 21 21 PRO HB2 H 1 2.492 0.030 . 2 . . . . 21 PRO HB2 . 11152 1 130 . 1 1 21 21 PRO HB3 H 1 1.622 0.030 . 2 . . . . 21 PRO HB3 . 11152 1 131 . 1 1 21 21 PRO HD2 H 1 4.520 0.030 . 2 . . . . 21 PRO HD2 . 11152 1 132 . 1 1 21 21 PRO HD3 H 1 3.676 0.030 . 2 . . . . 21 PRO HD3 . 11152 1 133 . 1 1 21 21 PRO HG2 H 1 1.802 0.030 . 2 . . . . 21 PRO HG2 . 11152 1 134 . 1 1 21 21 PRO HG3 H 1 1.626 0.030 . 2 . . . . 21 PRO HG3 . 11152 1 135 . 1 1 21 21 PRO C C 13 175.796 0.300 . 1 . . . . 21 PRO C . 11152 1 136 . 1 1 21 21 PRO CA C 13 63.305 0.300 . 1 . . . . 21 PRO CA . 11152 1 137 . 1 1 21 21 PRO CB C 13 31.772 0.300 . 1 . . . . 21 PRO CB . 11152 1 138 . 1 1 21 21 PRO CD C 13 50.879 0.300 . 1 . . . . 21 PRO CD . 11152 1 139 . 1 1 21 21 PRO CG C 13 28.077 0.300 . 1 . . . . 21 PRO CG . 11152 1 140 . 1 1 22 22 THR H H 1 8.081 0.030 . 1 . . . . 22 THR H . 11152 1 141 . 1 1 22 22 THR HA H 1 4.257 0.030 . 1 . . . . 22 THR HA . 11152 1 142 . 1 1 22 22 THR HB H 1 4.351 0.030 . 1 . . . . 22 THR HB . 11152 1 143 . 1 1 22 22 THR HG21 H 1 1.277 0.030 . 1 . . . . 22 THR HG2 . 11152 1 144 . 1 1 22 22 THR HG22 H 1 1.277 0.030 . 1 . . . . 22 THR HG2 . 11152 1 145 . 1 1 22 22 THR HG23 H 1 1.277 0.030 . 1 . . . . 22 THR HG2 . 11152 1 146 . 1 1 22 22 THR C C 13 172.929 0.300 . 1 . . . . 22 THR C . 11152 1 147 . 1 1 22 22 THR CA C 13 62.589 0.300 . 1 . . . . 22 THR CA . 11152 1 148 . 1 1 22 22 THR CB C 13 70.219 0.300 . 1 . . . . 22 THR CB . 11152 1 149 . 1 1 22 22 THR CG2 C 13 22.443 0.300 . 1 . . . . 22 THR CG2 . 11152 1 150 . 1 1 22 22 THR N N 15 113.636 0.300 . 1 . . . . 22 THR N . 11152 1 151 . 1 1 23 23 ARG H H 1 8.023 0.030 . 1 . . . . 23 ARG H . 11152 1 152 . 1 1 23 23 ARG HA H 1 3.944 0.030 . 1 . . . . 23 ARG HA . 11152 1 153 . 1 1 23 23 ARG HB2 H 1 1.818 0.030 . 2 . . . . 23 ARG HB2 . 11152 1 154 . 1 1 23 23 ARG HB3 H 1 1.701 0.030 . 2 . . . . 23 ARG HB3 . 11152 1 155 . 1 1 23 23 ARG HD2 H 1 3.161 0.030 . 1 . . . . 23 ARG HD2 . 11152 1 156 . 1 1 23 23 ARG HD3 H 1 3.161 0.030 . 1 . . . . 23 ARG HD3 . 11152 1 157 . 1 1 23 23 ARG HG2 H 1 1.560 0.030 . 1 . . . . 23 ARG HG2 . 11152 1 158 . 1 1 23 23 ARG HG3 H 1 1.560 0.030 . 1 . . . . 23 ARG HG3 . 11152 1 159 . 1 1 23 23 ARG C C 13 174.622 0.300 . 1 . . . . 23 ARG C . 11152 1 160 . 1 1 23 23 ARG CA C 13 56.552 0.300 . 1 . . . . 23 ARG CA . 11152 1 161 . 1 1 23 23 ARG CB C 13 30.930 0.300 . 1 . . . . 23 ARG CB . 11152 1 162 . 1 1 23 23 ARG CD C 13 43.477 0.300 . 1 . . . . 23 ARG CD . 11152 1 163 . 1 1 23 23 ARG CG C 13 27.043 0.300 . 1 . . . . 23 ARG CG . 11152 1 164 . 1 1 23 23 ARG N N 15 115.516 0.300 . 1 . . . . 23 ARG N . 11152 1 165 . 1 1 24 24 LEU H H 1 8.109 0.030 . 1 . . . . 24 LEU H . 11152 1 166 . 1 1 24 24 LEU HA H 1 4.668 0.030 . 1 . . . . 24 LEU HA . 11152 1 167 . 1 1 24 24 LEU HB2 H 1 1.246 0.030 . 2 . . . . 24 LEU HB2 . 11152 1 168 . 1 1 24 24 LEU HB3 H 1 0.874 0.030 . 2 . . . . 24 LEU HB3 . 11152 1 169 . 1 1 24 24 LEU HD11 H 1 0.713 0.030 . 1 . . . . 24 LEU HD1 . 11152 1 170 . 1 1 24 24 LEU HD12 H 1 0.713 0.030 . 1 . . . . 24 LEU HD1 . 11152 1 171 . 1 1 24 24 LEU HD13 H 1 0.713 0.030 . 1 . . . . 24 LEU HD1 . 11152 1 172 . 1 1 24 24 LEU HD21 H 1 0.666 0.030 . 1 . . . . 24 LEU HD2 . 11152 1 173 . 1 1 24 24 LEU HD22 H 1 0.666 0.030 . 1 . . . . 24 LEU HD2 . 11152 1 174 . 1 1 24 24 LEU HD23 H 1 0.666 0.030 . 1 . . . . 24 LEU HD2 . 11152 1 175 . 1 1 24 24 LEU HG H 1 1.330 0.030 . 1 . . . . 24 LEU HG . 11152 1 176 . 1 1 24 24 LEU C C 13 176.195 0.300 . 1 . . . . 24 LEU C . 11152 1 177 . 1 1 24 24 LEU CA C 13 54.452 0.300 . 1 . . . . 24 LEU CA . 11152 1 178 . 1 1 24 24 LEU CB C 13 42.153 0.300 . 1 . . . . 24 LEU CB . 11152 1 179 . 1 1 24 24 LEU CD1 C 13 25.590 0.300 . 2 . . . . 24 LEU CD1 . 11152 1 180 . 1 1 24 24 LEU CD2 C 13 23.465 0.300 . 2 . . . . 24 LEU CD2 . 11152 1 181 . 1 1 24 24 LEU CG C 13 27.212 0.300 . 1 . . . . 24 LEU CG . 11152 1 182 . 1 1 24 24 LEU N N 15 121.254 0.300 . 1 . . . . 24 LEU N . 11152 1 183 . 1 1 25 25 VAL H H 1 8.780 0.030 . 1 . . . . 25 VAL H . 11152 1 184 . 1 1 25 25 VAL HA H 1 4.053 0.030 . 1 . . . . 25 VAL HA . 11152 1 185 . 1 1 25 25 VAL HB H 1 1.744 0.030 . 1 . . . . 25 VAL HB . 11152 1 186 . 1 1 25 25 VAL HG11 H 1 0.746 0.030 . 1 . . . . 25 VAL HG1 . 11152 1 187 . 1 1 25 25 VAL HG12 H 1 0.746 0.030 . 1 . . . . 25 VAL HG1 . 11152 1 188 . 1 1 25 25 VAL HG13 H 1 0.746 0.030 . 1 . . . . 25 VAL HG1 . 11152 1 189 . 1 1 25 25 VAL C C 13 174.355 0.300 . 1 . . . . 25 VAL C . 11152 1 190 . 1 1 25 25 VAL CA C 13 61.282 0.300 . 1 . . . . 25 VAL CA . 11152 1 191 . 1 1 25 25 VAL CB C 13 34.084 0.300 . 1 . . . . 25 VAL CB . 11152 1 192 . 1 1 25 25 VAL CG1 C 13 21.065 0.300 . 1 . . . . 25 VAL CG1 . 11152 1 193 . 1 1 25 25 VAL CG2 C 13 21.065 0.300 . 1 . . . . 25 VAL CG2 . 11152 1 194 . 1 1 25 25 VAL N N 15 124.799 0.300 . 1 . . . . 25 VAL N . 11152 1 195 . 1 1 26 26 PHE H H 1 8.716 0.030 . 1 . . . . 26 PHE H . 11152 1 196 . 1 1 26 26 PHE HA H 1 5.268 0.030 . 1 . . . . 26 PHE HA . 11152 1 197 . 1 1 26 26 PHE HB2 H 1 2.847 0.030 . 2 . . . . 26 PHE HB2 . 11152 1 198 . 1 1 26 26 PHE HB3 H 1 2.723 0.030 . 2 . . . . 26 PHE HB3 . 11152 1 199 . 1 1 26 26 PHE HD1 H 1 6.934 0.030 . 1 . . . . 26 PHE HD1 . 11152 1 200 . 1 1 26 26 PHE HD2 H 1 6.934 0.030 . 1 . . . . 26 PHE HD2 . 11152 1 201 . 1 1 26 26 PHE HE1 H 1 6.572 0.030 . 1 . . . . 26 PHE HE1 . 11152 1 202 . 1 1 26 26 PHE HE2 H 1 6.572 0.030 . 1 . . . . 26 PHE HE2 . 11152 1 203 . 1 1 26 26 PHE HZ H 1 6.808 0.030 . 1 . . . . 26 PHE HZ . 11152 1 204 . 1 1 26 26 PHE C C 13 176.094 0.300 . 1 . . . . 26 PHE C . 11152 1 205 . 1 1 26 26 PHE CA C 13 56.223 0.300 . 1 . . . . 26 PHE CA . 11152 1 206 . 1 1 26 26 PHE CB C 13 42.325 0.300 . 1 . . . . 26 PHE CB . 11152 1 207 . 1 1 26 26 PHE CD1 C 13 131.974 0.300 . 1 . . . . 26 PHE CD1 . 11152 1 208 . 1 1 26 26 PHE CD2 C 13 131.974 0.300 . 1 . . . . 26 PHE CD2 . 11152 1 209 . 1 1 26 26 PHE CE1 C 13 130.932 0.300 . 1 . . . . 26 PHE CE1 . 11152 1 210 . 1 1 26 26 PHE CE2 C 13 130.932 0.300 . 1 . . . . 26 PHE CE2 . 11152 1 211 . 1 1 26 26 PHE CZ C 13 128.080 0.300 . 1 . . . . 26 PHE CZ . 11152 1 212 . 1 1 26 26 PHE N N 15 124.616 0.300 . 1 . . . . 26 PHE N . 11152 1 213 . 1 1 27 27 SER H H 1 8.909 0.030 . 1 . . . . 27 SER H . 11152 1 214 . 1 1 27 27 SER HA H 1 4.762 0.030 . 1 . . . . 27 SER HA . 11152 1 215 . 1 1 27 27 SER HB2 H 1 3.592 0.030 . 2 . . . . 27 SER HB2 . 11152 1 216 . 1 1 27 27 SER HB3 H 1 3.738 0.030 . 2 . . . . 27 SER HB3 . 11152 1 217 . 1 1 27 27 SER C C 13 173.084 0.300 . 1 . . . . 27 SER C . 11152 1 218 . 1 1 27 27 SER CA C 13 56.823 0.300 . 1 . . . . 27 SER CA . 11152 1 219 . 1 1 27 27 SER CB C 13 64.713 0.300 . 1 . . . . 27 SER CB . 11152 1 220 . 1 1 27 27 SER N N 15 117.000 0.300 . 1 . . . . 27 SER N . 11152 1 221 . 1 1 28 28 ALA H H 1 9.073 0.030 . 1 . . . . 28 ALA H . 11152 1 222 . 1 1 28 28 ALA HA H 1 4.462 0.030 . 1 . . . . 28 ALA HA . 11152 1 223 . 1 1 28 28 ALA HB1 H 1 1.457 0.030 . 1 . . . . 28 ALA HB . 11152 1 224 . 1 1 28 28 ALA HB2 H 1 1.457 0.030 . 1 . . . . 28 ALA HB . 11152 1 225 . 1 1 28 28 ALA HB3 H 1 1.457 0.030 . 1 . . . . 28 ALA HB . 11152 1 226 . 1 1 28 28 ALA C C 13 177.510 0.300 . 1 . . . . 28 ALA C . 11152 1 227 . 1 1 28 28 ALA CA C 13 53.433 0.300 . 1 . . . . 28 ALA CA . 11152 1 228 . 1 1 28 28 ALA CB C 13 18.754 0.300 . 1 . . . . 28 ALA CB . 11152 1 229 . 1 1 28 28 ALA N N 15 130.106 0.300 . 1 . . . . 28 ALA N . 11152 1 230 . 1 1 29 29 LEU H H 1 8.087 0.030 . 1 . . . . 29 LEU H . 11152 1 231 . 1 1 29 29 LEU HA H 1 4.493 0.030 . 1 . . . . 29 LEU HA . 11152 1 232 . 1 1 29 29 LEU HB2 H 1 1.502 0.030 . 2 . . . . 29 LEU HB2 . 11152 1 233 . 1 1 29 29 LEU HB3 H 1 1.383 0.030 . 2 . . . . 29 LEU HB3 . 11152 1 234 . 1 1 29 29 LEU HD11 H 1 0.739 0.030 . 1 . . . . 29 LEU HD1 . 11152 1 235 . 1 1 29 29 LEU HD12 H 1 0.739 0.030 . 1 . . . . 29 LEU HD1 . 11152 1 236 . 1 1 29 29 LEU HD13 H 1 0.739 0.030 . 1 . . . . 29 LEU HD1 . 11152 1 237 . 1 1 29 29 LEU HD21 H 1 0.776 0.030 . 1 . . . . 29 LEU HD2 . 11152 1 238 . 1 1 29 29 LEU HD22 H 1 0.776 0.030 . 1 . . . . 29 LEU HD2 . 11152 1 239 . 1 1 29 29 LEU HD23 H 1 0.776 0.030 . 1 . . . . 29 LEU HD2 . 11152 1 240 . 1 1 29 29 LEU HG H 1 1.539 0.030 . 1 . . . . 29 LEU HG . 11152 1 241 . 1 1 29 29 LEU C C 13 176.382 0.300 . 1 . . . . 29 LEU C . 11152 1 242 . 1 1 29 29 LEU CA C 13 54.470 0.300 . 1 . . . . 29 LEU CA . 11152 1 243 . 1 1 29 29 LEU CB C 13 42.615 0.300 . 1 . . . . 29 LEU CB . 11152 1 244 . 1 1 29 29 LEU CD1 C 13 22.757 0.300 . 2 . . . . 29 LEU CD1 . 11152 1 245 . 1 1 29 29 LEU CD2 C 13 27.043 0.300 . 2 . . . . 29 LEU CD2 . 11152 1 246 . 1 1 29 29 LEU CG C 13 27.015 0.300 . 1 . . . . 29 LEU CG . 11152 1 247 . 1 1 29 29 LEU N N 15 124.411 0.300 . 1 . . . . 29 LEU N . 11152 1 248 . 1 1 30 30 GLY H H 1 7.935 0.030 . 1 . . . . 30 GLY H . 11152 1 249 . 1 1 30 30 GLY HA2 H 1 4.180 0.030 . 2 . . . . 30 GLY HA2 . 11152 1 250 . 1 1 30 30 GLY HA3 H 1 4.040 0.030 . 2 . . . . 30 GLY HA3 . 11152 1 251 . 1 1 30 30 GLY C C 13 171.179 0.300 . 1 . . . . 30 GLY C . 11152 1 252 . 1 1 30 30 GLY CA C 13 44.665 0.300 . 1 . . . . 30 GLY CA . 11152 1 253 . 1 1 30 30 GLY N N 15 108.594 0.300 . 1 . . . . 30 GLY N . 11152 1 254 . 1 1 31 31 PRO HA H 1 4.358 0.030 . 1 . . . . 31 PRO HA . 11152 1 255 . 1 1 31 31 PRO HB2 H 1 2.006 0.030 . 2 . . . . 31 PRO HB2 . 11152 1 256 . 1 1 31 31 PRO HB3 H 1 2.408 0.030 . 2 . . . . 31 PRO HB3 . 11152 1 257 . 1 1 31 31 PRO HD2 H 1 3.752 0.030 . 2 . . . . 31 PRO HD2 . 11152 1 258 . 1 1 31 31 PRO HD3 H 1 3.569 0.030 . 2 . . . . 31 PRO HD3 . 11152 1 259 . 1 1 31 31 PRO HG2 H 1 2.071 0.030 . 1 . . . . 31 PRO HG2 . 11152 1 260 . 1 1 31 31 PRO HG3 H 1 2.071 0.030 . 1 . . . . 31 PRO HG3 . 11152 1 261 . 1 1 31 31 PRO C C 13 176.400 0.300 . 1 . . . . 31 PRO C . 11152 1 262 . 1 1 31 31 PRO CA C 13 64.753 0.300 . 1 . . . . 31 PRO CA . 11152 1 263 . 1 1 31 31 PRO CB C 13 32.630 0.300 . 1 . . . . 31 PRO CB . 11152 1 264 . 1 1 31 31 PRO CD C 13 48.989 0.300 . 1 . . . . 31 PRO CD . 11152 1 265 . 1 1 31 31 PRO CG C 13 27.346 0.300 . 1 . . . . 31 PRO CG . 11152 1 266 . 1 1 32 32 THR H H 1 7.762 0.030 . 1 . . . . 32 THR H . 11152 1 267 . 1 1 32 32 THR HA H 1 4.516 0.030 . 1 . . . . 32 THR HA . 11152 1 268 . 1 1 32 32 THR HB H 1 4.900 0.030 . 1 . . . . 32 THR HB . 11152 1 269 . 1 1 32 32 THR HG21 H 1 1.101 0.030 . 1 . . . . 32 THR HG2 . 11152 1 270 . 1 1 32 32 THR HG22 H 1 1.101 0.030 . 1 . . . . 32 THR HG2 . 11152 1 271 . 1 1 32 32 THR HG23 H 1 1.101 0.030 . 1 . . . . 32 THR HG2 . 11152 1 272 . 1 1 32 32 THR C C 13 173.195 0.300 . 1 . . . . 32 THR C . 11152 1 273 . 1 1 32 32 THR CA C 13 59.466 0.300 . 1 . . . . 32 THR CA . 11152 1 274 . 1 1 32 32 THR CB C 13 70.767 0.300 . 1 . . . . 32 THR CB . 11152 1 275 . 1 1 32 32 THR CG2 C 13 21.386 0.300 . 1 . . . . 32 THR CG2 . 11152 1 276 . 1 1 32 32 THR N N 15 101.048 0.300 . 1 . . . . 32 THR N . 11152 1 277 . 1 1 33 33 SER H H 1 6.991 0.030 . 1 . . . . 33 SER H . 11152 1 278 . 1 1 33 33 SER HA H 1 5.459 0.030 . 1 . . . . 33 SER HA . 11152 1 279 . 1 1 33 33 SER HB2 H 1 3.645 0.030 . 2 . . . . 33 SER HB2 . 11152 1 280 . 1 1 33 33 SER HB3 H 1 3.533 0.030 . 2 . . . . 33 SER HB3 . 11152 1 281 . 1 1 33 33 SER C C 13 173.219 0.300 . 1 . . . . 33 SER C . 11152 1 282 . 1 1 33 33 SER CA C 13 56.199 0.300 . 1 . . . . 33 SER CA . 11152 1 283 . 1 1 33 33 SER CB C 13 66.281 0.300 . 1 . . . . 33 SER CB . 11152 1 284 . 1 1 33 33 SER N N 15 112.242 0.300 . 1 . . . . 33 SER N . 11152 1 285 . 1 1 34 34 LEU H H 1 8.741 0.030 . 1 . . . . 34 LEU H . 11152 1 286 . 1 1 34 34 LEU HA H 1 4.868 0.030 . 1 . . . . 34 LEU HA . 11152 1 287 . 1 1 34 34 LEU HB2 H 1 1.109 0.030 . 2 . . . . 34 LEU HB2 . 11152 1 288 . 1 1 34 34 LEU HB3 H 1 1.414 0.030 . 2 . . . . 34 LEU HB3 . 11152 1 289 . 1 1 34 34 LEU HD11 H 1 0.455 0.030 . 1 . . . . 34 LEU HD1 . 11152 1 290 . 1 1 34 34 LEU HD12 H 1 0.455 0.030 . 1 . . . . 34 LEU HD1 . 11152 1 291 . 1 1 34 34 LEU HD13 H 1 0.455 0.030 . 1 . . . . 34 LEU HD1 . 11152 1 292 . 1 1 34 34 LEU HD21 H 1 0.533 0.030 . 1 . . . . 34 LEU HD2 . 11152 1 293 . 1 1 34 34 LEU HD22 H 1 0.533 0.030 . 1 . . . . 34 LEU HD2 . 11152 1 294 . 1 1 34 34 LEU HD23 H 1 0.533 0.030 . 1 . . . . 34 LEU HD2 . 11152 1 295 . 1 1 34 34 LEU HG H 1 1.269 0.030 . 1 . . . . 34 LEU HG . 11152 1 296 . 1 1 34 34 LEU C C 13 173.879 0.300 . 1 . . . . 34 LEU C . 11152 1 297 . 1 1 34 34 LEU CA C 13 53.675 0.300 . 1 . . . . 34 LEU CA . 11152 1 298 . 1 1 34 34 LEU CB C 13 48.248 0.300 . 1 . . . . 34 LEU CB . 11152 1 299 . 1 1 34 34 LEU CD1 C 13 26.738 0.300 . 2 . . . . 34 LEU CD1 . 11152 1 300 . 1 1 34 34 LEU CD2 C 13 25.115 0.300 . 2 . . . . 34 LEU CD2 . 11152 1 301 . 1 1 34 34 LEU CG C 13 25.916 0.300 . 1 . . . . 34 LEU CG . 11152 1 302 . 1 1 34 34 LEU N N 15 123.042 0.300 . 1 . . . . 34 LEU N . 11152 1 303 . 1 1 35 35 ARG H H 1 9.135 0.030 . 1 . . . . 35 ARG H . 11152 1 304 . 1 1 35 35 ARG HA H 1 5.084 0.030 . 1 . . . . 35 ARG HA . 11152 1 305 . 1 1 35 35 ARG HB2 H 1 1.753 0.030 . 2 . . . . 35 ARG HB2 . 11152 1 306 . 1 1 35 35 ARG HB3 H 1 1.558 0.030 . 2 . . . . 35 ARG HB3 . 11152 1 307 . 1 1 35 35 ARG HD2 H 1 3.054 0.030 . 2 . . . . 35 ARG HD2 . 11152 1 308 . 1 1 35 35 ARG HD3 H 1 2.917 0.030 . 2 . . . . 35 ARG HD3 . 11152 1 309 . 1 1 35 35 ARG HG2 H 1 1.324 0.030 . 2 . . . . 35 ARG HG2 . 11152 1 310 . 1 1 35 35 ARG HG3 H 1 1.213 0.030 . 2 . . . . 35 ARG HG3 . 11152 1 311 . 1 1 35 35 ARG C C 13 174.896 0.300 . 1 . . . . 35 ARG C . 11152 1 312 . 1 1 35 35 ARG CA C 13 54.909 0.300 . 1 . . . . 35 ARG CA . 11152 1 313 . 1 1 35 35 ARG CB C 13 32.328 0.300 . 1 . . . . 35 ARG CB . 11152 1 314 . 1 1 35 35 ARG CD C 13 43.011 0.300 . 1 . . . . 35 ARG CD . 11152 1 315 . 1 1 35 35 ARG CG C 13 27.937 0.300 . 1 . . . . 35 ARG CG . 11152 1 316 . 1 1 35 35 ARG N N 15 123.223 0.300 . 1 . . . . 35 ARG N . 11152 1 317 . 1 1 36 36 VAL H H 1 8.938 0.030 . 1 . . . . 36 VAL H . 11152 1 318 . 1 1 36 36 VAL HA H 1 4.540 0.030 . 1 . . . . 36 VAL HA . 11152 1 319 . 1 1 36 36 VAL HB H 1 1.795 0.030 . 1 . . . . 36 VAL HB . 11152 1 320 . 1 1 36 36 VAL HG11 H 1 0.368 0.030 . 1 . . . . 36 VAL HG1 . 11152 1 321 . 1 1 36 36 VAL HG12 H 1 0.368 0.030 . 1 . . . . 36 VAL HG1 . 11152 1 322 . 1 1 36 36 VAL HG13 H 1 0.368 0.030 . 1 . . . . 36 VAL HG1 . 11152 1 323 . 1 1 36 36 VAL HG21 H 1 0.703 0.030 . 1 . . . . 36 VAL HG2 . 11152 1 324 . 1 1 36 36 VAL HG22 H 1 0.703 0.030 . 1 . . . . 36 VAL HG2 . 11152 1 325 . 1 1 36 36 VAL HG23 H 1 0.703 0.030 . 1 . . . . 36 VAL HG2 . 11152 1 326 . 1 1 36 36 VAL C C 13 174.085 0.300 . 1 . . . . 36 VAL C . 11152 1 327 . 1 1 36 36 VAL CA C 13 60.346 0.300 . 1 . . . . 36 VAL CA . 11152 1 328 . 1 1 36 36 VAL CB C 13 33.513 0.300 . 1 . . . . 36 VAL CB . 11152 1 329 . 1 1 36 36 VAL CG1 C 13 21.269 0.300 . 2 . . . . 36 VAL CG1 . 11152 1 330 . 1 1 36 36 VAL CG2 C 13 20.718 0.300 . 2 . . . . 36 VAL CG2 . 11152 1 331 . 1 1 36 36 VAL N N 15 130.031 0.300 . 1 . . . . 36 VAL N . 11152 1 332 . 1 1 37 37 SER H H 1 8.804 0.030 . 1 . . . . 37 SER H . 11152 1 333 . 1 1 37 37 SER HA H 1 4.953 0.030 . 1 . . . . 37 SER HA . 11152 1 334 . 1 1 37 37 SER HB2 H 1 3.483 0.030 . 1 . . . . 37 SER HB2 . 11152 1 335 . 1 1 37 37 SER HB3 H 1 3.483 0.030 . 1 . . . . 37 SER HB3 . 11152 1 336 . 1 1 37 37 SER C C 13 171.838 0.300 . 1 . . . . 37 SER C . 11152 1 337 . 1 1 37 37 SER CA C 13 57.041 0.300 . 1 . . . . 37 SER CA . 11152 1 338 . 1 1 37 37 SER CB C 13 66.084 0.300 . 1 . . . . 37 SER CB . 11152 1 339 . 1 1 37 37 SER N N 15 119.844 0.300 . 1 . . . . 37 SER N . 11152 1 340 . 1 1 38 38 TRP H H 1 7.813 0.030 . 1 . . . . 38 TRP H . 11152 1 341 . 1 1 38 38 TRP HA H 1 4.982 0.030 . 1 . . . . 38 TRP HA . 11152 1 342 . 1 1 38 38 TRP HB2 H 1 3.266 0.030 . 2 . . . . 38 TRP HB2 . 11152 1 343 . 1 1 38 38 TRP HB3 H 1 2.918 0.030 . 2 . . . . 38 TRP HB3 . 11152 1 344 . 1 1 38 38 TRP HD1 H 1 6.536 0.030 . 1 . . . . 38 TRP HD1 . 11152 1 345 . 1 1 38 38 TRP HE1 H 1 6.081 0.030 . 1 . . . . 38 TRP HE1 . 11152 1 346 . 1 1 38 38 TRP HE3 H 1 6.801 0.030 . 1 . . . . 38 TRP HE3 . 11152 1 347 . 1 1 38 38 TRP HH2 H 1 6.466 0.030 . 1 . . . . 38 TRP HH2 . 11152 1 348 . 1 1 38 38 TRP HZ2 H 1 6.637 0.030 . 1 . . . . 38 TRP HZ2 . 11152 1 349 . 1 1 38 38 TRP HZ3 H 1 6.560 0.030 . 1 . . . . 38 TRP HZ3 . 11152 1 350 . 1 1 38 38 TRP C C 13 173.491 0.300 . 1 . . . . 38 TRP C . 11152 1 351 . 1 1 38 38 TRP CA C 13 56.141 0.300 . 1 . . . . 38 TRP CA . 11152 1 352 . 1 1 38 38 TRP CB C 13 30.247 0.300 . 1 . . . . 38 TRP CB . 11152 1 353 . 1 1 38 38 TRP CD1 C 13 124.381 0.300 . 1 . . . . 38 TRP CD1 . 11152 1 354 . 1 1 38 38 TRP CE3 C 13 120.263 0.300 . 1 . . . . 38 TRP CE3 . 11152 1 355 . 1 1 38 38 TRP CH2 C 13 123.149 0.300 . 1 . . . . 38 TRP CH2 . 11152 1 356 . 1 1 38 38 TRP CZ2 C 13 113.652 0.300 . 1 . . . . 38 TRP CZ2 . 11152 1 357 . 1 1 38 38 TRP CZ3 C 13 121.426 0.300 . 1 . . . . 38 TRP CZ3 . 11152 1 358 . 1 1 38 38 TRP N N 15 118.610 0.300 . 1 . . . . 38 TRP N . 11152 1 359 . 1 1 38 38 TRP NE1 N 15 123.557 0.300 . 1 . . . . 38 TRP NE1 . 11152 1 360 . 1 1 39 39 GLN H H 1 8.084 0.030 . 1 . . . . 39 GLN H . 11152 1 361 . 1 1 39 39 GLN HA H 1 4.561 0.030 . 1 . . . . 39 GLN HA . 11152 1 362 . 1 1 39 39 GLN HB2 H 1 2.051 0.030 . 2 . . . . 39 GLN HB2 . 11152 1 363 . 1 1 39 39 GLN HB3 H 1 1.993 0.030 . 2 . . . . 39 GLN HB3 . 11152 1 364 . 1 1 39 39 GLN HE21 H 1 7.543 0.030 . 2 . . . . 39 GLN HE21 . 11152 1 365 . 1 1 39 39 GLN HE22 H 1 6.834 0.030 . 2 . . . . 39 GLN HE22 . 11152 1 366 . 1 1 39 39 GLN HG2 H 1 2.332 0.030 . 2 . . . . 39 GLN HG2 . 11152 1 367 . 1 1 39 39 GLN HG3 H 1 2.293 0.030 . 2 . . . . 39 GLN HG3 . 11152 1 368 . 1 1 39 39 GLN C C 13 176.051 0.300 . 1 . . . . 39 GLN C . 11152 1 369 . 1 1 39 39 GLN CA C 13 53.993 0.300 . 1 . . . . 39 GLN CA . 11152 1 370 . 1 1 39 39 GLN CB C 13 30.651 0.300 . 1 . . . . 39 GLN CB . 11152 1 371 . 1 1 39 39 GLN CG C 13 34.203 0.300 . 1 . . . . 39 GLN CG . 11152 1 372 . 1 1 39 39 GLN N N 15 116.533 0.300 . 1 . . . . 39 GLN N . 11152 1 373 . 1 1 39 39 GLN NE2 N 15 112.633 0.300 . 1 . . . . 39 GLN NE2 . 11152 1 374 . 1 1 40 40 GLU H H 1 9.069 0.030 . 1 . . . . 40 GLU H . 11152 1 375 . 1 1 40 40 GLU HA H 1 4.622 0.030 . 1 . . . . 40 GLU HA . 11152 1 376 . 1 1 40 40 GLU HB2 H 1 2.079 0.030 . 2 . . . . 40 GLU HB2 . 11152 1 377 . 1 1 40 40 GLU HB3 H 1 1.994 0.030 . 2 . . . . 40 GLU HB3 . 11152 1 378 . 1 1 40 40 GLU HG2 H 1 2.363 0.030 . 1 . . . . 40 GLU HG2 . 11152 1 379 . 1 1 40 40 GLU HG3 H 1 2.363 0.030 . 1 . . . . 40 GLU HG3 . 11152 1 380 . 1 1 40 40 GLU C C 13 174.902 0.300 . 1 . . . . 40 GLU C . 11152 1 381 . 1 1 40 40 GLU CA C 13 54.693 0.300 . 1 . . . . 40 GLU CA . 11152 1 382 . 1 1 40 40 GLU CB C 13 30.305 0.300 . 1 . . . . 40 GLU CB . 11152 1 383 . 1 1 40 40 GLU CG C 13 35.640 0.300 . 1 . . . . 40 GLU CG . 11152 1 384 . 1 1 40 40 GLU N N 15 125.368 0.300 . 1 . . . . 40 GLU N . 11152 1 385 . 1 1 41 41 PRO HA H 1 4.722 0.030 . 1 . . . . 41 PRO HA . 11152 1 386 . 1 1 41 41 PRO HB2 H 1 1.917 0.030 . 2 . . . . 41 PRO HB2 . 11152 1 387 . 1 1 41 41 PRO HB3 H 1 1.840 0.030 . 2 . . . . 41 PRO HB3 . 11152 1 388 . 1 1 41 41 PRO HD2 H 1 4.069 0.030 . 2 . . . . 41 PRO HD2 . 11152 1 389 . 1 1 41 41 PRO HD3 H 1 4.213 0.030 . 2 . . . . 41 PRO HD3 . 11152 1 390 . 1 1 41 41 PRO HG2 H 1 2.041 0.030 . 2 . . . . 41 PRO HG2 . 11152 1 391 . 1 1 41 41 PRO HG3 H 1 1.948 0.030 . 2 . . . . 41 PRO HG3 . 11152 1 392 . 1 1 41 41 PRO C C 13 175.641 0.300 . 1 . . . . 41 PRO C . 11152 1 393 . 1 1 41 41 PRO CA C 13 61.437 0.300 . 1 . . . . 41 PRO CA . 11152 1 394 . 1 1 41 41 PRO CB C 13 33.455 0.300 . 1 . . . . 41 PRO CB . 11152 1 395 . 1 1 41 41 PRO CD C 13 51.072 0.300 . 1 . . . . 41 PRO CD . 11152 1 396 . 1 1 41 41 PRO CG C 13 27.467 0.300 . 1 . . . . 41 PRO CG . 11152 1 397 . 1 1 42 42 ARG H H 1 8.350 0.030 . 1 . . . . 42 ARG H . 11152 1 398 . 1 1 42 42 ARG HA H 1 4.176 0.030 . 1 . . . . 42 ARG HA . 11152 1 399 . 1 1 42 42 ARG HB2 H 1 1.805 0.030 . 1 . . . . 42 ARG HB2 . 11152 1 400 . 1 1 42 42 ARG HB3 H 1 1.805 0.030 . 1 . . . . 42 ARG HB3 . 11152 1 401 . 1 1 42 42 ARG HD2 H 1 3.244 0.030 . 2 . . . . 42 ARG HD2 . 11152 1 402 . 1 1 42 42 ARG HD3 H 1 3.179 0.030 . 2 . . . . 42 ARG HD3 . 11152 1 403 . 1 1 42 42 ARG HG2 H 1 1.728 0.030 . 2 . . . . 42 ARG HG2 . 11152 1 404 . 1 1 42 42 ARG HG3 H 1 1.618 0.030 . 2 . . . . 42 ARG HG3 . 11152 1 405 . 1 1 42 42 ARG C C 13 175.803 0.300 . 1 . . . . 42 ARG C . 11152 1 406 . 1 1 42 42 ARG CA C 13 56.685 0.300 . 1 . . . . 42 ARG CA . 11152 1 407 . 1 1 42 42 ARG CB C 13 30.707 0.300 . 1 . . . . 42 ARG CB . 11152 1 408 . 1 1 42 42 ARG CD C 13 43.263 0.300 . 1 . . . . 42 ARG CD . 11152 1 409 . 1 1 42 42 ARG CG C 13 27.236 0.300 . 1 . . . . 42 ARG CG . 11152 1 410 . 1 1 42 42 ARG N N 15 119.474 0.300 . 1 . . . . 42 ARG N . 11152 1 411 . 1 1 43 43 CYS H H 1 8.153 0.030 . 1 . . . . 43 CYS H . 11152 1 412 . 1 1 43 43 CYS HA H 1 4.290 0.030 . 1 . . . . 43 CYS HA . 11152 1 413 . 1 1 43 43 CYS HB2 H 1 2.698 0.030 . 2 . . . . 43 CYS HB2 . 11152 1 414 . 1 1 43 43 CYS HB3 H 1 2.900 0.030 . 2 . . . . 43 CYS HB3 . 11152 1 415 . 1 1 43 43 CYS C C 13 173.257 0.300 . 1 . . . . 43 CYS C . 11152 1 416 . 1 1 43 43 CYS CA C 13 59.522 0.300 . 1 . . . . 43 CYS CA . 11152 1 417 . 1 1 43 43 CYS CB C 13 29.571 0.300 . 1 . . . . 43 CYS CB . 11152 1 418 . 1 1 43 43 CYS N N 15 120.843 0.300 . 1 . . . . 43 CYS N . 11152 1 419 . 1 1 44 44 GLU H H 1 8.825 0.030 . 1 . . . . 44 GLU H . 11152 1 420 . 1 1 44 44 GLU HA H 1 4.267 0.030 . 1 . . . . 44 GLU HA . 11152 1 421 . 1 1 44 44 GLU HB2 H 1 1.779 0.030 . 2 . . . . 44 GLU HB2 . 11152 1 422 . 1 1 44 44 GLU HB3 H 1 2.173 0.030 . 2 . . . . 44 GLU HB3 . 11152 1 423 . 1 1 44 44 GLU HG2 H 1 2.320 0.030 . 2 . . . . 44 GLU HG2 . 11152 1 424 . 1 1 44 44 GLU HG3 H 1 2.244 0.030 . 2 . . . . 44 GLU HG3 . 11152 1 425 . 1 1 44 44 GLU C C 13 175.880 0.300 . 1 . . . . 44 GLU C . 11152 1 426 . 1 1 44 44 GLU CA C 13 57.972 0.300 . 1 . . . . 44 GLU CA . 11152 1 427 . 1 1 44 44 GLU CB C 13 30.477 0.300 . 1 . . . . 44 GLU CB . 11152 1 428 . 1 1 44 44 GLU CG C 13 36.874 0.300 . 1 . . . . 44 GLU CG . 11152 1 429 . 1 1 44 44 GLU N N 15 126.700 0.300 . 1 . . . . 44 GLU N . 11152 1 430 . 1 1 45 45 ARG H H 1 8.050 0.030 . 1 . . . . 45 ARG H . 11152 1 431 . 1 1 45 45 ARG HA H 1 4.785 0.030 . 1 . . . . 45 ARG HA . 11152 1 432 . 1 1 45 45 ARG HB2 H 1 1.700 0.030 . 2 . . . . 45 ARG HB2 . 11152 1 433 . 1 1 45 45 ARG HB3 H 1 2.038 0.030 . 2 . . . . 45 ARG HB3 . 11152 1 434 . 1 1 45 45 ARG HD2 H 1 3.292 0.030 . 2 . . . . 45 ARG HD2 . 11152 1 435 . 1 1 45 45 ARG HD3 H 1 3.190 0.030 . 2 . . . . 45 ARG HD3 . 11152 1 436 . 1 1 45 45 ARG HG2 H 1 1.699 0.030 . 2 . . . . 45 ARG HG2 . 11152 1 437 . 1 1 45 45 ARG HG3 H 1 1.608 0.030 . 2 . . . . 45 ARG HG3 . 11152 1 438 . 1 1 45 45 ARG C C 13 173.418 0.300 . 1 . . . . 45 ARG C . 11152 1 439 . 1 1 45 45 ARG CA C 13 52.437 0.300 . 1 . . . . 45 ARG CA . 11152 1 440 . 1 1 45 45 ARG CB C 13 30.939 0.300 . 1 . . . . 45 ARG CB . 11152 1 441 . 1 1 45 45 ARG CD C 13 42.682 0.300 . 1 . . . . 45 ARG CD . 11152 1 442 . 1 1 45 45 ARG CG C 13 27.273 0.300 . 1 . . . . 45 ARG CG . 11152 1 443 . 1 1 45 45 ARG N N 15 119.736 0.300 . 1 . . . . 45 ARG N . 11152 1 444 . 1 1 46 46 PRO HA H 1 4.264 0.030 . 1 . . . . 46 PRO HA . 11152 1 445 . 1 1 46 46 PRO HB2 H 1 1.680 0.030 . 2 . . . . 46 PRO HB2 . 11152 1 446 . 1 1 46 46 PRO HB3 H 1 2.319 0.030 . 2 . . . . 46 PRO HB3 . 11152 1 447 . 1 1 46 46 PRO HD2 H 1 3.525 0.030 . 2 . . . . 46 PRO HD2 . 11152 1 448 . 1 1 46 46 PRO HD3 H 1 3.786 0.030 . 2 . . . . 46 PRO HD3 . 11152 1 449 . 1 1 46 46 PRO HG2 H 1 2.050 0.030 . 2 . . . . 46 PRO HG2 . 11152 1 450 . 1 1 46 46 PRO HG3 H 1 1.947 0.030 . 2 . . . . 46 PRO HG3 . 11152 1 451 . 1 1 46 46 PRO C C 13 177.129 0.300 . 1 . . . . 46 PRO C . 11152 1 452 . 1 1 46 46 PRO CA C 13 63.089 0.300 . 1 . . . . 46 PRO CA . 11152 1 453 . 1 1 46 46 PRO CB C 13 32.189 0.300 . 1 . . . . 46 PRO CB . 11152 1 454 . 1 1 46 46 PRO CD C 13 50.463 0.300 . 1 . . . . 46 PRO CD . 11152 1 455 . 1 1 46 46 PRO CG C 13 27.927 0.300 . 1 . . . . 46 PRO CG . 11152 1 456 . 1 1 47 47 LEU H H 1 8.585 0.030 . 1 . . . . 47 LEU H . 11152 1 457 . 1 1 47 47 LEU HA H 1 4.244 0.030 . 1 . . . . 47 LEU HA . 11152 1 458 . 1 1 47 47 LEU HB2 H 1 1.775 0.030 . 2 . . . . 47 LEU HB2 . 11152 1 459 . 1 1 47 47 LEU HB3 H 1 1.155 0.030 . 2 . . . . 47 LEU HB3 . 11152 1 460 . 1 1 47 47 LEU HD11 H 1 1.041 0.030 . 1 . . . . 47 LEU HD1 . 11152 1 461 . 1 1 47 47 LEU HD12 H 1 1.041 0.030 . 1 . . . . 47 LEU HD1 . 11152 1 462 . 1 1 47 47 LEU HD13 H 1 1.041 0.030 . 1 . . . . 47 LEU HD1 . 11152 1 463 . 1 1 47 47 LEU HD21 H 1 0.756 0.030 . 1 . . . . 47 LEU HD2 . 11152 1 464 . 1 1 47 47 LEU HD22 H 1 0.756 0.030 . 1 . . . . 47 LEU HD2 . 11152 1 465 . 1 1 47 47 LEU HD23 H 1 0.756 0.030 . 1 . . . . 47 LEU HD2 . 11152 1 466 . 1 1 47 47 LEU HG H 1 1.850 0.030 . 1 . . . . 47 LEU HG . 11152 1 467 . 1 1 47 47 LEU C C 13 177.580 0.300 . 1 . . . . 47 LEU C . 11152 1 468 . 1 1 47 47 LEU CA C 13 54.701 0.300 . 1 . . . . 47 LEU CA . 11152 1 469 . 1 1 47 47 LEU CB C 13 43.060 0.300 . 1 . . . . 47 LEU CB . 11152 1 470 . 1 1 47 47 LEU CD1 C 13 26.501 0.300 . 2 . . . . 47 LEU CD1 . 11152 1 471 . 1 1 47 47 LEU CD2 C 13 23.823 0.300 . 2 . . . . 47 LEU CD2 . 11152 1 472 . 1 1 47 47 LEU CG C 13 27.269 0.300 . 1 . . . . 47 LEU CG . 11152 1 473 . 1 1 47 47 LEU N N 15 122.745 0.300 . 1 . . . . 47 LEU N . 11152 1 474 . 1 1 48 48 GLN H H 1 8.930 0.030 . 1 . . . . 48 GLN H . 11152 1 475 . 1 1 48 48 GLN HA H 1 4.374 0.030 . 1 . . . . 48 GLN HA . 11152 1 476 . 1 1 48 48 GLN HB2 H 1 1.851 0.030 . 2 . . . . 48 GLN HB2 . 11152 1 477 . 1 1 48 48 GLN HB3 H 1 1.183 0.030 . 2 . . . . 48 GLN HB3 . 11152 1 478 . 1 1 48 48 GLN HE21 H 1 6.701 0.030 . 2 . . . . 48 GLN HE21 . 11152 1 479 . 1 1 48 48 GLN HE22 H 1 6.886 0.030 . 2 . . . . 48 GLN HE22 . 11152 1 480 . 1 1 48 48 GLN HG2 H 1 2.003 0.030 . 1 . . . . 48 GLN HG2 . 11152 1 481 . 1 1 48 48 GLN HG3 H 1 2.003 0.030 . 1 . . . . 48 GLN HG3 . 11152 1 482 . 1 1 48 48 GLN C C 13 174.928 0.300 . 1 . . . . 48 GLN C . 11152 1 483 . 1 1 48 48 GLN CA C 13 55.167 0.300 . 1 . . . . 48 GLN CA . 11152 1 484 . 1 1 48 48 GLN CB C 13 30.567 0.300 . 1 . . . . 48 GLN CB . 11152 1 485 . 1 1 48 48 GLN CG C 13 33.977 0.300 . 1 . . . . 48 GLN CG . 11152 1 486 . 1 1 48 48 GLN N N 15 115.813 0.300 . 1 . . . . 48 GLN N . 11152 1 487 . 1 1 48 48 GLN NE2 N 15 109.898 0.300 . 1 . . . . 48 GLN NE2 . 11152 1 488 . 1 1 49 49 GLY H H 1 6.779 0.030 . 1 . . . . 49 GLY H . 11152 1 489 . 1 1 49 49 GLY HA2 H 1 3.223 0.030 . 2 . . . . 49 GLY HA2 . 11152 1 490 . 1 1 49 49 GLY HA3 H 1 4.628 0.030 . 2 . . . . 49 GLY HA3 . 11152 1 491 . 1 1 49 49 GLY C C 13 170.743 0.300 . 1 . . . . 49 GLY C . 11152 1 492 . 1 1 49 49 GLY CA C 13 44.729 0.300 . 1 . . . . 49 GLY CA . 11152 1 493 . 1 1 49 49 GLY N N 15 102.600 0.300 . 1 . . . . 49 GLY N . 11152 1 494 . 1 1 50 50 TYR H H 1 8.915 0.030 . 1 . . . . 50 TYR H . 11152 1 495 . 1 1 50 50 TYR HA H 1 5.910 0.030 . 1 . . . . 50 TYR HA . 11152 1 496 . 1 1 50 50 TYR HB2 H 1 3.091 0.030 . 2 . . . . 50 TYR HB2 . 11152 1 497 . 1 1 50 50 TYR HB3 H 1 2.721 0.030 . 2 . . . . 50 TYR HB3 . 11152 1 498 . 1 1 50 50 TYR HD1 H 1 7.179 0.030 . 1 . . . . 50 TYR HD1 . 11152 1 499 . 1 1 50 50 TYR HD2 H 1 7.179 0.030 . 1 . . . . 50 TYR HD2 . 11152 1 500 . 1 1 50 50 TYR C C 13 175.301 0.300 . 1 . . . . 50 TYR C . 11152 1 501 . 1 1 50 50 TYR CA C 13 56.511 0.300 . 1 . . . . 50 TYR CA . 11152 1 502 . 1 1 50 50 TYR CB C 13 44.007 0.300 . 1 . . . . 50 TYR CB . 11152 1 503 . 1 1 50 50 TYR N N 15 113.458 0.300 . 1 . . . . 50 TYR N . 11152 1 504 . 1 1 51 51 SER H H 1 9.201 0.030 . 1 . . . . 51 SER H . 11152 1 505 . 1 1 51 51 SER HA H 1 5.266 0.030 . 1 . . . . 51 SER HA . 11152 1 506 . 1 1 51 51 SER HB2 H 1 3.506 0.030 . 2 . . . . 51 SER HB2 . 11152 1 507 . 1 1 51 51 SER HB3 H 1 3.702 0.030 . 2 . . . . 51 SER HB3 . 11152 1 508 . 1 1 51 51 SER C C 13 172.890 0.300 . 1 . . . . 51 SER C . 11152 1 509 . 1 1 51 51 SER CA C 13 57.191 0.300 . 1 . . . . 51 SER CA . 11152 1 510 . 1 1 51 51 SER CB C 13 65.688 0.300 . 1 . . . . 51 SER CB . 11152 1 511 . 1 1 51 51 SER N N 15 115.992 0.300 . 1 . . . . 51 SER N . 11152 1 512 . 1 1 52 52 VAL H H 1 8.817 0.030 . 1 . . . . 52 VAL H . 11152 1 513 . 1 1 52 52 VAL HA H 1 4.873 0.030 . 1 . . . . 52 VAL HA . 11152 1 514 . 1 1 52 52 VAL HB H 1 2.114 0.030 . 1 . . . . 52 VAL HB . 11152 1 515 . 1 1 52 52 VAL HG11 H 1 1.037 0.030 . 1 . . . . 52 VAL HG1 . 11152 1 516 . 1 1 52 52 VAL HG12 H 1 1.037 0.030 . 1 . . . . 52 VAL HG1 . 11152 1 517 . 1 1 52 52 VAL HG13 H 1 1.037 0.030 . 1 . . . . 52 VAL HG1 . 11152 1 518 . 1 1 52 52 VAL HG21 H 1 0.807 0.030 . 1 . . . . 52 VAL HG2 . 11152 1 519 . 1 1 52 52 VAL HG22 H 1 0.807 0.030 . 1 . . . . 52 VAL HG2 . 11152 1 520 . 1 1 52 52 VAL HG23 H 1 0.807 0.030 . 1 . . . . 52 VAL HG2 . 11152 1 521 . 1 1 52 52 VAL C C 13 174.170 0.300 . 1 . . . . 52 VAL C . 11152 1 522 . 1 1 52 52 VAL CA C 13 60.762 0.300 . 1 . . . . 52 VAL CA . 11152 1 523 . 1 1 52 52 VAL CB C 13 34.779 0.300 . 1 . . . . 52 VAL CB . 11152 1 524 . 1 1 52 52 VAL CG1 C 13 20.760 0.300 . 2 . . . . 52 VAL CG1 . 11152 1 525 . 1 1 52 52 VAL CG2 C 13 21.918 0.300 . 2 . . . . 52 VAL CG2 . 11152 1 526 . 1 1 52 52 VAL N N 15 123.881 0.300 . 1 . . . . 52 VAL N . 11152 1 527 . 1 1 53 53 GLU H H 1 9.173 0.030 . 1 . . . . 53 GLU H . 11152 1 528 . 1 1 53 53 GLU HA H 1 5.705 0.030 . 1 . . . . 53 GLU HA . 11152 1 529 . 1 1 53 53 GLU HB2 H 1 1.879 0.030 . 1 . . . . 53 GLU HB2 . 11152 1 530 . 1 1 53 53 GLU HB3 H 1 1.879 0.030 . 1 . . . . 53 GLU HB3 . 11152 1 531 . 1 1 53 53 GLU HG2 H 1 2.193 0.030 . 2 . . . . 53 GLU HG2 . 11152 1 532 . 1 1 53 53 GLU HG3 H 1 2.056 0.030 . 2 . . . . 53 GLU HG3 . 11152 1 533 . 1 1 53 53 GLU C C 13 175.162 0.300 . 1 . . . . 53 GLU C . 11152 1 534 . 1 1 53 53 GLU CA C 13 53.374 0.300 . 1 . . . . 53 GLU CA . 11152 1 535 . 1 1 53 53 GLU CB C 13 33.871 0.300 . 1 . . . . 53 GLU CB . 11152 1 536 . 1 1 53 53 GLU CG C 13 37.110 0.300 . 1 . . . . 53 GLU CG . 11152 1 537 . 1 1 53 53 GLU N N 15 126.311 0.300 . 1 . . . . 53 GLU N . 11152 1 538 . 1 1 54 54 TYR H H 1 8.750 0.030 . 1 . . . . 54 TYR H . 11152 1 539 . 1 1 54 54 TYR HA H 1 5.674 0.030 . 1 . . . . 54 TYR HA . 11152 1 540 . 1 1 54 54 TYR HB2 H 1 1.940 0.030 . 2 . . . . 54 TYR HB2 . 11152 1 541 . 1 1 54 54 TYR HB3 H 1 1.608 0.030 . 2 . . . . 54 TYR HB3 . 11152 1 542 . 1 1 54 54 TYR HD1 H 1 6.355 0.030 . 1 . . . . 54 TYR HD1 . 11152 1 543 . 1 1 54 54 TYR HD2 H 1 6.355 0.030 . 1 . . . . 54 TYR HD2 . 11152 1 544 . 1 1 54 54 TYR HE1 H 1 6.258 0.030 . 1 . . . . 54 TYR HE1 . 11152 1 545 . 1 1 54 54 TYR HE2 H 1 6.258 0.030 . 1 . . . . 54 TYR HE2 . 11152 1 546 . 1 1 54 54 TYR C C 13 173.697 0.300 . 1 . . . . 54 TYR C . 11152 1 547 . 1 1 54 54 TYR CA C 13 55.593 0.300 . 1 . . . . 54 TYR CA . 11152 1 548 . 1 1 54 54 TYR CB C 13 40.021 0.300 . 1 . . . . 54 TYR CB . 11152 1 549 . 1 1 54 54 TYR CD1 C 13 132.832 0.300 . 1 . . . . 54 TYR CD1 . 11152 1 550 . 1 1 54 54 TYR CD2 C 13 132.832 0.300 . 1 . . . . 54 TYR CD2 . 11152 1 551 . 1 1 54 54 TYR CE1 C 13 117.928 0.300 . 1 . . . . 54 TYR CE1 . 11152 1 552 . 1 1 54 54 TYR CE2 C 13 117.928 0.300 . 1 . . . . 54 TYR CE2 . 11152 1 553 . 1 1 54 54 TYR N N 15 117.162 0.300 . 1 . . . . 54 TYR N . 11152 1 554 . 1 1 55 55 GLN H H 1 8.337 0.030 . 1 . . . . 55 GLN H . 11152 1 555 . 1 1 55 55 GLN HA H 1 4.787 0.030 . 1 . . . . 55 GLN HA . 11152 1 556 . 1 1 55 55 GLN HB2 H 1 2.040 0.030 . 2 . . . . 55 GLN HB2 . 11152 1 557 . 1 1 55 55 GLN HB3 H 1 1.789 0.030 . 2 . . . . 55 GLN HB3 . 11152 1 558 . 1 1 55 55 GLN HE21 H 1 6.908 0.030 . 2 . . . . 55 GLN HE21 . 11152 1 559 . 1 1 55 55 GLN HE22 H 1 7.239 0.030 . 2 . . . . 55 GLN HE22 . 11152 1 560 . 1 1 55 55 GLN HG2 H 1 2.233 0.030 . 2 . . . . 55 GLN HG2 . 11152 1 561 . 1 1 55 55 GLN HG3 H 1 2.108 0.030 . 2 . . . . 55 GLN HG3 . 11152 1 562 . 1 1 55 55 GLN C C 13 174.422 0.300 . 1 . . . . 55 GLN C . 11152 1 563 . 1 1 55 55 GLN CA C 13 54.006 0.300 . 1 . . . . 55 GLN CA . 11152 1 564 . 1 1 55 55 GLN CB C 13 33.477 0.300 . 1 . . . . 55 GLN CB . 11152 1 565 . 1 1 55 55 GLN CG C 13 32.921 0.300 . 1 . . . . 55 GLN CG . 11152 1 566 . 1 1 55 55 GLN N N 15 115.347 0.300 . 1 . . . . 55 GLN N . 11152 1 567 . 1 1 55 55 GLN NE2 N 15 110.959 0.300 . 1 . . . . 55 GLN NE2 . 11152 1 568 . 1 1 56 56 LEU H H 1 9.166 0.030 . 1 . . . . 56 LEU H . 11152 1 569 . 1 1 56 56 LEU HA H 1 3.993 0.030 . 1 . . . . 56 LEU HA . 11152 1 570 . 1 1 56 56 LEU HB2 H 1 1.664 0.030 . 2 . . . . 56 LEU HB2 . 11152 1 571 . 1 1 56 56 LEU HB3 H 1 1.396 0.030 . 2 . . . . 56 LEU HB3 . 11152 1 572 . 1 1 56 56 LEU HD11 H 1 0.913 0.030 . 1 . . . . 56 LEU HD1 . 11152 1 573 . 1 1 56 56 LEU HD12 H 1 0.913 0.030 . 1 . . . . 56 LEU HD1 . 11152 1 574 . 1 1 56 56 LEU HD13 H 1 0.913 0.030 . 1 . . . . 56 LEU HD1 . 11152 1 575 . 1 1 56 56 LEU HD21 H 1 0.390 0.030 . 1 . . . . 56 LEU HD2 . 11152 1 576 . 1 1 56 56 LEU HD22 H 1 0.390 0.030 . 1 . . . . 56 LEU HD2 . 11152 1 577 . 1 1 56 56 LEU HD23 H 1 0.390 0.030 . 1 . . . . 56 LEU HD2 . 11152 1 578 . 1 1 56 56 LEU HG H 1 1.475 0.030 . 1 . . . . 56 LEU HG . 11152 1 579 . 1 1 56 56 LEU C C 13 178.997 0.300 . 1 . . . . 56 LEU C . 11152 1 580 . 1 1 56 56 LEU CA C 13 55.744 0.300 . 1 . . . . 56 LEU CA . 11152 1 581 . 1 1 56 56 LEU CB C 13 42.101 0.300 . 1 . . . . 56 LEU CB . 11152 1 582 . 1 1 56 56 LEU CD1 C 13 25.943 0.300 . 2 . . . . 56 LEU CD1 . 11152 1 583 . 1 1 56 56 LEU CD2 C 13 24.442 0.300 . 2 . . . . 56 LEU CD2 . 11152 1 584 . 1 1 56 56 LEU CG C 13 27.500 0.300 . 1 . . . . 56 LEU CG . 11152 1 585 . 1 1 56 56 LEU N N 15 125.755 0.300 . 1 . . . . 56 LEU N . 11152 1 586 . 1 1 57 57 LEU H H 1 8.380 0.030 . 1 . . . . 57 LEU H . 11152 1 587 . 1 1 57 57 LEU HA H 1 3.876 0.030 . 1 . . . . 57 LEU HA . 11152 1 588 . 1 1 57 57 LEU HB2 H 1 1.138 0.030 . 2 . . . . 57 LEU HB2 . 11152 1 589 . 1 1 57 57 LEU HB3 H 1 1.543 0.030 . 2 . . . . 57 LEU HB3 . 11152 1 590 . 1 1 57 57 LEU HD11 H 1 0.828 0.030 . 1 . . . . 57 LEU HD1 . 11152 1 591 . 1 1 57 57 LEU HD12 H 1 0.828 0.030 . 1 . . . . 57 LEU HD1 . 11152 1 592 . 1 1 57 57 LEU HD13 H 1 0.828 0.030 . 1 . . . . 57 LEU HD1 . 11152 1 593 . 1 1 57 57 LEU HD21 H 1 0.817 0.030 . 1 . . . . 57 LEU HD2 . 11152 1 594 . 1 1 57 57 LEU HD22 H 1 0.817 0.030 . 1 . . . . 57 LEU HD2 . 11152 1 595 . 1 1 57 57 LEU HD23 H 1 0.817 0.030 . 1 . . . . 57 LEU HD2 . 11152 1 596 . 1 1 57 57 LEU HG H 1 1.449 0.030 . 1 . . . . 57 LEU HG . 11152 1 597 . 1 1 57 57 LEU C C 13 177.840 0.300 . 1 . . . . 57 LEU C . 11152 1 598 . 1 1 57 57 LEU CA C 13 57.638 0.300 . 1 . . . . 57 LEU CA . 11152 1 599 . 1 1 57 57 LEU CB C 13 42.409 0.300 . 1 . . . . 57 LEU CB . 11152 1 600 . 1 1 57 57 LEU CD1 C 13 24.305 0.300 . 2 . . . . 57 LEU CD1 . 11152 1 601 . 1 1 57 57 LEU CD2 C 13 24.988 0.300 . 2 . . . . 57 LEU CD2 . 11152 1 602 . 1 1 57 57 LEU CG C 13 27.043 0.300 . 1 . . . . 57 LEU CG . 11152 1 603 . 1 1 57 57 LEU N N 15 124.901 0.300 . 1 . . . . 57 LEU N . 11152 1 604 . 1 1 58 58 ASN H H 1 8.390 0.030 . 1 . . . . 58 ASN H . 11152 1 605 . 1 1 58 58 ASN HA H 1 4.604 0.030 . 1 . . . . 58 ASN HA . 11152 1 606 . 1 1 58 58 ASN HB2 H 1 2.886 0.030 . 2 . . . . 58 ASN HB2 . 11152 1 607 . 1 1 58 58 ASN HB3 H 1 2.782 0.030 . 2 . . . . 58 ASN HB3 . 11152 1 608 . 1 1 58 58 ASN HD21 H 1 7.586 0.030 . 2 . . . . 58 ASN HD21 . 11152 1 609 . 1 1 58 58 ASN HD22 H 1 6.857 0.030 . 2 . . . . 58 ASN HD22 . 11152 1 610 . 1 1 58 58 ASN C C 13 174.998 0.300 . 1 . . . . 58 ASN C . 11152 1 611 . 1 1 58 58 ASN CA C 13 53.355 0.300 . 1 . . . . 58 ASN CA . 11152 1 612 . 1 1 58 58 ASN CB C 13 37.873 0.300 . 1 . . . . 58 ASN CB . 11152 1 613 . 1 1 58 58 ASN N N 15 113.196 0.300 . 1 . . . . 58 ASN N . 11152 1 614 . 1 1 58 58 ASN ND2 N 15 112.257 0.300 . 1 . . . . 58 ASN ND2 . 11152 1 615 . 1 1 59 59 GLY H H 1 7.620 0.030 . 1 . . . . 59 GLY H . 11152 1 616 . 1 1 59 59 GLY HA2 H 1 4.310 0.030 . 2 . . . . 59 GLY HA2 . 11152 1 617 . 1 1 59 59 GLY HA3 H 1 3.589 0.030 . 2 . . . . 59 GLY HA3 . 11152 1 618 . 1 1 59 59 GLY C C 13 173.296 0.300 . 1 . . . . 59 GLY C . 11152 1 619 . 1 1 59 59 GLY CA C 13 44.732 0.300 . 1 . . . . 59 GLY CA . 11152 1 620 . 1 1 59 59 GLY N N 15 108.112 0.300 . 1 . . . . 59 GLY N . 11152 1 621 . 1 1 60 60 GLY H H 1 8.035 0.030 . 1 . . . . 60 GLY H . 11152 1 622 . 1 1 60 60 GLY HA2 H 1 3.888 0.030 . 2 . . . . 60 GLY HA2 . 11152 1 623 . 1 1 60 60 GLY HA3 H 1 4.258 0.030 . 2 . . . . 60 GLY HA3 . 11152 1 624 . 1 1 60 60 GLY C C 13 173.199 0.300 . 1 . . . . 60 GLY C . 11152 1 625 . 1 1 60 60 GLY CA C 13 44.765 0.300 . 1 . . . . 60 GLY CA . 11152 1 626 . 1 1 60 60 GLY N N 15 108.380 0.300 . 1 . . . . 60 GLY N . 11152 1 627 . 1 1 61 61 GLU H H 1 8.414 0.030 . 1 . . . . 61 GLU H . 11152 1 628 . 1 1 61 61 GLU HA H 1 3.947 0.030 . 1 . . . . 61 GLU HA . 11152 1 629 . 1 1 61 61 GLU HB2 H 1 1.835 0.030 . 2 . . . . 61 GLU HB2 . 11152 1 630 . 1 1 61 61 GLU HB3 H 1 1.755 0.030 . 2 . . . . 61 GLU HB3 . 11152 1 631 . 1 1 61 61 GLU HG2 H 1 2.038 0.030 . 2 . . . . 61 GLU HG2 . 11152 1 632 . 1 1 61 61 GLU HG3 H 1 1.832 0.030 . 2 . . . . 61 GLU HG3 . 11152 1 633 . 1 1 61 61 GLU C C 13 175.335 0.300 . 1 . . . . 61 GLU C . 11152 1 634 . 1 1 61 61 GLU CA C 13 56.770 0.300 . 1 . . . . 61 GLU CA . 11152 1 635 . 1 1 61 61 GLU CB C 13 30.182 0.300 . 1 . . . . 61 GLU CB . 11152 1 636 . 1 1 61 61 GLU CG C 13 35.623 0.300 . 1 . . . . 61 GLU CG . 11152 1 637 . 1 1 61 61 GLU N N 15 121.041 0.300 . 1 . . . . 61 GLU N . 11152 1 638 . 1 1 62 62 LEU H H 1 8.324 0.030 . 1 . . . . 62 LEU H . 11152 1 639 . 1 1 62 62 LEU HA H 1 4.298 0.030 . 1 . . . . 62 LEU HA . 11152 1 640 . 1 1 62 62 LEU HB2 H 1 1.537 0.030 . 2 . . . . 62 LEU HB2 . 11152 1 641 . 1 1 62 62 LEU HB3 H 1 1.264 0.030 . 2 . . . . 62 LEU HB3 . 11152 1 642 . 1 1 62 62 LEU HD11 H 1 0.653 0.030 . 1 . . . . 62 LEU HD1 . 11152 1 643 . 1 1 62 62 LEU HD12 H 1 0.653 0.030 . 1 . . . . 62 LEU HD1 . 11152 1 644 . 1 1 62 62 LEU HD13 H 1 0.653 0.030 . 1 . . . . 62 LEU HD1 . 11152 1 645 . 1 1 62 62 LEU HD21 H 1 0.653 0.030 . 1 . . . . 62 LEU HD2 . 11152 1 646 . 1 1 62 62 LEU HD22 H 1 0.653 0.030 . 1 . . . . 62 LEU HD2 . 11152 1 647 . 1 1 62 62 LEU HD23 H 1 0.653 0.030 . 1 . . . . 62 LEU HD2 . 11152 1 648 . 1 1 62 62 LEU HG H 1 1.215 0.030 . 1 . . . . 62 LEU HG . 11152 1 649 . 1 1 62 62 LEU C C 13 176.028 0.300 . 1 . . . . 62 LEU C . 11152 1 650 . 1 1 62 62 LEU CA C 13 54.654 0.300 . 1 . . . . 62 LEU CA . 11152 1 651 . 1 1 62 62 LEU CB C 13 42.910 0.300 . 1 . . . . 62 LEU CB . 11152 1 652 . 1 1 62 62 LEU CD1 C 13 23.963 0.300 . 2 . . . . 62 LEU CD1 . 11152 1 653 . 1 1 62 62 LEU CD2 C 13 25.299 0.300 . 2 . . . . 62 LEU CD2 . 11152 1 654 . 1 1 62 62 LEU CG C 13 27.163 0.300 . 1 . . . . 62 LEU CG . 11152 1 655 . 1 1 62 62 LEU N N 15 125.078 0.300 . 1 . . . . 62 LEU N . 11152 1 656 . 1 1 63 63 HIS H H 1 8.581 0.030 . 1 . . . . 63 HIS H . 11152 1 657 . 1 1 63 63 HIS HA H 1 4.450 0.030 . 1 . . . . 63 HIS HA . 11152 1 658 . 1 1 63 63 HIS HB2 H 1 2.334 0.030 . 2 . . . . 63 HIS HB2 . 11152 1 659 . 1 1 63 63 HIS HB3 H 1 1.394 0.030 . 2 . . . . 63 HIS HB3 . 11152 1 660 . 1 1 63 63 HIS HD2 H 1 6.773 0.030 . 1 . . . . 63 HIS HD2 . 11152 1 661 . 1 1 63 63 HIS HE1 H 1 8.086 0.030 . 1 . . . . 63 HIS HE1 . 11152 1 662 . 1 1 63 63 HIS C C 13 173.586 0.300 . 1 . . . . 63 HIS C . 11152 1 663 . 1 1 63 63 HIS CA C 13 54.743 0.300 . 1 . . . . 63 HIS CA . 11152 1 664 . 1 1 63 63 HIS CB C 13 29.998 0.300 . 1 . . . . 63 HIS CB . 11152 1 665 . 1 1 63 63 HIS CD2 C 13 121.749 0.300 . 1 . . . . 63 HIS CD2 . 11152 1 666 . 1 1 63 63 HIS CE1 C 13 136.816 0.300 . 1 . . . . 63 HIS CE1 . 11152 1 667 . 1 1 63 63 HIS N N 15 126.589 0.300 . 1 . . . . 63 HIS N . 11152 1 668 . 1 1 64 64 ARG H H 1 8.519 0.030 . 1 . . . . 64 ARG H . 11152 1 669 . 1 1 64 64 ARG HA H 1 5.194 0.030 . 1 . . . . 64 ARG HA . 11152 1 670 . 1 1 64 64 ARG HB2 H 1 1.698 0.030 . 2 . . . . 64 ARG HB2 . 11152 1 671 . 1 1 64 64 ARG HB3 H 1 1.551 0.030 . 2 . . . . 64 ARG HB3 . 11152 1 672 . 1 1 64 64 ARG HD2 H 1 3.054 0.030 . 1 . . . . 64 ARG HD2 . 11152 1 673 . 1 1 64 64 ARG HD3 H 1 3.054 0.030 . 1 . . . . 64 ARG HD3 . 11152 1 674 . 1 1 64 64 ARG HG2 H 1 1.383 0.030 . 2 . . . . 64 ARG HG2 . 11152 1 675 . 1 1 64 64 ARG HG3 H 1 1.330 0.030 . 2 . . . . 64 ARG HG3 . 11152 1 676 . 1 1 64 64 ARG C C 13 174.945 0.300 . 1 . . . . 64 ARG C . 11152 1 677 . 1 1 64 64 ARG CA C 13 55.260 0.300 . 1 . . . . 64 ARG CA . 11152 1 678 . 1 1 64 64 ARG CB C 13 33.360 0.300 . 1 . . . . 64 ARG CB . 11152 1 679 . 1 1 64 64 ARG CD C 13 43.308 0.300 . 1 . . . . 64 ARG CD . 11152 1 680 . 1 1 64 64 ARG CG C 13 28.159 0.300 . 1 . . . . 64 ARG CG . 11152 1 681 . 1 1 64 64 ARG N N 15 121.120 0.300 . 1 . . . . 64 ARG N . 11152 1 682 . 1 1 65 65 LEU H H 1 9.592 0.030 . 1 . . . . 65 LEU H . 11152 1 683 . 1 1 65 65 LEU HA H 1 4.831 0.030 . 1 . . . . 65 LEU HA . 11152 1 684 . 1 1 65 65 LEU HB2 H 1 1.664 0.030 . 2 . . . . 65 LEU HB2 . 11152 1 685 . 1 1 65 65 LEU HB3 H 1 1.837 0.030 . 2 . . . . 65 LEU HB3 . 11152 1 686 . 1 1 65 65 LEU HD11 H 1 1.072 0.030 . 1 . . . . 65 LEU HD1 . 11152 1 687 . 1 1 65 65 LEU HD12 H 1 1.072 0.030 . 1 . . . . 65 LEU HD1 . 11152 1 688 . 1 1 65 65 LEU HD13 H 1 1.072 0.030 . 1 . . . . 65 LEU HD1 . 11152 1 689 . 1 1 65 65 LEU HD21 H 1 1.103 0.030 . 1 . . . . 65 LEU HD2 . 11152 1 690 . 1 1 65 65 LEU HD22 H 1 1.103 0.030 . 1 . . . . 65 LEU HD2 . 11152 1 691 . 1 1 65 65 LEU HD23 H 1 1.103 0.030 . 1 . . . . 65 LEU HD2 . 11152 1 692 . 1 1 65 65 LEU HG H 1 1.775 0.030 . 1 . . . . 65 LEU HG . 11152 1 693 . 1 1 65 65 LEU C C 13 175.191 0.300 . 1 . . . . 65 LEU C . 11152 1 694 . 1 1 65 65 LEU CA C 13 53.960 0.300 . 1 . . . . 65 LEU CA . 11152 1 695 . 1 1 65 65 LEU CB C 13 44.620 0.300 . 1 . . . . 65 LEU CB . 11152 1 696 . 1 1 65 65 LEU CD1 C 13 25.971 0.300 . 2 . . . . 65 LEU CD1 . 11152 1 697 . 1 1 65 65 LEU CD2 C 13 24.251 0.300 . 2 . . . . 65 LEU CD2 . 11152 1 698 . 1 1 65 65 LEU CG C 13 27.292 0.300 . 1 . . . . 65 LEU CG . 11152 1 699 . 1 1 65 65 LEU N N 15 126.250 0.300 . 1 . . . . 65 LEU N . 11152 1 700 . 1 1 66 66 ASN H H 1 8.993 0.030 . 1 . . . . 66 ASN H . 11152 1 701 . 1 1 66 66 ASN HA H 1 5.202 0.030 . 1 . . . . 66 ASN HA . 11152 1 702 . 1 1 66 66 ASN HB2 H 1 2.821 0.030 . 2 . . . . 66 ASN HB2 . 11152 1 703 . 1 1 66 66 ASN HB3 H 1 2.759 0.030 . 2 . . . . 66 ASN HB3 . 11152 1 704 . 1 1 66 66 ASN HD21 H 1 7.790 0.030 . 2 . . . . 66 ASN HD21 . 11152 1 705 . 1 1 66 66 ASN HD22 H 1 7.063 0.030 . 2 . . . . 66 ASN HD22 . 11152 1 706 . 1 1 66 66 ASN C C 13 174.344 0.300 . 1 . . . . 66 ASN C . 11152 1 707 . 1 1 66 66 ASN CA C 13 53.239 0.300 . 1 . . . . 66 ASN CA . 11152 1 708 . 1 1 66 66 ASN CB C 13 40.836 0.300 . 1 . . . . 66 ASN CB . 11152 1 709 . 1 1 66 66 ASN N N 15 122.200 0.300 . 1 . . . . 66 ASN N . 11152 1 710 . 1 1 66 66 ASN ND2 N 15 113.604 0.300 . 1 . . . . 66 ASN ND2 . 11152 1 711 . 1 1 67 67 ILE H H 1 8.767 0.030 . 1 . . . . 67 ILE H . 11152 1 712 . 1 1 67 67 ILE HA H 1 4.833 0.030 . 1 . . . . 67 ILE HA . 11152 1 713 . 1 1 67 67 ILE HB H 1 2.333 0.030 . 1 . . . . 67 ILE HB . 11152 1 714 . 1 1 67 67 ILE HD11 H 1 1.026 0.030 . 1 . . . . 67 ILE HD1 . 11152 1 715 . 1 1 67 67 ILE HD12 H 1 1.026 0.030 . 1 . . . . 67 ILE HD1 . 11152 1 716 . 1 1 67 67 ILE HD13 H 1 1.026 0.030 . 1 . . . . 67 ILE HD1 . 11152 1 717 . 1 1 67 67 ILE HG12 H 1 1.545 0.030 . 2 . . . . 67 ILE HG12 . 11152 1 718 . 1 1 67 67 ILE HG13 H 1 1.367 0.030 . 2 . . . . 67 ILE HG13 . 11152 1 719 . 1 1 67 67 ILE HG21 H 1 1.393 0.030 . 1 . . . . 67 ILE HG2 . 11152 1 720 . 1 1 67 67 ILE HG22 H 1 1.393 0.030 . 1 . . . . 67 ILE HG2 . 11152 1 721 . 1 1 67 67 ILE HG23 H 1 1.393 0.030 . 1 . . . . 67 ILE HG2 . 11152 1 722 . 1 1 67 67 ILE C C 13 174.472 0.300 . 1 . . . . 67 ILE C . 11152 1 723 . 1 1 67 67 ILE CA C 13 57.843 0.300 . 1 . . . . 67 ILE CA . 11152 1 724 . 1 1 67 67 ILE CB C 13 39.300 0.300 . 1 . . . . 67 ILE CB . 11152 1 725 . 1 1 67 67 ILE CD1 C 13 13.923 0.300 . 1 . . . . 67 ILE CD1 . 11152 1 726 . 1 1 67 67 ILE CG1 C 13 27.235 0.300 . 1 . . . . 67 ILE CG1 . 11152 1 727 . 1 1 67 67 ILE CG2 C 13 18.581 0.300 . 1 . . . . 67 ILE CG2 . 11152 1 728 . 1 1 67 67 ILE N N 15 124.990 0.300 . 1 . . . . 67 ILE N . 11152 1 729 . 1 1 68 68 PRO HA H 1 4.921 0.030 . 1 . . . . 68 PRO HA . 11152 1 730 . 1 1 68 68 PRO HB2 H 1 2.356 0.030 . 2 . . . . 68 PRO HB2 . 11152 1 731 . 1 1 68 68 PRO HB3 H 1 2.100 0.030 . 2 . . . . 68 PRO HB3 . 11152 1 732 . 1 1 68 68 PRO HD2 H 1 3.673 0.030 . 2 . . . . 68 PRO HD2 . 11152 1 733 . 1 1 68 68 PRO HD3 H 1 4.071 0.030 . 2 . . . . 68 PRO HD3 . 11152 1 734 . 1 1 68 68 PRO HG2 H 1 1.964 0.030 . 2 . . . . 68 PRO HG2 . 11152 1 735 . 1 1 68 68 PRO HG3 H 1 2.095 0.030 . 2 . . . . 68 PRO HG3 . 11152 1 736 . 1 1 68 68 PRO C C 13 174.861 0.300 . 1 . . . . 68 PRO C . 11152 1 737 . 1 1 68 68 PRO CA C 13 63.641 0.300 . 1 . . . . 68 PRO CA . 11152 1 738 . 1 1 68 68 PRO CB C 13 30.713 0.300 . 1 . . . . 68 PRO CB . 11152 1 739 . 1 1 68 68 PRO CD C 13 50.871 0.300 . 1 . . . . 68 PRO CD . 11152 1 740 . 1 1 68 68 PRO CG C 13 26.637 0.300 . 1 . . . . 68 PRO CG . 11152 1 741 . 1 1 69 69 ASN H H 1 7.420 0.030 . 1 . . . . 69 ASN H . 11152 1 742 . 1 1 69 69 ASN HA H 1 5.188 0.030 . 1 . . . . 69 ASN HA . 11152 1 743 . 1 1 69 69 ASN HB2 H 1 3.135 0.030 . 2 . . . . 69 ASN HB2 . 11152 1 744 . 1 1 69 69 ASN HB3 H 1 2.898 0.030 . 2 . . . . 69 ASN HB3 . 11152 1 745 . 1 1 69 69 ASN HD21 H 1 7.166 0.030 . 2 . . . . 69 ASN HD21 . 11152 1 746 . 1 1 69 69 ASN HD22 H 1 7.860 0.030 . 2 . . . . 69 ASN HD22 . 11152 1 747 . 1 1 69 69 ASN C C 13 174.574 0.300 . 1 . . . . 69 ASN C . 11152 1 748 . 1 1 69 69 ASN CA C 13 49.698 0.300 . 1 . . . . 69 ASN CA . 11152 1 749 . 1 1 69 69 ASN CB C 13 40.226 0.300 . 1 . . . . 69 ASN CB . 11152 1 750 . 1 1 69 69 ASN N N 15 116.901 0.300 . 1 . . . . 69 ASN N . 11152 1 751 . 1 1 69 69 ASN ND2 N 15 112.221 0.300 . 1 . . . . 69 ASN ND2 . 11152 1 752 . 1 1 70 70 PRO HA H 1 4.189 0.030 . 1 . . . . 70 PRO HA . 11152 1 753 . 1 1 70 70 PRO HB2 H 1 2.027 0.030 . 2 . . . . 70 PRO HB2 . 11152 1 754 . 1 1 70 70 PRO HB3 H 1 1.675 0.030 . 2 . . . . 70 PRO HB3 . 11152 1 755 . 1 1 70 70 PRO HD2 H 1 3.984 0.030 . 2 . . . . 70 PRO HD2 . 11152 1 756 . 1 1 70 70 PRO HD3 H 1 3.697 0.030 . 2 . . . . 70 PRO HD3 . 11152 1 757 . 1 1 70 70 PRO HG2 H 1 1.952 0.030 . 2 . . . . 70 PRO HG2 . 11152 1 758 . 1 1 70 70 PRO HG3 H 1 1.802 0.030 . 2 . . . . 70 PRO HG3 . 11152 1 759 . 1 1 70 70 PRO C C 13 176.139 0.300 . 1 . . . . 70 PRO C . 11152 1 760 . 1 1 70 70 PRO CA C 13 63.973 0.300 . 1 . . . . 70 PRO CA . 11152 1 761 . 1 1 70 70 PRO CB C 13 32.601 0.300 . 1 . . . . 70 PRO CB . 11152 1 762 . 1 1 70 70 PRO CD C 13 50.549 0.300 . 1 . . . . 70 PRO CD . 11152 1 763 . 1 1 70 70 PRO CG C 13 26.801 0.300 . 1 . . . . 70 PRO CG . 11152 1 764 . 1 1 71 71 ALA H H 1 7.950 0.030 . 1 . . . . 71 ALA H . 11152 1 765 . 1 1 71 71 ALA HA H 1 4.450 0.030 . 1 . . . . 71 ALA HA . 11152 1 766 . 1 1 71 71 ALA HB1 H 1 1.411 0.030 . 1 . . . . 71 ALA HB . 11152 1 767 . 1 1 71 71 ALA HB2 H 1 1.411 0.030 . 1 . . . . 71 ALA HB . 11152 1 768 . 1 1 71 71 ALA HB3 H 1 1.411 0.030 . 1 . . . . 71 ALA HB . 11152 1 769 . 1 1 71 71 ALA C C 13 177.366 0.300 . 1 . . . . 71 ALA C . 11152 1 770 . 1 1 71 71 ALA CA C 13 52.258 0.300 . 1 . . . . 71 ALA CA . 11152 1 771 . 1 1 71 71 ALA CB C 13 18.997 0.300 . 1 . . . . 71 ALA CB . 11152 1 772 . 1 1 71 71 ALA N N 15 120.104 0.300 . 1 . . . . 71 ALA N . 11152 1 773 . 1 1 72 72 GLN H H 1 7.837 0.030 . 1 . . . . 72 GLN H . 11152 1 774 . 1 1 72 72 GLN HA H 1 4.319 0.030 . 1 . . . . 72 GLN HA . 11152 1 775 . 1 1 72 72 GLN HB2 H 1 2.427 0.030 . 2 . . . . 72 GLN HB2 . 11152 1 776 . 1 1 72 72 GLN HB3 H 1 1.934 0.030 . 2 . . . . 72 GLN HB3 . 11152 1 777 . 1 1 72 72 GLN HE21 H 1 7.257 0.030 . 2 . . . . 72 GLN HE21 . 11152 1 778 . 1 1 72 72 GLN HE22 H 1 7.778 0.030 . 2 . . . . 72 GLN HE22 . 11152 1 779 . 1 1 72 72 GLN HG2 H 1 2.531 0.030 . 2 . . . . 72 GLN HG2 . 11152 1 780 . 1 1 72 72 GLN HG3 H 1 2.421 0.030 . 2 . . . . 72 GLN HG3 . 11152 1 781 . 1 1 72 72 GLN C C 13 172.925 0.300 . 1 . . . . 72 GLN C . 11152 1 782 . 1 1 72 72 GLN CA C 13 55.431 0.300 . 1 . . . . 72 GLN CA . 11152 1 783 . 1 1 72 72 GLN CB C 13 27.846 0.300 . 1 . . . . 72 GLN CB . 11152 1 784 . 1 1 72 72 GLN CG C 13 33.823 0.300 . 1 . . . . 72 GLN CG . 11152 1 785 . 1 1 72 72 GLN N N 15 122.917 0.300 . 1 . . . . 72 GLN N . 11152 1 786 . 1 1 72 72 GLN NE2 N 15 111.002 0.300 . 1 . . . . 72 GLN NE2 . 11152 1 787 . 1 1 73 73 THR H H 1 7.340 0.030 . 1 . . . . 73 THR H . 11152 1 788 . 1 1 73 73 THR HA H 1 3.384 0.030 . 1 . . . . 73 THR HA . 11152 1 789 . 1 1 73 73 THR HB H 1 3.734 0.030 . 1 . . . . 73 THR HB . 11152 1 790 . 1 1 73 73 THR HG21 H 1 0.805 0.030 . 1 . . . . 73 THR HG2 . 11152 1 791 . 1 1 73 73 THR HG22 H 1 0.805 0.030 . 1 . . . . 73 THR HG2 . 11152 1 792 . 1 1 73 73 THR HG23 H 1 0.805 0.030 . 1 . . . . 73 THR HG2 . 11152 1 793 . 1 1 73 73 THR C C 13 171.193 0.300 . 1 . . . . 73 THR C . 11152 1 794 . 1 1 73 73 THR CA C 13 58.520 0.300 . 1 . . . . 73 THR CA . 11152 1 795 . 1 1 73 73 THR CB C 13 66.894 0.300 . 1 . . . . 73 THR CB . 11152 1 796 . 1 1 73 73 THR CG2 C 13 20.942 0.300 . 1 . . . . 73 THR CG2 . 11152 1 797 . 1 1 73 73 THR N N 15 112.338 0.300 . 1 . . . . 73 THR N . 11152 1 798 . 1 1 74 74 SER H H 1 6.530 0.030 . 1 . . . . 74 SER H . 11152 1 799 . 1 1 74 74 SER HA H 1 4.699 0.030 . 1 . . . . 74 SER HA . 11152 1 800 . 1 1 74 74 SER HB2 H 1 3.393 0.030 . 2 . . . . 74 SER HB2 . 11152 1 801 . 1 1 74 74 SER HB3 H 1 3.328 0.030 . 2 . . . . 74 SER HB3 . 11152 1 802 . 1 1 74 74 SER C C 13 173.378 0.300 . 1 . . . . 74 SER C . 11152 1 803 . 1 1 74 74 SER CA C 13 56.535 0.300 . 1 . . . . 74 SER CA . 11152 1 804 . 1 1 74 74 SER CB C 13 66.031 0.300 . 1 . . . . 74 SER CB . 11152 1 805 . 1 1 74 74 SER N N 15 108.735 0.300 . 1 . . . . 74 SER N . 11152 1 806 . 1 1 75 75 VAL H H 1 8.878 0.030 . 1 . . . . 75 VAL H . 11152 1 807 . 1 1 75 75 VAL HA H 1 4.540 0.030 . 1 . . . . 75 VAL HA . 11152 1 808 . 1 1 75 75 VAL HB H 1 2.166 0.030 . 1 . . . . 75 VAL HB . 11152 1 809 . 1 1 75 75 VAL HG11 H 1 1.025 0.030 . 1 . . . . 75 VAL HG1 . 11152 1 810 . 1 1 75 75 VAL HG12 H 1 1.025 0.030 . 1 . . . . 75 VAL HG1 . 11152 1 811 . 1 1 75 75 VAL HG13 H 1 1.025 0.030 . 1 . . . . 75 VAL HG1 . 11152 1 812 . 1 1 75 75 VAL HG21 H 1 1.073 0.030 . 1 . . . . 75 VAL HG2 . 11152 1 813 . 1 1 75 75 VAL HG22 H 1 1.073 0.030 . 1 . . . . 75 VAL HG2 . 11152 1 814 . 1 1 75 75 VAL HG23 H 1 1.073 0.030 . 1 . . . . 75 VAL HG2 . 11152 1 815 . 1 1 75 75 VAL C C 13 171.951 0.300 . 1 . . . . 75 VAL C . 11152 1 816 . 1 1 75 75 VAL CA C 13 60.395 0.300 . 1 . . . . 75 VAL CA . 11152 1 817 . 1 1 75 75 VAL CB C 13 35.784 0.300 . 1 . . . . 75 VAL CB . 11152 1 818 . 1 1 75 75 VAL CG1 C 13 20.658 0.300 . 2 . . . . 75 VAL CG1 . 11152 1 819 . 1 1 75 75 VAL CG2 C 13 21.175 0.300 . 2 . . . . 75 VAL CG2 . 11152 1 820 . 1 1 75 75 VAL N N 15 118.164 0.300 . 1 . . . . 75 VAL N . 11152 1 821 . 1 1 76 76 VAL H H 1 8.158 0.030 . 1 . . . . 76 VAL H . 11152 1 822 . 1 1 76 76 VAL HA H 1 4.668 0.030 . 1 . . . . 76 VAL HA . 11152 1 823 . 1 1 76 76 VAL HB H 1 1.855 0.030 . 1 . . . . 76 VAL HB . 11152 1 824 . 1 1 76 76 VAL HG11 H 1 0.696 0.030 . 1 . . . . 76 VAL HG1 . 11152 1 825 . 1 1 76 76 VAL HG12 H 1 0.696 0.030 . 1 . . . . 76 VAL HG1 . 11152 1 826 . 1 1 76 76 VAL HG13 H 1 0.696 0.030 . 1 . . . . 76 VAL HG1 . 11152 1 827 . 1 1 76 76 VAL HG21 H 1 0.825 0.030 . 1 . . . . 76 VAL HG2 . 11152 1 828 . 1 1 76 76 VAL HG22 H 1 0.825 0.030 . 1 . . . . 76 VAL HG2 . 11152 1 829 . 1 1 76 76 VAL HG23 H 1 0.825 0.030 . 1 . . . . 76 VAL HG2 . 11152 1 830 . 1 1 76 76 VAL C C 13 175.369 0.300 . 1 . . . . 76 VAL C . 11152 1 831 . 1 1 76 76 VAL CA C 13 62.013 0.300 . 1 . . . . 76 VAL CA . 11152 1 832 . 1 1 76 76 VAL CB C 13 32.653 0.300 . 1 . . . . 76 VAL CB . 11152 1 833 . 1 1 76 76 VAL CG1 C 13 21.002 0.300 . 2 . . . . 76 VAL CG1 . 11152 1 834 . 1 1 76 76 VAL CG2 C 13 21.707 0.300 . 2 . . . . 76 VAL CG2 . 11152 1 835 . 1 1 76 76 VAL N N 15 125.480 0.300 . 1 . . . . 76 VAL N . 11152 1 836 . 1 1 77 77 VAL H H 1 9.130 0.030 . 1 . . . . 77 VAL H . 11152 1 837 . 1 1 77 77 VAL HA H 1 4.193 0.030 . 1 . . . . 77 VAL HA . 11152 1 838 . 1 1 77 77 VAL HB H 1 1.681 0.030 . 1 . . . . 77 VAL HB . 11152 1 839 . 1 1 77 77 VAL HG11 H 1 0.588 0.030 . 1 . . . . 77 VAL HG1 . 11152 1 840 . 1 1 77 77 VAL HG12 H 1 0.588 0.030 . 1 . . . . 77 VAL HG1 . 11152 1 841 . 1 1 77 77 VAL HG13 H 1 0.588 0.030 . 1 . . . . 77 VAL HG1 . 11152 1 842 . 1 1 77 77 VAL HG21 H 1 0.699 0.030 . 1 . . . . 77 VAL HG2 . 11152 1 843 . 1 1 77 77 VAL HG22 H 1 0.699 0.030 . 1 . . . . 77 VAL HG2 . 11152 1 844 . 1 1 77 77 VAL HG23 H 1 0.699 0.030 . 1 . . . . 77 VAL HG2 . 11152 1 845 . 1 1 77 77 VAL C C 13 174.238 0.300 . 1 . . . . 77 VAL C . 11152 1 846 . 1 1 77 77 VAL CA C 13 61.439 0.300 . 1 . . . . 77 VAL CA . 11152 1 847 . 1 1 77 77 VAL CB C 13 33.614 0.300 . 1 . . . . 77 VAL CB . 11152 1 848 . 1 1 77 77 VAL CG1 C 13 21.929 0.300 . 2 . . . . 77 VAL CG1 . 11152 1 849 . 1 1 77 77 VAL CG2 C 13 20.976 0.300 . 2 . . . . 77 VAL CG2 . 11152 1 850 . 1 1 77 77 VAL N N 15 127.943 0.300 . 1 . . . . 77 VAL N . 11152 1 851 . 1 1 78 78 GLU H H 1 8.420 0.030 . 1 . . . . 78 GLU H . 11152 1 852 . 1 1 78 78 GLU HA H 1 4.809 0.030 . 1 . . . . 78 GLU HA . 11152 1 853 . 1 1 78 78 GLU HB2 H 1 2.047 0.030 . 2 . . . . 78 GLU HB2 . 11152 1 854 . 1 1 78 78 GLU HB3 H 1 1.741 0.030 . 2 . . . . 78 GLU HB3 . 11152 1 855 . 1 1 78 78 GLU HG2 H 1 2.109 0.030 . 2 . . . . 78 GLU HG2 . 11152 1 856 . 1 1 78 78 GLU HG3 H 1 1.984 0.030 . 2 . . . . 78 GLU HG3 . 11152 1 857 . 1 1 78 78 GLU C C 13 174.669 0.300 . 1 . . . . 78 GLU C . 11152 1 858 . 1 1 78 78 GLU CA C 13 54.522 0.300 . 1 . . . . 78 GLU CA . 11152 1 859 . 1 1 78 78 GLU CB C 13 33.038 0.300 . 1 . . . . 78 GLU CB . 11152 1 860 . 1 1 78 78 GLU CG C 13 36.661 0.300 . 1 . . . . 78 GLU CG . 11152 1 861 . 1 1 78 78 GLU N N 15 123.998 0.300 . 1 . . . . 78 GLU N . 11152 1 862 . 1 1 79 79 ASP H H 1 8.840 0.030 . 1 . . . . 79 ASP H . 11152 1 863 . 1 1 79 79 ASP HA H 1 4.217 0.030 . 1 . . . . 79 ASP HA . 11152 1 864 . 1 1 79 79 ASP HB2 H 1 2.862 0.030 . 2 . . . . 79 ASP HB2 . 11152 1 865 . 1 1 79 79 ASP HB3 H 1 2.704 0.030 . 2 . . . . 79 ASP HB3 . 11152 1 866 . 1 1 79 79 ASP C C 13 175.495 0.300 . 1 . . . . 79 ASP C . 11152 1 867 . 1 1 79 79 ASP CA C 13 55.320 0.300 . 1 . . . . 79 ASP CA . 11152 1 868 . 1 1 79 79 ASP CB C 13 39.111 0.300 . 1 . . . . 79 ASP CB . 11152 1 869 . 1 1 79 79 ASP N N 15 114.849 0.300 . 1 . . . . 79 ASP N . 11152 1 870 . 1 1 80 80 LEU H H 1 8.348 0.030 . 1 . . . . 80 LEU H . 11152 1 871 . 1 1 80 80 LEU HA H 1 4.260 0.030 . 1 . . . . 80 LEU HA . 11152 1 872 . 1 1 80 80 LEU HB2 H 1 1.060 0.030 . 2 . . . . 80 LEU HB2 . 11152 1 873 . 1 1 80 80 LEU HB3 H 1 1.002 0.030 . 2 . . . . 80 LEU HB3 . 11152 1 874 . 1 1 80 80 LEU HD11 H 1 0.237 0.030 . 1 . . . . 80 LEU HD1 . 11152 1 875 . 1 1 80 80 LEU HD12 H 1 0.237 0.030 . 1 . . . . 80 LEU HD1 . 11152 1 876 . 1 1 80 80 LEU HD13 H 1 0.237 0.030 . 1 . . . . 80 LEU HD1 . 11152 1 877 . 1 1 80 80 LEU HD21 H 1 -0.109 0.030 . 1 . . . . 80 LEU HD2 . 11152 1 878 . 1 1 80 80 LEU HD22 H 1 -0.109 0.030 . 1 . . . . 80 LEU HD2 . 11152 1 879 . 1 1 80 80 LEU HD23 H 1 -0.109 0.030 . 1 . . . . 80 LEU HD2 . 11152 1 880 . 1 1 80 80 LEU HG H 1 1.089 0.030 . 1 . . . . 80 LEU HG . 11152 1 881 . 1 1 80 80 LEU C C 13 176.905 0.300 . 1 . . . . 80 LEU C . 11152 1 882 . 1 1 80 80 LEU CA C 13 54.003 0.300 . 1 . . . . 80 LEU CA . 11152 1 883 . 1 1 80 80 LEU CB C 13 42.024 0.300 . 1 . . . . 80 LEU CB . 11152 1 884 . 1 1 80 80 LEU CD1 C 13 26.702 0.300 . 2 . . . . 80 LEU CD1 . 11152 1 885 . 1 1 80 80 LEU CD2 C 13 20.829 0.300 . 2 . . . . 80 LEU CD2 . 11152 1 886 . 1 1 80 80 LEU CG C 13 26.297 0.300 . 1 . . . . 80 LEU CG . 11152 1 887 . 1 1 80 80 LEU N N 15 118.906 0.300 . 1 . . . . 80 LEU N . 11152 1 888 . 1 1 81 81 LEU H H 1 8.444 0.030 . 1 . . . . 81 LEU H . 11152 1 889 . 1 1 81 81 LEU HA H 1 4.662 0.030 . 1 . . . . 81 LEU HA . 11152 1 890 . 1 1 81 81 LEU HB2 H 1 1.397 0.030 . 2 . . . . 81 LEU HB2 . 11152 1 891 . 1 1 81 81 LEU HB3 H 1 0.832 0.030 . 2 . . . . 81 LEU HB3 . 11152 1 892 . 1 1 81 81 LEU HD11 H 1 0.534 0.030 . 1 . . . . 81 LEU HD1 . 11152 1 893 . 1 1 81 81 LEU HD12 H 1 0.534 0.030 . 1 . . . . 81 LEU HD1 . 11152 1 894 . 1 1 81 81 LEU HD13 H 1 0.534 0.030 . 1 . . . . 81 LEU HD1 . 11152 1 895 . 1 1 81 81 LEU HD21 H 1 0.713 0.030 . 1 . . . . 81 LEU HD2 . 11152 1 896 . 1 1 81 81 LEU HD22 H 1 0.713 0.030 . 1 . . . . 81 LEU HD2 . 11152 1 897 . 1 1 81 81 LEU HD23 H 1 0.713 0.030 . 1 . . . . 81 LEU HD2 . 11152 1 898 . 1 1 81 81 LEU HG H 1 1.557 0.030 . 1 . . . . 81 LEU HG . 11152 1 899 . 1 1 81 81 LEU C C 13 174.823 0.300 . 1 . . . . 81 LEU C . 11152 1 900 . 1 1 81 81 LEU CA C 13 51.986 0.300 . 1 . . . . 81 LEU CA . 11152 1 901 . 1 1 81 81 LEU CB C 13 42.130 0.300 . 1 . . . . 81 LEU CB . 11152 1 902 . 1 1 81 81 LEU CD1 C 13 24.988 0.300 . 2 . . . . 81 LEU CD1 . 11152 1 903 . 1 1 81 81 LEU CD2 C 13 22.819 0.300 . 2 . . . . 81 LEU CD2 . 11152 1 904 . 1 1 81 81 LEU CG C 13 26.348 0.300 . 1 . . . . 81 LEU CG . 11152 1 905 . 1 1 81 81 LEU N N 15 121.288 0.300 . 1 . . . . 81 LEU N . 11152 1 906 . 1 1 82 82 PRO HA H 1 4.348 0.030 . 1 . . . . 82 PRO HA . 11152 1 907 . 1 1 82 82 PRO HB2 H 1 2.421 0.030 . 2 . . . . 82 PRO HB2 . 11152 1 908 . 1 1 82 82 PRO HB3 H 1 1.874 0.030 . 2 . . . . 82 PRO HB3 . 11152 1 909 . 1 1 82 82 PRO HD2 H 1 3.677 0.030 . 2 . . . . 82 PRO HD2 . 11152 1 910 . 1 1 82 82 PRO HD3 H 1 4.151 0.030 . 2 . . . . 82 PRO HD3 . 11152 1 911 . 1 1 82 82 PRO HG2 H 1 2.072 0.030 . 2 . . . . 82 PRO HG2 . 11152 1 912 . 1 1 82 82 PRO HG3 H 1 1.980 0.030 . 2 . . . . 82 PRO HG3 . 11152 1 913 . 1 1 82 82 PRO C C 13 179.208 0.300 . 1 . . . . 82 PRO C . 11152 1 914 . 1 1 82 82 PRO CA C 13 63.140 0.300 . 1 . . . . 82 PRO CA . 11152 1 915 . 1 1 82 82 PRO CB C 13 32.612 0.300 . 1 . . . . 82 PRO CB . 11152 1 916 . 1 1 82 82 PRO CD C 13 50.888 0.300 . 1 . . . . 82 PRO CD . 11152 1 917 . 1 1 82 82 PRO CG C 13 27.335 0.300 . 1 . . . . 82 PRO CG . 11152 1 918 . 1 1 83 83 ASN H H 1 9.024 0.030 . 1 . . . . 83 ASN H . 11152 1 919 . 1 1 83 83 ASN HA H 1 4.376 0.030 . 1 . . . . 83 ASN HA . 11152 1 920 . 1 1 83 83 ASN HB2 H 1 3.034 0.030 . 2 . . . . 83 ASN HB2 . 11152 1 921 . 1 1 83 83 ASN HB3 H 1 2.971 0.030 . 2 . . . . 83 ASN HB3 . 11152 1 922 . 1 1 83 83 ASN HD21 H 1 7.050 0.030 . 2 . . . . 83 ASN HD21 . 11152 1 923 . 1 1 83 83 ASN HD22 H 1 7.623 0.030 . 2 . . . . 83 ASN HD22 . 11152 1 924 . 1 1 83 83 ASN C C 13 173.876 0.300 . 1 . . . . 83 ASN C . 11152 1 925 . 1 1 83 83 ASN CA C 13 55.152 0.300 . 1 . . . . 83 ASN CA . 11152 1 926 . 1 1 83 83 ASN CB C 13 37.633 0.300 . 1 . . . . 83 ASN CB . 11152 1 927 . 1 1 83 83 ASN N N 15 117.990 0.300 . 1 . . . . 83 ASN N . 11152 1 928 . 1 1 83 83 ASN ND2 N 15 113.294 0.300 . 1 . . . . 83 ASN ND2 . 11152 1 929 . 1 1 84 84 HIS H H 1 7.819 0.030 . 1 . . . . 84 HIS H . 11152 1 930 . 1 1 84 84 HIS HA H 1 4.768 0.030 . 1 . . . . 84 HIS HA . 11152 1 931 . 1 1 84 84 HIS HB2 H 1 3.155 0.030 . 2 . . . . 84 HIS HB2 . 11152 1 932 . 1 1 84 84 HIS HB3 H 1 2.783 0.030 . 2 . . . . 84 HIS HB3 . 11152 1 933 . 1 1 84 84 HIS HD2 H 1 7.026 0.030 . 1 . . . . 84 HIS HD2 . 11152 1 934 . 1 1 84 84 HIS HE1 H 1 7.923 0.030 . 1 . . . . 84 HIS HE1 . 11152 1 935 . 1 1 84 84 HIS C C 13 174.131 0.300 . 1 . . . . 84 HIS C . 11152 1 936 . 1 1 84 84 HIS CA C 13 55.880 0.300 . 1 . . . . 84 HIS CA . 11152 1 937 . 1 1 84 84 HIS CB C 13 31.955 0.300 . 1 . . . . 84 HIS CB . 11152 1 938 . 1 1 84 84 HIS CD2 C 13 124.774 0.300 . 1 . . . . 84 HIS CD2 . 11152 1 939 . 1 1 84 84 HIS CE1 C 13 138.240 0.300 . 1 . . . . 84 HIS CE1 . 11152 1 940 . 1 1 84 84 HIS N N 15 116.509 0.300 . 1 . . . . 84 HIS N . 11152 1 941 . 1 1 85 85 SER H H 1 8.656 0.030 . 1 . . . . 85 SER H . 11152 1 942 . 1 1 85 85 SER HA H 1 5.459 0.030 . 1 . . . . 85 SER HA . 11152 1 943 . 1 1 85 85 SER HB2 H 1 3.582 0.030 . 1 . . . . 85 SER HB2 . 11152 1 944 . 1 1 85 85 SER HB3 H 1 3.582 0.030 . 1 . . . . 85 SER HB3 . 11152 1 945 . 1 1 85 85 SER C C 13 173.276 0.300 . 1 . . . . 85 SER C . 11152 1 946 . 1 1 85 85 SER CA C 13 57.869 0.300 . 1 . . . . 85 SER CA . 11152 1 947 . 1 1 85 85 SER CB C 13 64.487 0.300 . 1 . . . . 85 SER CB . 11152 1 948 . 1 1 85 85 SER N N 15 116.459 0.300 . 1 . . . . 85 SER N . 11152 1 949 . 1 1 86 86 TYR H H 1 9.502 0.030 . 1 . . . . 86 TYR H . 11152 1 950 . 1 1 86 86 TYR HA H 1 4.986 0.030 . 1 . . . . 86 TYR HA . 11152 1 951 . 1 1 86 86 TYR HB2 H 1 2.734 0.030 . 2 . . . . 86 TYR HB2 . 11152 1 952 . 1 1 86 86 TYR HB3 H 1 2.636 0.030 . 2 . . . . 86 TYR HB3 . 11152 1 953 . 1 1 86 86 TYR HD1 H 1 6.858 0.030 . 1 . . . . 86 TYR HD1 . 11152 1 954 . 1 1 86 86 TYR HD2 H 1 6.858 0.030 . 1 . . . . 86 TYR HD2 . 11152 1 955 . 1 1 86 86 TYR HE1 H 1 6.857 0.030 . 1 . . . . 86 TYR HE1 . 11152 1 956 . 1 1 86 86 TYR HE2 H 1 6.857 0.030 . 1 . . . . 86 TYR HE2 . 11152 1 957 . 1 1 86 86 TYR C C 13 174.136 0.300 . 1 . . . . 86 TYR C . 11152 1 958 . 1 1 86 86 TYR CA C 13 57.954 0.300 . 1 . . . . 86 TYR CA . 11152 1 959 . 1 1 86 86 TYR CB C 13 44.390 0.300 . 1 . . . . 86 TYR CB . 11152 1 960 . 1 1 86 86 TYR CD1 C 13 132.542 0.300 . 1 . . . . 86 TYR CD1 . 11152 1 961 . 1 1 86 86 TYR CD2 C 13 132.542 0.300 . 1 . . . . 86 TYR CD2 . 11152 1 962 . 1 1 86 86 TYR CE1 C 13 118.200 0.300 . 1 . . . . 86 TYR CE1 . 11152 1 963 . 1 1 86 86 TYR CE2 C 13 118.200 0.300 . 1 . . . . 86 TYR CE2 . 11152 1 964 . 1 1 86 86 TYR N N 15 124.268 0.300 . 1 . . . . 86 TYR N . 11152 1 965 . 1 1 87 87 VAL H H 1 9.016 0.030 . 1 . . . . 87 VAL H . 11152 1 966 . 1 1 87 87 VAL HA H 1 5.109 0.030 . 1 . . . . 87 VAL HA . 11152 1 967 . 1 1 87 87 VAL HB H 1 1.942 0.030 . 1 . . . . 87 VAL HB . 11152 1 968 . 1 1 87 87 VAL HG11 H 1 0.935 0.030 . 1 . . . . 87 VAL HG1 . 11152 1 969 . 1 1 87 87 VAL HG12 H 1 0.935 0.030 . 1 . . . . 87 VAL HG1 . 11152 1 970 . 1 1 87 87 VAL HG13 H 1 0.935 0.030 . 1 . . . . 87 VAL HG1 . 11152 1 971 . 1 1 87 87 VAL HG21 H 1 0.953 0.030 . 1 . . . . 87 VAL HG2 . 11152 1 972 . 1 1 87 87 VAL HG22 H 1 0.953 0.030 . 1 . . . . 87 VAL HG2 . 11152 1 973 . 1 1 87 87 VAL HG23 H 1 0.953 0.030 . 1 . . . . 87 VAL HG2 . 11152 1 974 . 1 1 87 87 VAL C C 13 173.637 0.300 . 1 . . . . 87 VAL C . 11152 1 975 . 1 1 87 87 VAL CA C 13 59.737 0.300 . 1 . . . . 87 VAL CA . 11152 1 976 . 1 1 87 87 VAL CB C 13 34.379 0.300 . 1 . . . . 87 VAL CB . 11152 1 977 . 1 1 87 87 VAL CG1 C 13 19.869 0.300 . 2 . . . . 87 VAL CG1 . 11152 1 978 . 1 1 87 87 VAL CG2 C 13 22.105 0.300 . 2 . . . . 87 VAL CG2 . 11152 1 979 . 1 1 87 87 VAL N N 15 118.747 0.300 . 1 . . . . 87 VAL N . 11152 1 980 . 1 1 88 88 PHE H H 1 9.319 0.030 . 1 . . . . 88 PHE H . 11152 1 981 . 1 1 88 88 PHE HA H 1 5.442 0.030 . 1 . . . . 88 PHE HA . 11152 1 982 . 1 1 88 88 PHE HB2 H 1 3.175 0.030 . 2 . . . . 88 PHE HB2 . 11152 1 983 . 1 1 88 88 PHE HB3 H 1 2.648 0.030 . 2 . . . . 88 PHE HB3 . 11152 1 984 . 1 1 88 88 PHE HD1 H 1 6.973 0.030 . 1 . . . . 88 PHE HD1 . 11152 1 985 . 1 1 88 88 PHE HD2 H 1 6.973 0.030 . 1 . . . . 88 PHE HD2 . 11152 1 986 . 1 1 88 88 PHE HE1 H 1 6.526 0.030 . 1 . . . . 88 PHE HE1 . 11152 1 987 . 1 1 88 88 PHE HE2 H 1 6.526 0.030 . 1 . . . . 88 PHE HE2 . 11152 1 988 . 1 1 88 88 PHE HZ H 1 6.178 0.030 . 1 . . . . 88 PHE HZ . 11152 1 989 . 1 1 88 88 PHE C C 13 175.658 0.300 . 1 . . . . 88 PHE C . 11152 1 990 . 1 1 88 88 PHE CA C 13 56.254 0.300 . 1 . . . . 88 PHE CA . 11152 1 991 . 1 1 88 88 PHE CB C 13 44.441 0.300 . 1 . . . . 88 PHE CB . 11152 1 992 . 1 1 88 88 PHE CD1 C 13 131.260 0.300 . 1 . . . . 88 PHE CD1 . 11152 1 993 . 1 1 88 88 PHE CD2 C 13 131.260 0.300 . 1 . . . . 88 PHE CD2 . 11152 1 994 . 1 1 88 88 PHE CE1 C 13 131.200 0.300 . 1 . . . . 88 PHE CE1 . 11152 1 995 . 1 1 88 88 PHE CE2 C 13 131.200 0.300 . 1 . . . . 88 PHE CE2 . 11152 1 996 . 1 1 88 88 PHE CZ C 13 128.784 0.300 . 1 . . . . 88 PHE CZ . 11152 1 997 . 1 1 88 88 PHE N N 15 125.076 0.300 . 1 . . . . 88 PHE N . 11152 1 998 . 1 1 89 89 ARG H H 1 9.413 0.030 . 1 . . . . 89 ARG H . 11152 1 999 . 1 1 89 89 ARG HA H 1 5.484 0.030 . 1 . . . . 89 ARG HA . 11152 1 1000 . 1 1 89 89 ARG HB2 H 1 1.663 0.030 . 2 . . . . 89 ARG HB2 . 11152 1 1001 . 1 1 89 89 ARG HB3 H 1 1.413 0.030 . 2 . . . . 89 ARG HB3 . 11152 1 1002 . 1 1 89 89 ARG HD2 H 1 3.126 0.030 . 2 . . . . 89 ARG HD2 . 11152 1 1003 . 1 1 89 89 ARG HD3 H 1 3.126 0.030 . 2 . . . . 89 ARG HD3 . 11152 1 1004 . 1 1 89 89 ARG HE H 1 7.526 0.030 . 1 . . . . 89 ARG HE . 11152 1 1005 . 1 1 89 89 ARG HG2 H 1 1.480 0.030 . 1 . . . . 89 ARG HG2 . 11152 1 1006 . 1 1 89 89 ARG HG3 H 1 1.480 0.030 . 1 . . . . 89 ARG HG3 . 11152 1 1007 . 1 1 89 89 ARG C C 13 175.991 0.300 . 1 . . . . 89 ARG C . 11152 1 1008 . 1 1 89 89 ARG CA C 13 54.613 0.300 . 1 . . . . 89 ARG CA . 11152 1 1009 . 1 1 89 89 ARG CB C 13 33.970 0.300 . 1 . . . . 89 ARG CB . 11152 1 1010 . 1 1 89 89 ARG CD C 13 43.208 0.300 . 1 . . . . 89 ARG CD . 11152 1 1011 . 1 1 89 89 ARG CG C 13 28.766 0.300 . 1 . . . . 89 ARG CG . 11152 1 1012 . 1 1 89 89 ARG N N 15 117.400 0.300 . 1 . . . . 89 ARG N . 11152 1 1013 . 1 1 89 89 ARG NE N 15 85.343 0.300 . 1 . . . . 89 ARG NE . 11152 1 1014 . 1 1 90 90 VAL H H 1 8.853 0.030 . 1 . . . . 90 VAL H . 11152 1 1015 . 1 1 90 90 VAL HA H 1 5.111 0.030 . 1 . . . . 90 VAL HA . 11152 1 1016 . 1 1 90 90 VAL HB H 1 1.325 0.030 . 1 . . . . 90 VAL HB . 11152 1 1017 . 1 1 90 90 VAL HG11 H 1 -0.298 0.030 . 1 . . . . 90 VAL HG1 . 11152 1 1018 . 1 1 90 90 VAL HG12 H 1 -0.298 0.030 . 1 . . . . 90 VAL HG1 . 11152 1 1019 . 1 1 90 90 VAL HG13 H 1 -0.298 0.030 . 1 . . . . 90 VAL HG1 . 11152 1 1020 . 1 1 90 90 VAL HG21 H 1 0.421 0.030 . 1 . . . . 90 VAL HG2 . 11152 1 1021 . 1 1 90 90 VAL HG22 H 1 0.421 0.030 . 1 . . . . 90 VAL HG2 . 11152 1 1022 . 1 1 90 90 VAL HG23 H 1 0.421 0.030 . 1 . . . . 90 VAL HG2 . 11152 1 1023 . 1 1 90 90 VAL C C 13 174.162 0.300 . 1 . . . . 90 VAL C . 11152 1 1024 . 1 1 90 90 VAL CA C 13 60.737 0.300 . 1 . . . . 90 VAL CA . 11152 1 1025 . 1 1 90 90 VAL CB C 13 34.818 0.300 . 1 . . . . 90 VAL CB . 11152 1 1026 . 1 1 90 90 VAL CG1 C 13 18.512 0.300 . 2 . . . . 90 VAL CG1 . 11152 1 1027 . 1 1 90 90 VAL CG2 C 13 21.570 0.300 . 2 . . . . 90 VAL CG2 . 11152 1 1028 . 1 1 90 90 VAL N N 15 124.539 0.300 . 1 . . . . 90 VAL N . 11152 1 1029 . 1 1 91 91 ARG H H 1 8.430 0.030 . 1 . . . . 91 ARG H . 11152 1 1030 . 1 1 91 91 ARG HA H 1 4.797 0.030 . 1 . . . . 91 ARG HA . 11152 1 1031 . 1 1 91 91 ARG HB2 H 1 1.796 0.030 . 1 . . . . 91 ARG HB2 . 11152 1 1032 . 1 1 91 91 ARG HB3 H 1 1.796 0.030 . 1 . . . . 91 ARG HB3 . 11152 1 1033 . 1 1 91 91 ARG HD2 H 1 2.974 0.030 . 2 . . . . 91 ARG HD2 . 11152 1 1034 . 1 1 91 91 ARG HD3 H 1 2.904 0.030 . 2 . . . . 91 ARG HD3 . 11152 1 1035 . 1 1 91 91 ARG HE H 1 6.746 0.030 . 1 . . . . 91 ARG HE . 11152 1 1036 . 1 1 91 91 ARG HG2 H 1 1.565 0.030 . 1 . . . . 91 ARG HG2 . 11152 1 1037 . 1 1 91 91 ARG HG3 H 1 1.565 0.030 . 1 . . . . 91 ARG HG3 . 11152 1 1038 . 1 1 91 91 ARG C C 13 173.973 0.300 . 1 . . . . 91 ARG C . 11152 1 1039 . 1 1 91 91 ARG CA C 13 54.310 0.300 . 1 . . . . 91 ARG CA . 11152 1 1040 . 1 1 91 91 ARG CB C 13 35.559 0.300 . 1 . . . . 91 ARG CB . 11152 1 1041 . 1 1 91 91 ARG CD C 13 44.000 0.300 . 1 . . . . 91 ARG CD . 11152 1 1042 . 1 1 91 91 ARG CG C 13 26.522 0.300 . 1 . . . . 91 ARG CG . 11152 1 1043 . 1 1 91 91 ARG N N 15 123.001 0.300 . 1 . . . . 91 ARG N . 11152 1 1044 . 1 1 91 91 ARG NE N 15 84.002 0.300 . 1 . . . . 91 ARG NE . 11152 1 1045 . 1 1 92 92 ALA H H 1 9.200 0.030 . 1 . . . . 92 ALA H . 11152 1 1046 . 1 1 92 92 ALA HA H 1 5.447 0.030 . 1 . . . . 92 ALA HA . 11152 1 1047 . 1 1 92 92 ALA HB1 H 1 1.457 0.030 . 1 . . . . 92 ALA HB . 11152 1 1048 . 1 1 92 92 ALA HB2 H 1 1.457 0.030 . 1 . . . . 92 ALA HB . 11152 1 1049 . 1 1 92 92 ALA HB3 H 1 1.457 0.030 . 1 . . . . 92 ALA HB . 11152 1 1050 . 1 1 92 92 ALA C C 13 174.302 0.300 . 1 . . . . 92 ALA C . 11152 1 1051 . 1 1 92 92 ALA CA C 13 50.250 0.300 . 1 . . . . 92 ALA CA . 11152 1 1052 . 1 1 92 92 ALA CB C 13 24.644 0.300 . 1 . . . . 92 ALA CB . 11152 1 1053 . 1 1 92 92 ALA N N 15 122.977 0.300 . 1 . . . . 92 ALA N . 11152 1 1054 . 1 1 93 93 GLN H H 1 8.065 0.030 . 1 . . . . 93 GLN H . 11152 1 1055 . 1 1 93 93 GLN HA H 1 4.411 0.030 . 1 . . . . 93 GLN HA . 11152 1 1056 . 1 1 93 93 GLN HB2 H 1 0.546 0.030 . 2 . . . . 93 GLN HB2 . 11152 1 1057 . 1 1 93 93 GLN HB3 H 1 -0.350 0.030 . 2 . . . . 93 GLN HB3 . 11152 1 1058 . 1 1 93 93 GLN HE21 H 1 6.321 0.030 . 2 . . . . 93 GLN HE21 . 11152 1 1059 . 1 1 93 93 GLN HE22 H 1 6.538 0.030 . 2 . . . . 93 GLN HE22 . 11152 1 1060 . 1 1 93 93 GLN HG2 H 1 1.541 0.030 . 2 . . . . 93 GLN HG2 . 11152 1 1061 . 1 1 93 93 GLN HG3 H 1 0.556 0.030 . 2 . . . . 93 GLN HG3 . 11152 1 1062 . 1 1 93 93 GLN C C 13 175.199 0.300 . 1 . . . . 93 GLN C . 11152 1 1063 . 1 1 93 93 GLN CA C 13 53.640 0.300 . 1 . . . . 93 GLN CA . 11152 1 1064 . 1 1 93 93 GLN CB C 13 29.982 0.300 . 1 . . . . 93 GLN CB . 11152 1 1065 . 1 1 93 93 GLN CG C 13 32.325 0.300 . 1 . . . . 93 GLN CG . 11152 1 1066 . 1 1 93 93 GLN N N 15 119.857 0.300 . 1 . . . . 93 GLN N . 11152 1 1067 . 1 1 93 93 GLN NE2 N 15 109.593 0.300 . 1 . . . . 93 GLN NE2 . 11152 1 1068 . 1 1 94 94 SER H H 1 8.710 0.030 . 1 . . . . 94 SER H . 11152 1 1069 . 1 1 94 94 SER HA H 1 4.773 0.030 . 1 . . . . 94 SER HA . 11152 1 1070 . 1 1 94 94 SER HB2 H 1 4.179 0.030 . 2 . . . . 94 SER HB2 . 11152 1 1071 . 1 1 94 94 SER HB3 H 1 3.790 0.030 . 2 . . . . 94 SER HB3 . 11152 1 1072 . 1 1 94 94 SER C C 13 174.616 0.300 . 1 . . . . 94 SER C . 11152 1 1073 . 1 1 94 94 SER CA C 13 56.080 0.300 . 1 . . . . 94 SER CA . 11152 1 1074 . 1 1 94 94 SER CB C 13 68.258 0.300 . 1 . . . . 94 SER CB . 11152 1 1075 . 1 1 94 94 SER N N 15 121.470 0.300 . 1 . . . . 94 SER N . 11152 1 1076 . 1 1 95 95 GLN H H 1 9.546 0.030 . 1 . . . . 95 GLN H . 11152 1 1077 . 1 1 95 95 GLN HA H 1 3.934 0.030 . 1 . . . . 95 GLN HA . 11152 1 1078 . 1 1 95 95 GLN HB2 H 1 2.026 0.030 . 2 . . . . 95 GLN HB2 . 11152 1 1079 . 1 1 95 95 GLN HB3 H 1 1.924 0.030 . 2 . . . . 95 GLN HB3 . 11152 1 1080 . 1 1 95 95 GLN HE21 H 1 7.562 0.030 . 2 . . . . 95 GLN HE21 . 11152 1 1081 . 1 1 95 95 GLN HE22 H 1 6.842 0.030 . 2 . . . . 95 GLN HE22 . 11152 1 1082 . 1 1 95 95 GLN HG2 H 1 2.307 0.030 . 1 . . . . 95 GLN HG2 . 11152 1 1083 . 1 1 95 95 GLN HG3 H 1 2.307 0.030 . 1 . . . . 95 GLN HG3 . 11152 1 1084 . 1 1 95 95 GLN C C 13 176.392 0.300 . 1 . . . . 95 GLN C . 11152 1 1085 . 1 1 95 95 GLN CA C 13 58.608 0.300 . 1 . . . . 95 GLN CA . 11152 1 1086 . 1 1 95 95 GLN CB C 13 28.792 0.300 . 1 . . . . 95 GLN CB . 11152 1 1087 . 1 1 95 95 GLN CG C 13 33.821 0.300 . 1 . . . . 95 GLN CG . 11152 1 1088 . 1 1 95 95 GLN N N 15 119.709 0.300 . 1 . . . . 95 GLN N . 11152 1 1089 . 1 1 95 95 GLN NE2 N 15 112.230 0.300 . 1 . . . . 95 GLN NE2 . 11152 1 1090 . 1 1 96 96 GLU H H 1 7.763 0.030 . 1 . . . . 96 GLU H . 11152 1 1091 . 1 1 96 96 GLU HA H 1 4.196 0.030 . 1 . . . . 96 GLU HA . 11152 1 1092 . 1 1 96 96 GLU HB2 H 1 1.353 0.030 . 2 . . . . 96 GLU HB2 . 11152 1 1093 . 1 1 96 96 GLU HB3 H 1 1.968 0.030 . 2 . . . . 96 GLU HB3 . 11152 1 1094 . 1 1 96 96 GLU HG2 H 1 2.213 0.030 . 2 . . . . 96 GLU HG2 . 11152 1 1095 . 1 1 96 96 GLU HG3 H 1 2.109 0.030 . 2 . . . . 96 GLU HG3 . 11152 1 1096 . 1 1 96 96 GLU C C 13 175.892 0.300 . 1 . . . . 96 GLU C . 11152 1 1097 . 1 1 96 96 GLU CA C 13 56.523 0.300 . 1 . . . . 96 GLU CA . 11152 1 1098 . 1 1 96 96 GLU CB C 13 30.376 0.300 . 1 . . . . 96 GLU CB . 11152 1 1099 . 1 1 96 96 GLU CG C 13 36.947 0.300 . 1 . . . . 96 GLU CG . 11152 1 1100 . 1 1 96 96 GLU N N 15 115.007 0.300 . 1 . . . . 96 GLU N . 11152 1 1101 . 1 1 97 97 GLY H H 1 7.315 0.030 . 1 . . . . 97 GLY H . 11152 1 1102 . 1 1 97 97 GLY HA2 H 1 3.779 0.030 . 2 . . . . 97 GLY HA2 . 11152 1 1103 . 1 1 97 97 GLY HA3 H 1 4.438 0.030 . 2 . . . . 97 GLY HA3 . 11152 1 1104 . 1 1 97 97 GLY C C 13 172.125 0.300 . 1 . . . . 97 GLY C . 11152 1 1105 . 1 1 97 97 GLY CA C 13 44.347 0.300 . 1 . . . . 97 GLY CA . 11152 1 1106 . 1 1 97 97 GLY N N 15 106.507 0.300 . 1 . . . . 97 GLY N . 11152 1 1107 . 1 1 98 98 TRP H H 1 8.493 0.030 . 1 . . . . 98 TRP H . 11152 1 1108 . 1 1 98 98 TRP HA H 1 4.821 0.030 . 1 . . . . 98 TRP HA . 11152 1 1109 . 1 1 98 98 TRP HB2 H 1 3.217 0.030 . 2 . . . . 98 TRP HB2 . 11152 1 1110 . 1 1 98 98 TRP HB3 H 1 3.021 0.030 . 2 . . . . 98 TRP HB3 . 11152 1 1111 . 1 1 98 98 TRP HD1 H 1 7.280 0.030 . 1 . . . . 98 TRP HD1 . 11152 1 1112 . 1 1 98 98 TRP HE1 H 1 10.083 0.030 . 1 . . . . 98 TRP HE1 . 11152 1 1113 . 1 1 98 98 TRP HE3 H 1 7.233 0.030 . 1 . . . . 98 TRP HE3 . 11152 1 1114 . 1 1 98 98 TRP HH2 H 1 6.864 0.030 . 1 . . . . 98 TRP HH2 . 11152 1 1115 . 1 1 98 98 TRP HZ2 H 1 7.266 0.030 . 1 . . . . 98 TRP HZ2 . 11152 1 1116 . 1 1 98 98 TRP HZ3 H 1 6.801 0.030 . 1 . . . . 98 TRP HZ3 . 11152 1 1117 . 1 1 98 98 TRP C C 13 178.146 0.300 . 1 . . . . 98 TRP C . 11152 1 1118 . 1 1 98 98 TRP CA C 13 57.231 0.300 . 1 . . . . 98 TRP CA . 11152 1 1119 . 1 1 98 98 TRP CB C 13 31.028 0.300 . 1 . . . . 98 TRP CB . 11152 1 1120 . 1 1 98 98 TRP CD1 C 13 127.477 0.300 . 1 . . . . 98 TRP CD1 . 11152 1 1121 . 1 1 98 98 TRP CE3 C 13 119.839 0.300 . 1 . . . . 98 TRP CE3 . 11152 1 1122 . 1 1 98 98 TRP CH2 C 13 124.154 0.300 . 1 . . . . 98 TRP CH2 . 11152 1 1123 . 1 1 98 98 TRP CZ2 C 13 115.436 0.300 . 1 . . . . 98 TRP CZ2 . 11152 1 1124 . 1 1 98 98 TRP CZ3 C 13 122.215 0.300 . 1 . . . . 98 TRP CZ3 . 11152 1 1125 . 1 1 98 98 TRP N N 15 119.331 0.300 . 1 . . . . 98 TRP N . 11152 1 1126 . 1 1 98 98 TRP NE1 N 15 129.977 0.300 . 1 . . . . 98 TRP NE1 . 11152 1 1127 . 1 1 99 99 GLY H H 1 9.142 0.030 . 1 . . . . 99 GLY H . 11152 1 1128 . 1 1 99 99 GLY HA2 H 1 4.311 0.030 . 2 . . . . 99 GLY HA2 . 11152 1 1129 . 1 1 99 99 GLY HA3 H 1 4.195 0.030 . 2 . . . . 99 GLY HA3 . 11152 1 1130 . 1 1 99 99 GLY C C 13 173.693 0.300 . 1 . . . . 99 GLY C . 11152 1 1131 . 1 1 99 99 GLY CA C 13 44.236 0.300 . 1 . . . . 99 GLY CA . 11152 1 1132 . 1 1 99 99 GLY N N 15 109.290 0.300 . 1 . . . . 99 GLY N . 11152 1 1133 . 1 1 100 100 ARG H H 1 8.555 0.030 . 1 . . . . 100 ARG H . 11152 1 1134 . 1 1 100 100 ARG HA H 1 4.180 0.030 . 1 . . . . 100 ARG HA . 11152 1 1135 . 1 1 100 100 ARG HB2 H 1 1.935 0.030 . 2 . . . . 100 ARG HB2 . 11152 1 1136 . 1 1 100 100 ARG HB3 H 1 1.814 0.030 . 2 . . . . 100 ARG HB3 . 11152 1 1137 . 1 1 100 100 ARG HD2 H 1 3.249 0.030 . 1 . . . . 100 ARG HD2 . 11152 1 1138 . 1 1 100 100 ARG HD3 H 1 3.249 0.030 . 1 . . . . 100 ARG HD3 . 11152 1 1139 . 1 1 100 100 ARG HG2 H 1 1.831 0.030 . 2 . . . . 100 ARG HG2 . 11152 1 1140 . 1 1 100 100 ARG HG3 H 1 1.782 0.030 . 2 . . . . 100 ARG HG3 . 11152 1 1141 . 1 1 100 100 ARG C C 13 176.402 0.300 . 1 . . . . 100 ARG C . 11152 1 1142 . 1 1 100 100 ARG CA C 13 56.409 0.300 . 1 . . . . 100 ARG CA . 11152 1 1143 . 1 1 100 100 ARG CB C 13 31.007 0.300 . 1 . . . . 100 ARG CB . 11152 1 1144 . 1 1 100 100 ARG CD C 13 43.285 0.300 . 1 . . . . 100 ARG CD . 11152 1 1145 . 1 1 100 100 ARG CG C 13 27.872 0.300 . 1 . . . . 100 ARG CG . 11152 1 1146 . 1 1 100 100 ARG N N 15 117.753 0.300 . 1 . . . . 100 ARG N . 11152 1 1147 . 1 1 101 101 GLU H H 1 9.225 0.030 . 1 . . . . 101 GLU H . 11152 1 1148 . 1 1 101 101 GLU HA H 1 4.771 0.030 . 1 . . . . 101 GLU HA . 11152 1 1149 . 1 1 101 101 GLU HB2 H 1 1.742 0.030 . 2 . . . . 101 GLU HB2 . 11152 1 1150 . 1 1 101 101 GLU HB3 H 1 1.653 0.030 . 2 . . . . 101 GLU HB3 . 11152 1 1151 . 1 1 101 101 GLU HG2 H 1 2.117 0.030 . 2 . . . . 101 GLU HG2 . 11152 1 1152 . 1 1 101 101 GLU HG3 H 1 2.087 0.030 . 2 . . . . 101 GLU HG3 . 11152 1 1153 . 1 1 101 101 GLU C C 13 175.772 0.300 . 1 . . . . 101 GLU C . 11152 1 1154 . 1 1 101 101 GLU CA C 13 55.183 0.300 . 1 . . . . 101 GLU CA . 11152 1 1155 . 1 1 101 101 GLU CB C 13 30.676 0.300 . 1 . . . . 101 GLU CB . 11152 1 1156 . 1 1 101 101 GLU CG C 13 36.110 0.300 . 1 . . . . 101 GLU CG . 11152 1 1157 . 1 1 101 101 GLU N N 15 120.321 0.300 . 1 . . . . 101 GLU N . 11152 1 1158 . 1 1 102 102 ARG H H 1 8.781 0.030 . 1 . . . . 102 ARG H . 11152 1 1159 . 1 1 102 102 ARG HA H 1 4.687 0.030 . 1 . . . . 102 ARG HA . 11152 1 1160 . 1 1 102 102 ARG HB2 H 1 1.943 0.030 . 2 . . . . 102 ARG HB2 . 11152 1 1161 . 1 1 102 102 ARG HB3 H 1 1.575 0.030 . 2 . . . . 102 ARG HB3 . 11152 1 1162 . 1 1 102 102 ARG HD2 H 1 3.338 0.030 . 2 . . . . 102 ARG HD2 . 11152 1 1163 . 1 1 102 102 ARG HD3 H 1 3.500 0.030 . 2 . . . . 102 ARG HD3 . 11152 1 1164 . 1 1 102 102 ARG HG2 H 1 1.666 0.030 . 2 . . . . 102 ARG HG2 . 11152 1 1165 . 1 1 102 102 ARG HG3 H 1 1.434 0.030 . 2 . . . . 102 ARG HG3 . 11152 1 1166 . 1 1 102 102 ARG C C 13 174.310 0.300 . 1 . . . . 102 ARG C . 11152 1 1167 . 1 1 102 102 ARG CA C 13 52.982 0.300 . 1 . . . . 102 ARG CA . 11152 1 1168 . 1 1 102 102 ARG CB C 13 31.389 0.300 . 1 . . . . 102 ARG CB . 11152 1 1169 . 1 1 102 102 ARG CD C 13 41.207 0.300 . 1 . . . . 102 ARG CD . 11152 1 1170 . 1 1 102 102 ARG CG C 13 25.615 0.300 . 1 . . . . 102 ARG CG . 11152 1 1171 . 1 1 102 102 ARG N N 15 121.504 0.300 . 1 . . . . 102 ARG N . 11152 1 1172 . 1 1 103 103 GLU H H 1 8.929 0.030 . 1 . . . . 103 GLU H . 11152 1 1173 . 1 1 103 103 GLU HA H 1 5.885 0.030 . 1 . . . . 103 GLU HA . 11152 1 1174 . 1 1 103 103 GLU HB2 H 1 2.005 0.030 . 1 . . . . 103 GLU HB2 . 11152 1 1175 . 1 1 103 103 GLU HB3 H 1 2.005 0.030 . 1 . . . . 103 GLU HB3 . 11152 1 1176 . 1 1 103 103 GLU HG2 H 1 2.235 0.030 . 2 . . . . 103 GLU HG2 . 11152 1 1177 . 1 1 103 103 GLU HG3 H 1 2.062 0.030 . 2 . . . . 103 GLU HG3 . 11152 1 1178 . 1 1 103 103 GLU C C 13 177.121 0.300 . 1 . . . . 103 GLU C . 11152 1 1179 . 1 1 103 103 GLU CA C 13 54.255 0.300 . 1 . . . . 103 GLU CA . 11152 1 1180 . 1 1 103 103 GLU CB C 13 33.727 0.300 . 1 . . . . 103 GLU CB . 11152 1 1181 . 1 1 103 103 GLU CG C 13 37.804 0.300 . 1 . . . . 103 GLU CG . 11152 1 1182 . 1 1 103 103 GLU N N 15 127.245 0.300 . 1 . . . . 103 GLU N . 11152 1 1183 . 1 1 104 104 GLY H H 1 9.211 0.030 . 1 . . . . 104 GLY H . 11152 1 1184 . 1 1 104 104 GLY HA2 H 1 3.930 0.030 . 2 . . . . 104 GLY HA2 . 11152 1 1185 . 1 1 104 104 GLY HA3 H 1 4.726 0.030 . 2 . . . . 104 GLY HA3 . 11152 1 1186 . 1 1 104 104 GLY C C 13 170.498 0.300 . 1 . . . . 104 GLY C . 11152 1 1187 . 1 1 104 104 GLY CA C 13 45.853 0.300 . 1 . . . . 104 GLY CA . 11152 1 1188 . 1 1 104 104 GLY N N 15 111.597 0.300 . 1 . . . . 104 GLY N . 11152 1 1189 . 1 1 105 105 VAL H H 1 8.538 0.030 . 1 . . . . 105 VAL H . 11152 1 1190 . 1 1 105 105 VAL HA H 1 5.417 0.030 . 1 . . . . 105 VAL HA . 11152 1 1191 . 1 1 105 105 VAL HB H 1 1.954 0.030 . 1 . . . . 105 VAL HB . 11152 1 1192 . 1 1 105 105 VAL HG11 H 1 1.002 0.030 . 1 . . . . 105 VAL HG1 . 11152 1 1193 . 1 1 105 105 VAL HG12 H 1 1.002 0.030 . 1 . . . . 105 VAL HG1 . 11152 1 1194 . 1 1 105 105 VAL HG13 H 1 1.002 0.030 . 1 . . . . 105 VAL HG1 . 11152 1 1195 . 1 1 105 105 VAL HG21 H 1 0.925 0.030 . 1 . . . . 105 VAL HG2 . 11152 1 1196 . 1 1 105 105 VAL HG22 H 1 0.925 0.030 . 1 . . . . 105 VAL HG2 . 11152 1 1197 . 1 1 105 105 VAL HG23 H 1 0.925 0.030 . 1 . . . . 105 VAL HG2 . 11152 1 1198 . 1 1 105 105 VAL C C 13 174.422 0.300 . 1 . . . . 105 VAL C . 11152 1 1199 . 1 1 105 105 VAL CA C 13 60.766 0.300 . 1 . . . . 105 VAL CA . 11152 1 1200 . 1 1 105 105 VAL CB C 13 34.370 0.300 . 1 . . . . 105 VAL CB . 11152 1 1201 . 1 1 105 105 VAL CG1 C 13 21.418 0.300 . 2 . . . . 105 VAL CG1 . 11152 1 1202 . 1 1 105 105 VAL CG2 C 13 21.135 0.300 . 2 . . . . 105 VAL CG2 . 11152 1 1203 . 1 1 105 105 VAL N N 15 122.146 0.300 . 1 . . . . 105 VAL N . 11152 1 1204 . 1 1 106 106 ILE H H 1 8.974 0.030 . 1 . . . . 106 ILE H . 11152 1 1205 . 1 1 106 106 ILE HA H 1 4.554 0.030 . 1 . . . . 106 ILE HA . 11152 1 1206 . 1 1 106 106 ILE HB H 1 0.375 0.030 . 1 . . . . 106 ILE HB . 11152 1 1207 . 1 1 106 106 ILE HD11 H 1 0.746 0.030 . 1 . . . . 106 ILE HD1 . 11152 1 1208 . 1 1 106 106 ILE HD12 H 1 0.746 0.030 . 1 . . . . 106 ILE HD1 . 11152 1 1209 . 1 1 106 106 ILE HD13 H 1 0.746 0.030 . 1 . . . . 106 ILE HD1 . 11152 1 1210 . 1 1 106 106 ILE HG12 H 1 0.918 0.030 . 2 . . . . 106 ILE HG12 . 11152 1 1211 . 1 1 106 106 ILE HG13 H 1 0.633 0.030 . 2 . . . . 106 ILE HG13 . 11152 1 1212 . 1 1 106 106 ILE HG21 H 1 0.311 0.030 . 1 . . . . 106 ILE HG2 . 11152 1 1213 . 1 1 106 106 ILE HG22 H 1 0.311 0.030 . 1 . . . . 106 ILE HG2 . 11152 1 1214 . 1 1 106 106 ILE HG23 H 1 0.311 0.030 . 1 . . . . 106 ILE HG2 . 11152 1 1215 . 1 1 106 106 ILE C C 13 171.895 0.300 . 1 . . . . 106 ILE C . 11152 1 1216 . 1 1 106 106 ILE CA C 13 56.613 0.300 . 1 . . . . 106 ILE CA . 11152 1 1217 . 1 1 106 106 ILE CB C 13 41.781 0.300 . 1 . . . . 106 ILE CB . 11152 1 1218 . 1 1 106 106 ILE CD1 C 13 14.012 0.300 . 1 . . . . 106 ILE CD1 . 11152 1 1219 . 1 1 106 106 ILE CG1 C 13 28.812 0.300 . 1 . . . . 106 ILE CG1 . 11152 1 1220 . 1 1 106 106 ILE CG2 C 13 18.109 0.300 . 1 . . . . 106 ILE CG2 . 11152 1 1221 . 1 1 106 106 ILE N N 15 124.820 0.300 . 1 . . . . 106 ILE N . 11152 1 1222 . 1 1 107 107 THR H H 1 7.841 0.030 . 1 . . . . 107 THR H . 11152 1 1223 . 1 1 107 107 THR HA H 1 4.809 0.030 . 1 . . . . 107 THR HA . 11152 1 1224 . 1 1 107 107 THR HB H 1 3.809 0.030 . 1 . . . . 107 THR HB . 11152 1 1225 . 1 1 107 107 THR HG21 H 1 0.919 0.030 . 1 . . . . 107 THR HG2 . 11152 1 1226 . 1 1 107 107 THR HG22 H 1 0.919 0.030 . 1 . . . . 107 THR HG2 . 11152 1 1227 . 1 1 107 107 THR HG23 H 1 0.919 0.030 . 1 . . . . 107 THR HG2 . 11152 1 1228 . 1 1 107 107 THR C C 13 173.674 0.300 . 1 . . . . 107 THR C . 11152 1 1229 . 1 1 107 107 THR CA C 13 61.570 0.300 . 1 . . . . 107 THR CA . 11152 1 1230 . 1 1 107 107 THR CB C 13 70.185 0.300 . 1 . . . . 107 THR CB . 11152 1 1231 . 1 1 107 107 THR CG2 C 13 21.134 0.300 . 1 . . . . 107 THR CG2 . 11152 1 1232 . 1 1 107 107 THR N N 15 122.328 0.300 . 1 . . . . 107 THR N . 11152 1 1233 . 1 1 108 108 ILE H H 1 8.862 0.030 . 1 . . . . 108 ILE H . 11152 1 1234 . 1 1 108 108 ILE HA H 1 4.068 0.030 . 1 . . . . 108 ILE HA . 11152 1 1235 . 1 1 108 108 ILE HB H 1 2.272 0.030 . 1 . . . . 108 ILE HB . 11152 1 1236 . 1 1 108 108 ILE HD11 H 1 0.572 0.030 . 1 . . . . 108 ILE HD1 . 11152 1 1237 . 1 1 108 108 ILE HD12 H 1 0.572 0.030 . 1 . . . . 108 ILE HD1 . 11152 1 1238 . 1 1 108 108 ILE HD13 H 1 0.572 0.030 . 1 . . . . 108 ILE HD1 . 11152 1 1239 . 1 1 108 108 ILE HG12 H 1 1.552 0.030 . 2 . . . . 108 ILE HG12 . 11152 1 1240 . 1 1 108 108 ILE HG13 H 1 1.389 0.030 . 2 . . . . 108 ILE HG13 . 11152 1 1241 . 1 1 108 108 ILE HG21 H 1 0.909 0.030 . 1 . . . . 108 ILE HG2 . 11152 1 1242 . 1 1 108 108 ILE HG22 H 1 0.909 0.030 . 1 . . . . 108 ILE HG2 . 11152 1 1243 . 1 1 108 108 ILE HG23 H 1 0.909 0.030 . 1 . . . . 108 ILE HG2 . 11152 1 1244 . 1 1 108 108 ILE C C 13 175.985 0.300 . 1 . . . . 108 ILE C . 11152 1 1245 . 1 1 108 108 ILE CA C 13 59.929 0.300 . 1 . . . . 108 ILE CA . 11152 1 1246 . 1 1 108 108 ILE CB C 13 36.082 0.300 . 1 . . . . 108 ILE CB . 11152 1 1247 . 1 1 108 108 ILE CD1 C 13 11.626 0.300 . 1 . . . . 108 ILE CD1 . 11152 1 1248 . 1 1 108 108 ILE CG1 C 13 27.126 0.300 . 1 . . . . 108 ILE CG1 . 11152 1 1249 . 1 1 108 108 ILE CG2 C 13 17.625 0.300 . 1 . . . . 108 ILE CG2 . 11152 1 1250 . 1 1 108 108 ILE N N 15 128.063 0.300 . 1 . . . . 108 ILE N . 11152 1 1251 . 1 1 109 109 GLU H H 1 8.538 0.030 . 1 . . . . 109 GLU H . 11152 1 1252 . 1 1 109 109 GLU HA H 1 4.466 0.030 . 1 . . . . 109 GLU HA . 11152 1 1253 . 1 1 109 109 GLU HB2 H 1 2.060 0.030 . 2 . . . . 109 GLU HB2 . 11152 1 1254 . 1 1 109 109 GLU HB3 H 1 1.930 0.030 . 2 . . . . 109 GLU HB3 . 11152 1 1255 . 1 1 109 109 GLU HG2 H 1 2.256 0.030 . 2 . . . . 109 GLU HG2 . 11152 1 1256 . 1 1 109 109 GLU HG3 H 1 2.207 0.030 . 2 . . . . 109 GLU HG3 . 11152 1 1257 . 1 1 109 109 GLU C C 13 176.495 0.300 . 1 . . . . 109 GLU C . 11152 1 1258 . 1 1 109 109 GLU CA C 13 56.162 0.300 . 1 . . . . 109 GLU CA . 11152 1 1259 . 1 1 109 109 GLU CB C 13 30.901 0.300 . 1 . . . . 109 GLU CB . 11152 1 1260 . 1 1 109 109 GLU CG C 13 36.304 0.300 . 1 . . . . 109 GLU CG . 11152 1 1261 . 1 1 109 109 GLU N N 15 128.559 0.300 . 1 . . . . 109 GLU N . 11152 1 1262 . 1 1 110 110 SER H H 1 8.581 0.030 . 1 . . . . 110 SER H . 11152 1 1263 . 1 1 110 110 SER HA H 1 4.431 0.030 . 1 . . . . 110 SER HA . 11152 1 1264 . 1 1 110 110 SER HB2 H 1 3.822 0.030 . 1 . . . . 110 SER HB2 . 11152 1 1265 . 1 1 110 110 SER HB3 H 1 3.822 0.030 . 1 . . . . 110 SER HB3 . 11152 1 1266 . 1 1 110 110 SER C C 13 174.374 0.300 . 1 . . . . 110 SER C . 11152 1 1267 . 1 1 110 110 SER CA C 13 58.423 0.300 . 1 . . . . 110 SER CA . 11152 1 1268 . 1 1 110 110 SER CB C 13 64.112 0.300 . 1 . . . . 110 SER CB . 11152 1 1269 . 1 1 110 110 SER N N 15 117.246 0.300 . 1 . . . . 110 SER N . 11152 1 1270 . 1 1 111 111 GLN H H 1 8.597 0.030 . 1 . . . . 111 GLN H . 11152 1 1271 . 1 1 111 111 GLN HA H 1 4.433 0.030 . 1 . . . . 111 GLN HA . 11152 1 1272 . 1 1 111 111 GLN HB2 H 1 1.945 0.030 . 2 . . . . 111 GLN HB2 . 11152 1 1273 . 1 1 111 111 GLN HB3 H 1 2.114 0.030 . 2 . . . . 111 GLN HB3 . 11152 1 1274 . 1 1 111 111 GLN HE21 H 1 6.849 0.030 . 2 . . . . 111 GLN HE21 . 11152 1 1275 . 1 1 111 111 GLN HE22 H 1 7.570 0.030 . 2 . . . . 111 GLN HE22 . 11152 1 1276 . 1 1 111 111 GLN HG2 H 1 2.030 0.030 . 2 . . . . 111 GLN HG2 . 11152 1 1277 . 1 1 111 111 GLN HG3 H 1 2.336 0.030 . 2 . . . . 111 GLN HG3 . 11152 1 1278 . 1 1 111 111 GLN C C 13 175.891 0.300 . 1 . . . . 111 GLN C . 11152 1 1279 . 1 1 111 111 GLN CA C 13 55.703 0.300 . 1 . . . . 111 GLN CA . 11152 1 1280 . 1 1 111 111 GLN CB C 13 29.614 0.300 . 1 . . . . 111 GLN CB . 11152 1 1281 . 1 1 111 111 GLN CG C 13 33.649 0.300 . 1 . . . . 111 GLN CG . 11152 1 1282 . 1 1 111 111 GLN N N 15 122.655 0.300 . 1 . . . . 111 GLN N . 11152 1 1283 . 1 1 111 111 GLN NE2 N 15 112.485 0.300 . 1 . . . . 111 GLN NE2 . 11152 1 1284 . 1 1 112 112 VAL H H 1 8.286 0.030 . 1 . . . . 112 VAL H . 11152 1 1285 . 1 1 112 112 VAL HA H 1 4.160 0.030 . 1 . . . . 112 VAL HA . 11152 1 1286 . 1 1 112 112 VAL HB H 1 2.066 0.030 . 1 . . . . 112 VAL HB . 11152 1 1287 . 1 1 112 112 VAL HG11 H 1 0.915 0.030 . 1 . . . . 112 VAL HG1 . 11152 1 1288 . 1 1 112 112 VAL HG12 H 1 0.915 0.030 . 1 . . . . 112 VAL HG1 . 11152 1 1289 . 1 1 112 112 VAL HG13 H 1 0.915 0.030 . 1 . . . . 112 VAL HG1 . 11152 1 1290 . 1 1 112 112 VAL C C 13 176.186 0.300 . 1 . . . . 112 VAL C . 11152 1 1291 . 1 1 112 112 VAL CA C 13 62.319 0.300 . 1 . . . . 112 VAL CA . 11152 1 1292 . 1 1 112 112 VAL CB C 13 32.778 0.300 . 1 . . . . 112 VAL CB . 11152 1 1293 . 1 1 112 112 VAL CG1 C 13 20.367 0.300 . 1 . . . . 112 VAL CG1 . 11152 1 1294 . 1 1 112 112 VAL CG2 C 13 20.367 0.300 . 1 . . . . 112 VAL CG2 . 11152 1 1295 . 1 1 112 112 VAL N N 15 121.584 0.300 . 1 . . . . 112 VAL N . 11152 1 1296 . 1 1 113 113 SER H H 1 8.443 0.030 . 1 . . . . 113 SER H . 11152 1 1297 . 1 1 113 113 SER HA H 1 4.503 0.030 . 1 . . . . 113 SER HA . 11152 1 1298 . 1 1 113 113 SER HB2 H 1 3.855 0.030 . 1 . . . . 113 SER HB2 . 11152 1 1299 . 1 1 113 113 SER HB3 H 1 3.855 0.030 . 1 . . . . 113 SER HB3 . 11152 1 1300 . 1 1 113 113 SER C C 13 174.504 0.300 . 1 . . . . 113 SER C . 11152 1 1301 . 1 1 113 113 SER CA C 13 58.249 0.300 . 1 . . . . 113 SER CA . 11152 1 1302 . 1 1 113 113 SER CB C 13 63.995 0.300 . 1 . . . . 113 SER CB . 11152 1 1303 . 1 1 113 113 SER N N 15 119.855 0.300 . 1 . . . . 113 SER N . 11152 1 1304 . 1 1 114 114 GLY H H 1 8.265 0.030 . 1 . . . . 114 GLY H . 11152 1 1305 . 1 1 114 114 GLY HA2 H 1 4.179 0.030 . 2 . . . . 114 GLY HA2 . 11152 1 1306 . 1 1 114 114 GLY HA3 H 1 4.065 0.030 . 2 . . . . 114 GLY HA3 . 11152 1 1307 . 1 1 114 114 GLY C C 13 171.730 0.300 . 1 . . . . 114 GLY C . 11152 1 1308 . 1 1 114 114 GLY CA C 13 44.677 0.300 . 1 . . . . 114 GLY CA . 11152 1 1309 . 1 1 114 114 GLY N N 15 110.895 0.300 . 1 . . . . 114 GLY N . 11152 1 1310 . 1 1 115 115 PRO HA H 1 4.470 0.030 . 1 . . . . 115 PRO HA . 11152 1 1311 . 1 1 115 115 PRO HB2 H 1 1.965 0.030 . 2 . . . . 115 PRO HB2 . 11152 1 1312 . 1 1 115 115 PRO HB3 H 1 2.284 0.030 . 2 . . . . 115 PRO HB3 . 11152 1 1313 . 1 1 115 115 PRO HD2 H 1 3.621 0.030 . 1 . . . . 115 PRO HD2 . 11152 1 1314 . 1 1 115 115 PRO HD3 H 1 3.621 0.030 . 1 . . . . 115 PRO HD3 . 11152 1 1315 . 1 1 115 115 PRO HG2 H 1 2.005 0.030 . 1 . . . . 115 PRO HG2 . 11152 1 1316 . 1 1 115 115 PRO HG3 H 1 2.005 0.030 . 1 . . . . 115 PRO HG3 . 11152 1 1317 . 1 1 115 115 PRO C C 13 177.423 0.300 . 1 . . . . 115 PRO C . 11152 1 1318 . 1 1 115 115 PRO CA C 13 63.254 0.300 . 1 . . . . 115 PRO CA . 11152 1 1319 . 1 1 115 115 PRO CB C 13 32.221 0.300 . 1 . . . . 115 PRO CB . 11152 1 1320 . 1 1 115 115 PRO CD C 13 49.779 0.300 . 1 . . . . 115 PRO CD . 11152 1 1321 . 1 1 115 115 PRO CG C 13 27.173 0.300 . 1 . . . . 115 PRO CG . 11152 1 1322 . 1 1 116 116 SER H H 1 8.543 0.030 . 1 . . . . 116 SER H . 11152 1 1323 . 1 1 116 116 SER C C 13 174.711 0.300 . 1 . . . . 116 SER C . 11152 1 1324 . 1 1 116 116 SER N N 15 116.466 0.300 . 1 . . . . 116 SER N . 11152 1 stop_ save_