data_11398 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11398 _Entry.Title ; Solution structure of PDZ domain in protein XP_110852 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-09 _Entry.Accession_date 2010-09-09 _Entry.Last_release_date 2011-09-08 _Entry.Original_release_date 2011-09-08 _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 F. He . . . 11398 2 K. Hanaki . . . 11398 3 Y. Muto . . . 11398 4 M. Inoue . . . 11398 5 T. Kigawa . . . 11398 6 M. Shirouzu . . . 11398 7 T. Terada . . . 11398 8 S. Yokoyama . . . 11398 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)' . 11398 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11398 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 501 11398 '15N chemical shifts' 131 11398 '1H chemical shifts' 838 11398 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 . . 2011-09-08 2010-09-09 original author . 11398 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11398 _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 PDZ domain in protein XP_110852' _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 F. He . . . 11398 1 2 K. Hanaki . . . 11398 1 3 Y. Muto . . . 11398 1 4 M. Inoue . . . 11398 1 5 T. Kigawa . . . 11398 1 6 M. Shirouzu . . . 11398 1 7 T. Terada . . . 11398 1 8 S. Yokoyama . . . 11398 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11398 _Assembly.ID 1 _Assembly.Name 'HYPOTHETICAL PROTEIN (RIKEN cDNA 2810455B10)' _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 'PDZ domain' 1 $entity_1 A . yes native no no . . . 11398 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 1wg6 . . . . . . 11398 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11398 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PDZ domain' _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 ; GSSGSSGLKGEPDCYALSLE SSEQLTLEIPLNDSGSAGLG VSLKGNKSRETGTDLGIFIK SIIHGGAAFKDGRLRMNDQL IAVNGETLLGKSNHEAMETL RRSMSMEGNIRGMIQLVILR RSGPSSG ; _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 127 _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 1WG6 . "Solution Structure Of Pdz Domain In Protein Xp_110852" . . . . . 100.00 127 100.00 100.00 2.28e-82 . . . . 11398 1 2 no GB EDL98917 . "similar to amyotrophic lateral sclerosis 2 (juvenile) chromosome region, candidate 19 isoform b [Rattus norvegicus]" . . . . . 89.76 426 100.00 100.00 3.25e-71 . . . . 11398 1 3 no GB EGW06143 . "Partitioning defective 3-like B [Cricetulus griseus]" . . . . . 89.76 354 97.37 99.12 7.61e-71 . . . . 11398 1 4 no GB ERE85499 . "putative partitioning defective 3 [Cricetulus griseus]" . . . . . 89.76 511 97.37 99.12 4.89e-69 . . . . 11398 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 11398 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 . 11398 1 2 . SER . 11398 1 3 . SER . 11398 1 4 . GLY . 11398 1 5 . SER . 11398 1 6 . SER . 11398 1 7 . GLY . 11398 1 8 . LEU . 11398 1 9 . LYS . 11398 1 10 . GLY . 11398 1 11 . GLU . 11398 1 12 . PRO . 11398 1 13 . ASP . 11398 1 14 . CYS . 11398 1 15 . TYR . 11398 1 16 . ALA . 11398 1 17 . LEU . 11398 1 18 . SER . 11398 1 19 . LEU . 11398 1 20 . GLU . 11398 1 21 . SER . 11398 1 22 . SER . 11398 1 23 . GLU . 11398 1 24 . GLN . 11398 1 25 . LEU . 11398 1 26 . THR . 11398 1 27 . LEU . 11398 1 28 . GLU . 11398 1 29 . ILE . 11398 1 30 . PRO . 11398 1 31 . LEU . 11398 1 32 . ASN . 11398 1 33 . ASP . 11398 1 34 . SER . 11398 1 35 . GLY . 11398 1 36 . SER . 11398 1 37 . ALA . 11398 1 38 . GLY . 11398 1 39 . LEU . 11398 1 40 . GLY . 11398 1 41 . VAL . 11398 1 42 . SER . 11398 1 43 . LEU . 11398 1 44 . LYS . 11398 1 45 . GLY . 11398 1 46 . ASN . 11398 1 47 . LYS . 11398 1 48 . SER . 11398 1 49 . ARG . 11398 1 50 . GLU . 11398 1 51 . THR . 11398 1 52 . GLY . 11398 1 53 . THR . 11398 1 54 . ASP . 11398 1 55 . LEU . 11398 1 56 . GLY . 11398 1 57 . ILE . 11398 1 58 . PHE . 11398 1 59 . ILE . 11398 1 60 . LYS . 11398 1 61 . SER . 11398 1 62 . ILE . 11398 1 63 . ILE . 11398 1 64 . HIS . 11398 1 65 . GLY . 11398 1 66 . GLY . 11398 1 67 . ALA . 11398 1 68 . ALA . 11398 1 69 . PHE . 11398 1 70 . LYS . 11398 1 71 . ASP . 11398 1 72 . GLY . 11398 1 73 . ARG . 11398 1 74 . LEU . 11398 1 75 . ARG . 11398 1 76 . MET . 11398 1 77 . ASN . 11398 1 78 . ASP . 11398 1 79 . GLN . 11398 1 80 . LEU . 11398 1 81 . ILE . 11398 1 82 . ALA . 11398 1 83 . VAL . 11398 1 84 . ASN . 11398 1 85 . GLY . 11398 1 86 . GLU . 11398 1 87 . THR . 11398 1 88 . LEU . 11398 1 89 . LEU . 11398 1 90 . GLY . 11398 1 91 . LYS . 11398 1 92 . SER . 11398 1 93 . ASN . 11398 1 94 . HIS . 11398 1 95 . GLU . 11398 1 96 . ALA . 11398 1 97 . MET . 11398 1 98 . GLU . 11398 1 99 . THR . 11398 1 100 . LEU . 11398 1 101 . ARG . 11398 1 102 . ARG . 11398 1 103 . SER . 11398 1 104 . MET . 11398 1 105 . SER . 11398 1 106 . MET . 11398 1 107 . GLU . 11398 1 108 . GLY . 11398 1 109 . ASN . 11398 1 110 . ILE . 11398 1 111 . ARG . 11398 1 112 . GLY . 11398 1 113 . MET . 11398 1 114 . ILE . 11398 1 115 . GLN . 11398 1 116 . LEU . 11398 1 117 . VAL . 11398 1 118 . ILE . 11398 1 119 . LEU . 11398 1 120 . ARG . 11398 1 121 . ARG . 11398 1 122 . SER . 11398 1 123 . GLY . 11398 1 124 . PRO . 11398 1 125 . SER . 11398 1 126 . SER . 11398 1 127 . GLY . 11398 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 11398 1 . SER 2 2 11398 1 . SER 3 3 11398 1 . GLY 4 4 11398 1 . SER 5 5 11398 1 . SER 6 6 11398 1 . GLY 7 7 11398 1 . LEU 8 8 11398 1 . LYS 9 9 11398 1 . GLY 10 10 11398 1 . GLU 11 11 11398 1 . PRO 12 12 11398 1 . ASP 13 13 11398 1 . CYS 14 14 11398 1 . TYR 15 15 11398 1 . ALA 16 16 11398 1 . LEU 17 17 11398 1 . SER 18 18 11398 1 . LEU 19 19 11398 1 . GLU 20 20 11398 1 . SER 21 21 11398 1 . SER 22 22 11398 1 . GLU 23 23 11398 1 . GLN 24 24 11398 1 . LEU 25 25 11398 1 . THR 26 26 11398 1 . LEU 27 27 11398 1 . GLU 28 28 11398 1 . ILE 29 29 11398 1 . PRO 30 30 11398 1 . LEU 31 31 11398 1 . ASN 32 32 11398 1 . ASP 33 33 11398 1 . SER 34 34 11398 1 . GLY 35 35 11398 1 . SER 36 36 11398 1 . ALA 37 37 11398 1 . GLY 38 38 11398 1 . LEU 39 39 11398 1 . GLY 40 40 11398 1 . VAL 41 41 11398 1 . SER 42 42 11398 1 . LEU 43 43 11398 1 . LYS 44 44 11398 1 . GLY 45 45 11398 1 . ASN 46 46 11398 1 . LYS 47 47 11398 1 . SER 48 48 11398 1 . ARG 49 49 11398 1 . GLU 50 50 11398 1 . THR 51 51 11398 1 . GLY 52 52 11398 1 . THR 53 53 11398 1 . ASP 54 54 11398 1 . LEU 55 55 11398 1 . GLY 56 56 11398 1 . ILE 57 57 11398 1 . PHE 58 58 11398 1 . ILE 59 59 11398 1 . LYS 60 60 11398 1 . SER 61 61 11398 1 . ILE 62 62 11398 1 . ILE 63 63 11398 1 . HIS 64 64 11398 1 . GLY 65 65 11398 1 . GLY 66 66 11398 1 . ALA 67 67 11398 1 . ALA 68 68 11398 1 . PHE 69 69 11398 1 . LYS 70 70 11398 1 . ASP 71 71 11398 1 . GLY 72 72 11398 1 . ARG 73 73 11398 1 . LEU 74 74 11398 1 . ARG 75 75 11398 1 . MET 76 76 11398 1 . ASN 77 77 11398 1 . ASP 78 78 11398 1 . GLN 79 79 11398 1 . LEU 80 80 11398 1 . ILE 81 81 11398 1 . ALA 82 82 11398 1 . VAL 83 83 11398 1 . ASN 84 84 11398 1 . GLY 85 85 11398 1 . GLU 86 86 11398 1 . THR 87 87 11398 1 . LEU 88 88 11398 1 . LEU 89 89 11398 1 . GLY 90 90 11398 1 . LYS 91 91 11398 1 . SER 92 92 11398 1 . ASN 93 93 11398 1 . HIS 94 94 11398 1 . GLU 95 95 11398 1 . ALA 96 96 11398 1 . MET 97 97 11398 1 . GLU 98 98 11398 1 . THR 99 99 11398 1 . LEU 100 100 11398 1 . ARG 101 101 11398 1 . ARG 102 102 11398 1 . SER 103 103 11398 1 . MET 104 104 11398 1 . SER 105 105 11398 1 . MET 106 106 11398 1 . GLU 107 107 11398 1 . GLY 108 108 11398 1 . ASN 109 109 11398 1 . ILE 110 110 11398 1 . ARG 111 111 11398 1 . GLY 112 112 11398 1 . MET 113 113 11398 1 . ILE 114 114 11398 1 . GLN 115 115 11398 1 . LEU 116 116 11398 1 . VAL 117 117 11398 1 . ILE 118 118 11398 1 . LEU 119 119 11398 1 . ARG 120 120 11398 1 . ARG 121 121 11398 1 . SER 122 122 11398 1 . GLY 123 123 11398 1 . PRO 124 124 11398 1 . SER 125 125 11398 1 . SER 126 126 11398 1 . GLY 127 127 11398 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 11398 _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 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 11398 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 11398 _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' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P030407-A03 . . . . . . 11398 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11398 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8mM {U-15,13C;} 20mM phosphate buffer {NA;} 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 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 0.8 . . mM . . . . 11398 1 2 'phosphate buffer NA' 'natural abundance' . . . . . buffer 20 . . mM . . . . 11398 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11398 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11398 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11398 1 6 H2O . . . . . . solvent 90 . . % . . . . 11398 1 7 D2O . . . . . . solvent 10 . . % . . . . 11398 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 11398 _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 11398 1 pH 6.0 0.05 pH 11398 1 pressure 1 0.001 atm 11398 1 temperature 298 0.1 K 11398 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11398 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11398 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11398 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11398 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio F.' . . 11398 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11398 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11398 _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.' . . 11398 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11398 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11398 _Software.ID 4 _Software.Name Kujira _Software.Version 0.863 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi N.' . . 11398 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11398 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11398 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.8 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert P.' . . 11398 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11398 5 'structure solution' 11398 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 11398 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11398 _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 . 800 . . . 11398 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 11398 _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 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11398 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11398 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 11398 _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 . . . . . . . . . 11398 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11398 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11398 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 11398 _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 15N-separated NOESY' 1 $sample_1 isotropic 11398 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11398 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 . . 11398 1 2 $NMRPipe . . 11398 1 3 $NMRView . . 11398 1 4 $Kujira . . 11398 1 5 $CYANA . . 11398 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 6 6 SER HA H 1 4.519 0.030 . 1 . . . . 6 SER HA . 11398 1 2 . 1 1 6 6 SER HB2 H 1 3.997 0.030 . 1 . . . . 6 SER HB2 . 11398 1 3 . 1 1 6 6 SER HB3 H 1 3.997 0.030 . 1 . . . . 6 SER HB3 . 11398 1 4 . 1 1 6 6 SER C C 13 175.048 0.300 . 1 . . . . 6 SER C . 11398 1 5 . 1 1 6 6 SER CA C 13 58.778 0.300 . 1 . . . . 6 SER CA . 11398 1 6 . 1 1 6 6 SER CB C 13 63.969 0.300 . 1 . . . . 6 SER CB . 11398 1 7 . 1 1 7 7 GLY H H 1 8.421 0.030 . 1 . . . . 7 GLY H . 11398 1 8 . 1 1 7 7 GLY HA2 H 1 3.992 0.030 . 1 . . . . 7 GLY HA2 . 11398 1 9 . 1 1 7 7 GLY HA3 H 1 3.992 0.030 . 1 . . . . 7 GLY HA3 . 11398 1 10 . 1 1 7 7 GLY C C 13 174.099 0.300 . 1 . . . . 7 GLY C . 11398 1 11 . 1 1 7 7 GLY CA C 13 45.430 0.300 . 1 . . . . 7 GLY CA . 11398 1 12 . 1 1 7 7 GLY N N 15 110.619 0.300 . 1 . . . . 7 GLY N . 11398 1 13 . 1 1 8 8 LEU H H 1 8.112 0.030 . 1 . . . . 8 LEU H . 11398 1 14 . 1 1 8 8 LEU HA H 1 4.342 0.030 . 1 . . . . 8 LEU HA . 11398 1 15 . 1 1 8 8 LEU HB2 H 1 1.679 0.030 . 2 . . . . 8 LEU HB2 . 11398 1 16 . 1 1 8 8 LEU HB3 H 1 1.620 0.030 . 2 . . . . 8 LEU HB3 . 11398 1 17 . 1 1 8 8 LEU HD11 H 1 0.944 0.030 . 1 . . . . 8 LEU HD1 . 11398 1 18 . 1 1 8 8 LEU HD12 H 1 0.944 0.030 . 1 . . . . 8 LEU HD1 . 11398 1 19 . 1 1 8 8 LEU HD13 H 1 0.944 0.030 . 1 . . . . 8 LEU HD1 . 11398 1 20 . 1 1 8 8 LEU HD21 H 1 0.872 0.030 . 1 . . . . 8 LEU HD2 . 11398 1 21 . 1 1 8 8 LEU HD22 H 1 0.872 0.030 . 1 . . . . 8 LEU HD2 . 11398 1 22 . 1 1 8 8 LEU HD23 H 1 0.872 0.030 . 1 . . . . 8 LEU HD2 . 11398 1 23 . 1 1 8 8 LEU HG H 1 1.551 0.030 . 1 . . . . 8 LEU HG . 11398 1 24 . 1 1 8 8 LEU C C 13 177.483 0.300 . 1 . . . . 8 LEU C . 11398 1 25 . 1 1 8 8 LEU CA C 13 55.238 0.300 . 1 . . . . 8 LEU CA . 11398 1 26 . 1 1 8 8 LEU CB C 13 42.483 0.300 . 1 . . . . 8 LEU CB . 11398 1 27 . 1 1 8 8 LEU CD1 C 13 25.116 0.300 . 2 . . . . 8 LEU CD1 . 11398 1 28 . 1 1 8 8 LEU CD2 C 13 23.387 0.300 . 2 . . . . 8 LEU CD2 . 11398 1 29 . 1 1 8 8 LEU CG C 13 27.010 0.300 . 1 . . . . 8 LEU CG . 11398 1 30 . 1 1 8 8 LEU N N 15 121.728 0.300 . 1 . . . . 8 LEU N . 11398 1 31 . 1 1 9 9 LYS H H 1 8.402 0.030 . 1 . . . . 9 LYS H . 11398 1 32 . 1 1 9 9 LYS HA H 1 4.361 0.030 . 1 . . . . 9 LYS HA . 11398 1 33 . 1 1 9 9 LYS HB2 H 1 1.802 0.030 . 2 . . . . 9 LYS HB2 . 11398 1 34 . 1 1 9 9 LYS HB3 H 1 1.890 0.030 . 2 . . . . 9 LYS HB3 . 11398 1 35 . 1 1 9 9 LYS HD2 H 1 1.706 0.030 . 1 . . . . 9 LYS HD2 . 11398 1 36 . 1 1 9 9 LYS HD3 H 1 1.706 0.030 . 1 . . . . 9 LYS HD3 . 11398 1 37 . 1 1 9 9 LYS HE2 H 1 3.000 0.030 . 1 . . . . 9 LYS HE2 . 11398 1 38 . 1 1 9 9 LYS HE3 H 1 3.000 0.030 . 1 . . . . 9 LYS HE3 . 11398 1 39 . 1 1 9 9 LYS HG2 H 1 1.487 0.030 . 2 . . . . 9 LYS HG2 . 11398 1 40 . 1 1 9 9 LYS HG3 H 1 1.447 0.030 . 2 . . . . 9 LYS HG3 . 11398 1 41 . 1 1 9 9 LYS C C 13 176.895 0.300 . 1 . . . . 9 LYS C . 11398 1 42 . 1 1 9 9 LYS CA C 13 56.450 0.300 . 1 . . . . 9 LYS CA . 11398 1 43 . 1 1 9 9 LYS CB C 13 32.990 0.300 . 1 . . . . 9 LYS CB . 11398 1 44 . 1 1 9 9 LYS CD C 13 29.106 0.300 . 1 . . . . 9 LYS CD . 11398 1 45 . 1 1 9 9 LYS CE C 13 42.123 0.300 . 1 . . . . 9 LYS CE . 11398 1 46 . 1 1 9 9 LYS CG C 13 24.767 0.300 . 1 . . . . 9 LYS CG . 11398 1 47 . 1 1 9 9 LYS N N 15 122.050 0.300 . 1 . . . . 9 LYS N . 11398 1 48 . 1 1 10 10 GLY H H 1 8.355 0.030 . 1 . . . . 10 GLY H . 11398 1 49 . 1 1 10 10 GLY HA2 H 1 3.955 0.030 . 2 . . . . 10 GLY HA2 . 11398 1 50 . 1 1 10 10 GLY HA3 H 1 3.888 0.030 . 2 . . . . 10 GLY HA3 . 11398 1 51 . 1 1 10 10 GLY C C 13 173.708 0.300 . 1 . . . . 10 GLY C . 11398 1 52 . 1 1 10 10 GLY CA C 13 45.094 0.300 . 1 . . . . 10 GLY CA . 11398 1 53 . 1 1 10 10 GLY N N 15 110.029 0.300 . 1 . . . . 10 GLY N . 11398 1 54 . 1 1 11 11 GLU H H 1 8.229 0.030 . 1 . . . . 11 GLU H . 11398 1 55 . 1 1 11 11 GLU HA H 1 4.634 0.030 . 1 . . . . 11 GLU HA . 11398 1 56 . 1 1 11 11 GLU HB2 H 1 2.091 0.030 . 2 . . . . 11 GLU HB2 . 11398 1 57 . 1 1 11 11 GLU HB3 H 1 1.920 0.030 . 2 . . . . 11 GLU HB3 . 11398 1 58 . 1 1 11 11 GLU HG2 H 1 2.298 0.030 . 2 . . . . 11 GLU HG2 . 11398 1 59 . 1 1 11 11 GLU HG3 H 1 2.274 0.030 . 2 . . . . 11 GLU HG3 . 11398 1 60 . 1 1 11 11 GLU C C 13 174.736 0.300 . 1 . . . . 11 GLU C . 11398 1 61 . 1 1 11 11 GLU CA C 13 54.456 0.300 . 1 . . . . 11 GLU CA . 11398 1 62 . 1 1 11 11 GLU CB C 13 29.763 0.300 . 1 . . . . 11 GLU CB . 11398 1 63 . 1 1 11 11 GLU CG C 13 35.994 0.300 . 1 . . . . 11 GLU CG . 11398 1 64 . 1 1 11 11 GLU N N 15 121.537 0.300 . 1 . . . . 11 GLU N . 11398 1 65 . 1 1 12 12 PRO HA H 1 4.420 0.030 . 1 . . . . 12 PRO HA . 11398 1 66 . 1 1 12 12 PRO HB2 H 1 1.932 0.030 . 2 . . . . 12 PRO HB2 . 11398 1 67 . 1 1 12 12 PRO HB3 H 1 2.294 0.030 . 2 . . . . 12 PRO HB3 . 11398 1 68 . 1 1 12 12 PRO HD2 H 1 3.816 0.030 . 2 . . . . 12 PRO HD2 . 11398 1 69 . 1 1 12 12 PRO HD3 H 1 3.719 0.030 . 2 . . . . 12 PRO HD3 . 11398 1 70 . 1 1 12 12 PRO HG2 H 1 2.020 0.030 . 1 . . . . 12 PRO HG2 . 11398 1 71 . 1 1 12 12 PRO HG3 H 1 2.020 0.030 . 1 . . . . 12 PRO HG3 . 11398 1 72 . 1 1 12 12 PRO C C 13 176.664 0.300 . 1 . . . . 12 PRO C . 11398 1 73 . 1 1 12 12 PRO CA C 13 63.367 0.300 . 1 . . . . 12 PRO CA . 11398 1 74 . 1 1 12 12 PRO CB C 13 32.201 0.300 . 1 . . . . 12 PRO CB . 11398 1 75 . 1 1 12 12 PRO CD C 13 50.645 0.300 . 1 . . . . 12 PRO CD . 11398 1 76 . 1 1 12 12 PRO CG C 13 27.466 0.300 . 1 . . . . 12 PRO CG . 11398 1 77 . 1 1 13 13 ASP H H 1 8.426 0.030 . 1 . . . . 13 ASP H . 11398 1 78 . 1 1 13 13 ASP HA H 1 4.590 0.030 . 1 . . . . 13 ASP HA . 11398 1 79 . 1 1 13 13 ASP HB2 H 1 2.688 0.030 . 1 . . . . 13 ASP HB2 . 11398 1 80 . 1 1 13 13 ASP HB3 H 1 2.688 0.030 . 1 . . . . 13 ASP HB3 . 11398 1 81 . 1 1 13 13 ASP C C 13 176.381 0.300 . 1 . . . . 13 ASP C . 11398 1 82 . 1 1 13 13 ASP CA C 13 54.409 0.300 . 1 . . . . 13 ASP CA . 11398 1 83 . 1 1 13 13 ASP CB C 13 41.196 0.300 . 1 . . . . 13 ASP CB . 11398 1 84 . 1 1 13 13 ASP N N 15 120.101 0.300 . 1 . . . . 13 ASP N . 11398 1 85 . 1 1 14 14 CYS H H 1 8.207 0.030 . 1 . . . . 14 CYS H . 11398 1 86 . 1 1 14 14 CYS HA H 1 4.430 0.030 . 1 . . . . 14 CYS HA . 11398 1 87 . 1 1 14 14 CYS HB2 H 1 2.852 0.030 . 2 . . . . 14 CYS HB2 . 11398 1 88 . 1 1 14 14 CYS HB3 H 1 2.893 0.030 . 2 . . . . 14 CYS HB3 . 11398 1 89 . 1 1 14 14 CYS C C 13 174.607 0.300 . 1 . . . . 14 CYS C . 11398 1 90 . 1 1 14 14 CYS CA C 13 58.895 0.300 . 1 . . . . 14 CYS CA . 11398 1 91 . 1 1 14 14 CYS CB C 13 27.915 0.300 . 1 . . . . 14 CYS CB . 11398 1 92 . 1 1 14 14 CYS N N 15 118.680 0.300 . 1 . . . . 14 CYS N . 11398 1 93 . 1 1 15 15 TYR H H 1 8.240 0.030 . 1 . . . . 15 TYR H . 11398 1 94 . 1 1 15 15 TYR HA H 1 4.554 0.030 . 1 . . . . 15 TYR HA . 11398 1 95 . 1 1 15 15 TYR HB2 H 1 3.120 0.030 . 2 . . . . 15 TYR HB2 . 11398 1 96 . 1 1 15 15 TYR HB3 H 1 2.982 0.030 . 2 . . . . 15 TYR HB3 . 11398 1 97 . 1 1 15 15 TYR HD1 H 1 7.138 0.030 . 1 . . . . 15 TYR HD1 . 11398 1 98 . 1 1 15 15 TYR HD2 H 1 7.138 0.030 . 1 . . . . 15 TYR HD2 . 11398 1 99 . 1 1 15 15 TYR HE1 H 1 6.824 0.030 . 1 . . . . 15 TYR HE1 . 11398 1 100 . 1 1 15 15 TYR HE2 H 1 6.824 0.030 . 1 . . . . 15 TYR HE2 . 11398 1 101 . 1 1 15 15 TYR C C 13 175.820 0.300 . 1 . . . . 15 TYR C . 11398 1 102 . 1 1 15 15 TYR CA C 13 58.393 0.300 . 1 . . . . 15 TYR CA . 11398 1 103 . 1 1 15 15 TYR CB C 13 38.498 0.300 . 1 . . . . 15 TYR CB . 11398 1 104 . 1 1 15 15 TYR CD1 C 13 133.220 0.300 . 3 . . . . 15 TYR CD1 . 11398 1 105 . 1 1 15 15 TYR CD2 C 13 133.220 0.300 . 3 . . . . 15 TYR CD2 . 11398 1 106 . 1 1 15 15 TYR CE1 C 13 118.339 0.300 . 3 . . . . 15 TYR CE1 . 11398 1 107 . 1 1 15 15 TYR CE2 C 13 118.339 0.300 . 3 . . . . 15 TYR CE2 . 11398 1 108 . 1 1 15 15 TYR N N 15 122.482 0.300 . 1 . . . . 15 TYR N . 11398 1 109 . 1 1 16 16 ALA H H 1 8.099 0.030 . 1 . . . . 16 ALA H . 11398 1 110 . 1 1 16 16 ALA HA H 1 4.267 0.030 . 1 . . . . 16 ALA HA . 11398 1 111 . 1 1 16 16 ALA HB1 H 1 1.404 0.030 . 1 . . . . 16 ALA HB . 11398 1 112 . 1 1 16 16 ALA HB2 H 1 1.404 0.030 . 1 . . . . 16 ALA HB . 11398 1 113 . 1 1 16 16 ALA HB3 H 1 1.404 0.030 . 1 . . . . 16 ALA HB . 11398 1 114 . 1 1 16 16 ALA C C 13 177.760 0.300 . 1 . . . . 16 ALA C . 11398 1 115 . 1 1 16 16 ALA CA C 13 52.937 0.300 . 1 . . . . 16 ALA CA . 11398 1 116 . 1 1 16 16 ALA CB C 13 19.275 0.300 . 1 . . . . 16 ALA CB . 11398 1 117 . 1 1 16 16 ALA N N 15 124.309 0.300 . 1 . . . . 16 ALA N . 11398 1 118 . 1 1 17 17 LEU H H 1 8.055 0.030 . 1 . . . . 17 LEU H . 11398 1 119 . 1 1 17 17 LEU HA H 1 4.341 0.030 . 1 . . . . 17 LEU HA . 11398 1 120 . 1 1 17 17 LEU HB2 H 1 1.683 0.030 . 2 . . . . 17 LEU HB2 . 11398 1 121 . 1 1 17 17 LEU HB3 H 1 1.633 0.030 . 2 . . . . 17 LEU HB3 . 11398 1 122 . 1 1 17 17 LEU HD11 H 1 0.886 0.030 . 1 . . . . 17 LEU HD1 . 11398 1 123 . 1 1 17 17 LEU HD12 H 1 0.886 0.030 . 1 . . . . 17 LEU HD1 . 11398 1 124 . 1 1 17 17 LEU HD13 H 1 0.886 0.030 . 1 . . . . 17 LEU HD1 . 11398 1 125 . 1 1 17 17 LEU HD21 H 1 0.930 0.030 . 1 . . . . 17 LEU HD2 . 11398 1 126 . 1 1 17 17 LEU HD22 H 1 0.930 0.030 . 1 . . . . 17 LEU HD2 . 11398 1 127 . 1 1 17 17 LEU HD23 H 1 0.930 0.030 . 1 . . . . 17 LEU HD2 . 11398 1 128 . 1 1 17 17 LEU HG H 1 1.667 0.030 . 1 . . . . 17 LEU HG . 11398 1 129 . 1 1 17 17 LEU C C 13 177.489 0.300 . 1 . . . . 17 LEU C . 11398 1 130 . 1 1 17 17 LEU CA C 13 55.451 0.300 . 1 . . . . 17 LEU CA . 11398 1 131 . 1 1 17 17 LEU CB C 13 42.518 0.300 . 1 . . . . 17 LEU CB . 11398 1 132 . 1 1 17 17 LEU CD1 C 13 24.476 0.300 . 2 . . . . 17 LEU CD1 . 11398 1 133 . 1 1 17 17 LEU CD2 C 13 23.671 0.300 . 2 . . . . 17 LEU CD2 . 11398 1 134 . 1 1 17 17 LEU CG C 13 27.257 0.300 . 1 . . . . 17 LEU CG . 11398 1 135 . 1 1 17 17 LEU N N 15 120.312 0.300 . 1 . . . . 17 LEU N . 11398 1 136 . 1 1 18 18 SER H H 1 8.202 0.030 . 1 . . . . 18 SER H . 11398 1 137 . 1 1 18 18 SER HA H 1 4.492 0.030 . 1 . . . . 18 SER HA . 11398 1 138 . 1 1 18 18 SER HB2 H 1 3.920 0.030 . 2 . . . . 18 SER HB2 . 11398 1 139 . 1 1 18 18 SER HB3 H 1 4.030 0.030 . 2 . . . . 18 SER HB3 . 11398 1 140 . 1 1 18 18 SER C C 13 174.931 0.300 . 1 . . . . 18 SER C . 11398 1 141 . 1 1 18 18 SER CA C 13 58.354 0.300 . 1 . . . . 18 SER CA . 11398 1 142 . 1 1 18 18 SER CB C 13 63.748 0.300 . 1 . . . . 18 SER CB . 11398 1 143 . 1 1 18 18 SER N N 15 115.989 0.300 . 1 . . . . 18 SER N . 11398 1 144 . 1 1 19 19 LEU H H 1 8.251 0.030 . 1 . . . . 19 LEU H . 11398 1 145 . 1 1 19 19 LEU HA H 1 4.352 0.030 . 1 . . . . 19 LEU HA . 11398 1 146 . 1 1 19 19 LEU HB2 H 1 1.700 0.030 . 2 . . . . 19 LEU HB2 . 11398 1 147 . 1 1 19 19 LEU HB3 H 1 1.637 0.030 . 2 . . . . 19 LEU HB3 . 11398 1 148 . 1 1 19 19 LEU HD11 H 1 0.883 0.030 . 1 . . . . 19 LEU HD1 . 11398 1 149 . 1 1 19 19 LEU HD12 H 1 0.883 0.030 . 1 . . . . 19 LEU HD1 . 11398 1 150 . 1 1 19 19 LEU HD13 H 1 0.883 0.030 . 1 . . . . 19 LEU HD1 . 11398 1 151 . 1 1 19 19 LEU HD21 H 1 0.902 0.030 . 1 . . . . 19 LEU HD2 . 11398 1 152 . 1 1 19 19 LEU HD22 H 1 0.902 0.030 . 1 . . . . 19 LEU HD2 . 11398 1 153 . 1 1 19 19 LEU HD23 H 1 0.902 0.030 . 1 . . . . 19 LEU HD2 . 11398 1 154 . 1 1 19 19 LEU HG H 1 1.649 0.030 . 1 . . . . 19 LEU HG . 11398 1 155 . 1 1 19 19 LEU C C 13 177.644 0.300 . 1 . . . . 19 LEU C . 11398 1 156 . 1 1 19 19 LEU CA C 13 55.592 0.300 . 1 . . . . 19 LEU CA . 11398 1 157 . 1 1 19 19 LEU CB C 13 42.318 0.300 . 1 . . . . 19 LEU CB . 11398 1 158 . 1 1 19 19 LEU CD1 C 13 25.363 0.300 . 2 . . . . 19 LEU CD1 . 11398 1 159 . 1 1 19 19 LEU CD2 C 13 24.000 0.300 . 2 . . . . 19 LEU CD2 . 11398 1 160 . 1 1 19 19 LEU CG C 13 26.927 0.300 . 1 . . . . 19 LEU CG . 11398 1 161 . 1 1 19 19 LEU N N 15 124.116 0.300 . 1 . . . . 19 LEU N . 11398 1 162 . 1 1 20 20 GLU H H 1 8.314 0.030 . 1 . . . . 20 GLU H . 11398 1 163 . 1 1 20 20 GLU HA H 1 4.358 0.030 . 1 . . . . 20 GLU HA . 11398 1 164 . 1 1 20 20 GLU HB2 H 1 2.012 0.030 . 2 . . . . 20 GLU HB2 . 11398 1 165 . 1 1 20 20 GLU HB3 H 1 2.121 0.030 . 2 . . . . 20 GLU HB3 . 11398 1 166 . 1 1 20 20 GLU HG2 H 1 2.322 0.030 . 1 . . . . 20 GLU HG2 . 11398 1 167 . 1 1 20 20 GLU HG3 H 1 2.322 0.030 . 1 . . . . 20 GLU HG3 . 11398 1 168 . 1 1 20 20 GLU C C 13 176.559 0.300 . 1 . . . . 20 GLU C . 11398 1 169 . 1 1 20 20 GLU CA C 13 57.153 0.300 . 1 . . . . 20 GLU CA . 11398 1 170 . 1 1 20 20 GLU CB C 13 30.355 0.300 . 1 . . . . 20 GLU CB . 11398 1 171 . 1 1 20 20 GLU CG C 13 36.339 0.300 . 1 . . . . 20 GLU CG . 11398 1 172 . 1 1 20 20 GLU N N 15 120.311 0.300 . 1 . . . . 20 GLU N . 11398 1 173 . 1 1 21 21 SER H H 1 8.344 0.030 . 1 . . . . 21 SER H . 11398 1 174 . 1 1 21 21 SER HA H 1 4.594 0.030 . 1 . . . . 21 SER HA . 11398 1 175 . 1 1 21 21 SER HB2 H 1 3.950 0.030 . 1 . . . . 21 SER HB2 . 11398 1 176 . 1 1 21 21 SER HB3 H 1 3.950 0.030 . 1 . . . . 21 SER HB3 . 11398 1 177 . 1 1 21 21 SER C C 13 173.960 0.300 . 1 . . . . 21 SER C . 11398 1 178 . 1 1 21 21 SER CA C 13 58.239 0.300 . 1 . . . . 21 SER CA . 11398 1 179 . 1 1 21 21 SER CB C 13 64.046 0.300 . 1 . . . . 21 SER CB . 11398 1 180 . 1 1 21 21 SER N N 15 116.181 0.300 . 1 . . . . 21 SER N . 11398 1 181 . 1 1 22 22 SER H H 1 8.152 0.030 . 1 . . . . 22 SER H . 11398 1 182 . 1 1 22 22 SER HA H 1 5.079 0.030 . 1 . . . . 22 SER HA . 11398 1 183 . 1 1 22 22 SER HB2 H 1 3.725 0.030 . 2 . . . . 22 SER HB2 . 11398 1 184 . 1 1 22 22 SER HB3 H 1 3.810 0.030 . 2 . . . . 22 SER HB3 . 11398 1 185 . 1 1 22 22 SER C C 13 172.832 0.300 . 1 . . . . 22 SER C . 11398 1 186 . 1 1 22 22 SER CA C 13 57.940 0.300 . 1 . . . . 22 SER CA . 11398 1 187 . 1 1 22 22 SER CB C 13 65.690 0.300 . 1 . . . . 22 SER CB . 11398 1 188 . 1 1 22 22 SER N N 15 116.693 0.300 . 1 . . . . 22 SER N . 11398 1 189 . 1 1 23 23 GLU H H 1 8.756 0.030 . 1 . . . . 23 GLU H . 11398 1 190 . 1 1 23 23 GLU HA H 1 4.628 0.030 . 1 . . . . 23 GLU HA . 11398 1 191 . 1 1 23 23 GLU HB2 H 1 1.906 0.030 . 2 . . . . 23 GLU HB2 . 11398 1 192 . 1 1 23 23 GLU HB3 H 1 2.002 0.030 . 2 . . . . 23 GLU HB3 . 11398 1 193 . 1 1 23 23 GLU HG2 H 1 2.199 0.030 . 2 . . . . 23 GLU HG2 . 11398 1 194 . 1 1 23 23 GLU HG3 H 1 2.167 0.030 . 2 . . . . 23 GLU HG3 . 11398 1 195 . 1 1 23 23 GLU C C 13 174.013 0.300 . 1 . . . . 23 GLU C . 11398 1 196 . 1 1 23 23 GLU CA C 13 55.190 0.300 . 1 . . . . 23 GLU CA . 11398 1 197 . 1 1 23 23 GLU CB C 13 32.982 0.300 . 1 . . . . 23 GLU CB . 11398 1 198 . 1 1 23 23 GLU CG C 13 36.037 0.300 . 1 . . . . 23 GLU CG . 11398 1 199 . 1 1 23 23 GLU N N 15 121.182 0.300 . 1 . . . . 23 GLU N . 11398 1 200 . 1 1 24 24 GLN H H 1 8.588 0.030 . 1 . . . . 24 GLN H . 11398 1 201 . 1 1 24 24 GLN HA H 1 5.544 0.030 . 1 . . . . 24 GLN HA . 11398 1 202 . 1 1 24 24 GLN HB2 H 1 1.868 0.030 . 2 . . . . 24 GLN HB2 . 11398 1 203 . 1 1 24 24 GLN HB3 H 1 1.920 0.030 . 2 . . . . 24 GLN HB3 . 11398 1 204 . 1 1 24 24 GLN HE21 H 1 6.691 0.030 . 2 . . . . 24 GLN HE21 . 11398 1 205 . 1 1 24 24 GLN HE22 H 1 7.144 0.030 . 2 . . . . 24 GLN HE22 . 11398 1 206 . 1 1 24 24 GLN HG2 H 1 2.058 0.030 . 2 . . . . 24 GLN HG2 . 11398 1 207 . 1 1 24 24 GLN HG3 H 1 2.191 0.030 . 2 . . . . 24 GLN HG3 . 11398 1 208 . 1 1 24 24 GLN C C 13 175.681 0.300 . 1 . . . . 24 GLN C . 11398 1 209 . 1 1 24 24 GLN CA C 13 54.354 0.300 . 1 . . . . 24 GLN CA . 11398 1 210 . 1 1 24 24 GLN CB C 13 31.144 0.300 . 1 . . . . 24 GLN CB . 11398 1 211 . 1 1 24 24 GLN CG C 13 34.944 0.300 . 1 . . . . 24 GLN CG . 11398 1 212 . 1 1 24 24 GLN N N 15 123.682 0.300 . 1 . . . . 24 GLN N . 11398 1 213 . 1 1 24 24 GLN NE2 N 15 110.613 0.300 . 1 . . . . 24 GLN NE2 . 11398 1 214 . 1 1 25 25 LEU H H 1 8.750 0.030 . 1 . . . . 25 LEU H . 11398 1 215 . 1 1 25 25 LEU HA H 1 4.850 0.030 . 1 . . . . 25 LEU HA . 11398 1 216 . 1 1 25 25 LEU HB2 H 1 1.439 0.030 . 1 . . . . 25 LEU HB2 . 11398 1 217 . 1 1 25 25 LEU HB3 H 1 1.439 0.030 . 1 . . . . 25 LEU HB3 . 11398 1 218 . 1 1 25 25 LEU HD11 H 1 0.869 0.030 . 1 . . . . 25 LEU HD1 . 11398 1 219 . 1 1 25 25 LEU HD12 H 1 0.869 0.030 . 1 . . . . 25 LEU HD1 . 11398 1 220 . 1 1 25 25 LEU HD13 H 1 0.869 0.030 . 1 . . . . 25 LEU HD1 . 11398 1 221 . 1 1 25 25 LEU HD21 H 1 0.784 0.030 . 1 . . . . 25 LEU HD2 . 11398 1 222 . 1 1 25 25 LEU HD22 H 1 0.784 0.030 . 1 . . . . 25 LEU HD2 . 11398 1 223 . 1 1 25 25 LEU HD23 H 1 0.784 0.030 . 1 . . . . 25 LEU HD2 . 11398 1 224 . 1 1 25 25 LEU HG H 1 1.497 0.030 . 1 . . . . 25 LEU HG . 11398 1 225 . 1 1 25 25 LEU C C 13 174.910 0.300 . 1 . . . . 25 LEU C . 11398 1 226 . 1 1 25 25 LEU CA C 13 54.471 0.300 . 1 . . . . 25 LEU CA . 11398 1 227 . 1 1 25 25 LEU CB C 13 45.281 0.300 . 1 . . . . 25 LEU CB . 11398 1 228 . 1 1 25 25 LEU CD1 C 13 24.870 0.300 . 2 . . . . 25 LEU CD1 . 11398 1 229 . 1 1 25 25 LEU CD2 C 13 25.120 0.300 . 2 . . . . 25 LEU CD2 . 11398 1 230 . 1 1 25 25 LEU CG C 13 27.915 0.300 . 1 . . . . 25 LEU CG . 11398 1 231 . 1 1 25 25 LEU N N 15 126.131 0.300 . 1 . . . . 25 LEU N . 11398 1 232 . 1 1 26 26 THR H H 1 8.558 0.030 . 1 . . . . 26 THR H . 11398 1 233 . 1 1 26 26 THR HA H 1 5.019 0.030 . 1 . . . . 26 THR HA . 11398 1 234 . 1 1 26 26 THR HB H 1 3.996 0.030 . 1 . . . . 26 THR HB . 11398 1 235 . 1 1 26 26 THR HG21 H 1 1.070 0.030 . 1 . . . . 26 THR HG2 . 11398 1 236 . 1 1 26 26 THR HG22 H 1 1.070 0.030 . 1 . . . . 26 THR HG2 . 11398 1 237 . 1 1 26 26 THR HG23 H 1 1.070 0.030 . 1 . . . . 26 THR HG2 . 11398 1 238 . 1 1 26 26 THR C C 13 173.815 0.300 . 1 . . . . 26 THR C . 11398 1 239 . 1 1 26 26 THR CA C 13 62.245 0.300 . 1 . . . . 26 THR CA . 11398 1 240 . 1 1 26 26 THR CB C 13 69.600 0.300 . 1 . . . . 26 THR CB . 11398 1 241 . 1 1 26 26 THR CG2 C 13 21.172 0.300 . 1 . . . . 26 THR CG2 . 11398 1 242 . 1 1 26 26 THR N N 15 118.207 0.300 . 1 . . . . 26 THR N . 11398 1 243 . 1 1 27 27 LEU H H 1 9.408 0.030 . 1 . . . . 27 LEU H . 11398 1 244 . 1 1 27 27 LEU HA H 1 4.615 0.030 . 1 . . . . 27 LEU HA . 11398 1 245 . 1 1 27 27 LEU HB2 H 1 1.663 0.030 . 2 . . . . 27 LEU HB2 . 11398 1 246 . 1 1 27 27 LEU HB3 H 1 1.316 0.030 . 2 . . . . 27 LEU HB3 . 11398 1 247 . 1 1 27 27 LEU HD11 H 1 0.756 0.030 . 1 . . . . 27 LEU HD1 . 11398 1 248 . 1 1 27 27 LEU HD12 H 1 0.756 0.030 . 1 . . . . 27 LEU HD1 . 11398 1 249 . 1 1 27 27 LEU HD13 H 1 0.756 0.030 . 1 . . . . 27 LEU HD1 . 11398 1 250 . 1 1 27 27 LEU HD21 H 1 0.717 0.030 . 1 . . . . 27 LEU HD2 . 11398 1 251 . 1 1 27 27 LEU HD22 H 1 0.717 0.030 . 1 . . . . 27 LEU HD2 . 11398 1 252 . 1 1 27 27 LEU HD23 H 1 0.717 0.030 . 1 . . . . 27 LEU HD2 . 11398 1 253 . 1 1 27 27 LEU HG H 1 1.484 0.030 . 1 . . . . 27 LEU HG . 11398 1 254 . 1 1 27 27 LEU C C 13 174.468 0.300 . 1 . . . . 27 LEU C . 11398 1 255 . 1 1 27 27 LEU CA C 13 53.972 0.300 . 1 . . . . 27 LEU CA . 11398 1 256 . 1 1 27 27 LEU CB C 13 45.278 0.300 . 1 . . . . 27 LEU CB . 11398 1 257 . 1 1 27 27 LEU CD1 C 13 24.520 0.300 . 2 . . . . 27 LEU CD1 . 11398 1 258 . 1 1 27 27 LEU CD2 C 13 26.729 0.300 . 2 . . . . 27 LEU CD2 . 11398 1 259 . 1 1 27 27 LEU CG C 13 27.048 0.300 . 1 . . . . 27 LEU CG . 11398 1 260 . 1 1 27 27 LEU N N 15 127.279 0.300 . 1 . . . . 27 LEU N . 11398 1 261 . 1 1 28 28 GLU H H 1 8.304 0.030 . 1 . . . . 28 GLU H . 11398 1 262 . 1 1 28 28 GLU HA H 1 5.067 0.030 . 1 . . . . 28 GLU HA . 11398 1 263 . 1 1 28 28 GLU HB2 H 1 1.949 0.030 . 2 . . . . 28 GLU HB2 . 11398 1 264 . 1 1 28 28 GLU HB3 H 1 2.002 0.030 . 2 . . . . 28 GLU HB3 . 11398 1 265 . 1 1 28 28 GLU HG2 H 1 2.073 0.030 . 2 . . . . 28 GLU HG2 . 11398 1 266 . 1 1 28 28 GLU HG3 H 1 2.229 0.030 . 2 . . . . 28 GLU HG3 . 11398 1 267 . 1 1 28 28 GLU C C 13 175.299 0.300 . 1 . . . . 28 GLU C . 11398 1 268 . 1 1 28 28 GLU CA C 13 55.426 0.300 . 1 . . . . 28 GLU CA . 11398 1 269 . 1 1 28 28 GLU CB C 13 29.776 0.300 . 1 . . . . 28 GLU CB . 11398 1 270 . 1 1 28 28 GLU CG C 13 36.910 0.300 . 1 . . . . 28 GLU CG . 11398 1 271 . 1 1 28 28 GLU N N 15 122.644 0.300 . 1 . . . . 28 GLU N . 11398 1 272 . 1 1 29 29 ILE H H 1 8.896 0.030 . 1 . . . . 29 ILE H . 11398 1 273 . 1 1 29 29 ILE HA H 1 4.599 0.030 . 1 . . . . 29 ILE HA . 11398 1 274 . 1 1 29 29 ILE HB H 1 1.694 0.030 . 1 . . . . 29 ILE HB . 11398 1 275 . 1 1 29 29 ILE HD11 H 1 0.755 0.030 . 1 . . . . 29 ILE HD1 . 11398 1 276 . 1 1 29 29 ILE HD12 H 1 0.755 0.030 . 1 . . . . 29 ILE HD1 . 11398 1 277 . 1 1 29 29 ILE HD13 H 1 0.755 0.030 . 1 . . . . 29 ILE HD1 . 11398 1 278 . 1 1 29 29 ILE HG12 H 1 1.026 0.030 . 2 . . . . 29 ILE HG12 . 11398 1 279 . 1 1 29 29 ILE HG13 H 1 1.395 0.030 . 2 . . . . 29 ILE HG13 . 11398 1 280 . 1 1 29 29 ILE HG21 H 1 0.763 0.030 . 1 . . . . 29 ILE HG2 . 11398 1 281 . 1 1 29 29 ILE HG22 H 1 0.763 0.030 . 1 . . . . 29 ILE HG2 . 11398 1 282 . 1 1 29 29 ILE HG23 H 1 0.763 0.030 . 1 . . . . 29 ILE HG2 . 11398 1 283 . 1 1 29 29 ILE C C 13 173.648 0.300 . 1 . . . . 29 ILE C . 11398 1 284 . 1 1 29 29 ILE CA C 13 58.053 0.300 . 1 . . . . 29 ILE CA . 11398 1 285 . 1 1 29 29 ILE CB C 13 41.003 0.300 . 1 . . . . 29 ILE CB . 11398 1 286 . 1 1 29 29 ILE CD1 C 13 14.257 0.300 . 1 . . . . 29 ILE CD1 . 11398 1 287 . 1 1 29 29 ILE CG1 C 13 27.562 0.300 . 1 . . . . 29 ILE CG1 . 11398 1 288 . 1 1 29 29 ILE CG2 C 13 16.409 0.300 . 1 . . . . 29 ILE CG2 . 11398 1 289 . 1 1 29 29 ILE N N 15 126.450 0.300 . 1 . . . . 29 ILE N . 11398 1 290 . 1 1 30 30 PRO HA H 1 4.805 0.030 . 1 . . . . 30 PRO HA . 11398 1 291 . 1 1 30 30 PRO HB2 H 1 2.383 0.030 . 2 . . . . 30 PRO HB2 . 11398 1 292 . 1 1 30 30 PRO HB3 H 1 2.002 0.030 . 2 . . . . 30 PRO HB3 . 11398 1 293 . 1 1 30 30 PRO HD2 H 1 3.882 0.030 . 2 . . . . 30 PRO HD2 . 11398 1 294 . 1 1 30 30 PRO HD3 H 1 4.059 0.030 . 2 . . . . 30 PRO HD3 . 11398 1 295 . 1 1 30 30 PRO HG2 H 1 2.011 0.030 . 2 . . . . 30 PRO HG2 . 11398 1 296 . 1 1 30 30 PRO HG3 H 1 2.241 0.030 . 2 . . . . 30 PRO HG3 . 11398 1 297 . 1 1 30 30 PRO CA C 13 63.234 0.300 . 1 . . . . 30 PRO CA . 11398 1 298 . 1 1 30 30 PRO CB C 13 32.548 0.300 . 1 . . . . 30 PRO CB . 11398 1 299 . 1 1 30 30 PRO CD C 13 51.946 0.300 . 1 . . . . 30 PRO CD . 11398 1 300 . 1 1 30 30 PRO CG C 13 27.613 0.300 . 1 . . . . 30 PRO CG . 11398 1 301 . 1 1 31 31 LEU H H 1 8.219 0.030 . 1 . . . . 31 LEU H . 11398 1 302 . 1 1 31 31 LEU HA H 1 4.483 0.030 . 1 . . . . 31 LEU HA . 11398 1 303 . 1 1 31 31 LEU HB2 H 1 1.420 0.030 . 2 . . . . 31 LEU HB2 . 11398 1 304 . 1 1 31 31 LEU HB3 H 1 1.546 0.030 . 2 . . . . 31 LEU HB3 . 11398 1 305 . 1 1 31 31 LEU HD11 H 1 0.769 0.030 . 1 . . . . 31 LEU HD1 . 11398 1 306 . 1 1 31 31 LEU HD12 H 1 0.769 0.030 . 1 . . . . 31 LEU HD1 . 11398 1 307 . 1 1 31 31 LEU HD13 H 1 0.769 0.030 . 1 . . . . 31 LEU HD1 . 11398 1 308 . 1 1 31 31 LEU HD21 H 1 0.704 0.030 . 1 . . . . 31 LEU HD2 . 11398 1 309 . 1 1 31 31 LEU HD22 H 1 0.704 0.030 . 1 . . . . 31 LEU HD2 . 11398 1 310 . 1 1 31 31 LEU HD23 H 1 0.704 0.030 . 1 . . . . 31 LEU HD2 . 11398 1 311 . 1 1 31 31 LEU HG H 1 1.548 0.030 . 1 . . . . 31 LEU HG . 11398 1 312 . 1 1 31 31 LEU CA C 13 53.988 0.300 . 1 . . . . 31 LEU CA . 11398 1 313 . 1 1 31 31 LEU CB C 13 43.246 0.300 . 1 . . . . 31 LEU CB . 11398 1 314 . 1 1 31 31 LEU CD1 C 13 25.827 0.300 . 2 . . . . 31 LEU CD1 . 11398 1 315 . 1 1 31 31 LEU CD2 C 13 23.365 0.300 . 2 . . . . 31 LEU CD2 . 11398 1 316 . 1 1 31 31 LEU CG C 13 26.886 0.300 . 1 . . . . 31 LEU CG . 11398 1 317 . 1 1 31 31 LEU N N 15 122.004 0.300 . 1 . . . . 31 LEU N . 11398 1 318 . 1 1 32 32 ASN H H 1 8.383 0.030 . 1 . . . . 32 ASN H . 11398 1 319 . 1 1 32 32 ASN HA H 1 4.691 0.030 . 1 . . . . 32 ASN HA . 11398 1 320 . 1 1 32 32 ASN HB2 H 1 2.890 0.030 . 1 . . . . 32 ASN HB2 . 11398 1 321 . 1 1 32 32 ASN HB3 H 1 2.890 0.030 . 1 . . . . 32 ASN HB3 . 11398 1 322 . 1 1 32 32 ASN HD21 H 1 6.941 0.030 . 2 . . . . 32 ASN HD21 . 11398 1 323 . 1 1 32 32 ASN HD22 H 1 7.709 0.030 . 2 . . . . 32 ASN HD22 . 11398 1 324 . 1 1 32 32 ASN C C 13 175.223 0.300 . 1 . . . . 32 ASN C . 11398 1 325 . 1 1 32 32 ASN CA C 13 54.084 0.300 . 1 . . . . 32 ASN CA . 11398 1 326 . 1 1 32 32 ASN CB C 13 38.788 0.300 . 1 . . . . 32 ASN CB . 11398 1 327 . 1 1 32 32 ASN N N 15 118.299 0.300 . 1 . . . . 32 ASN N . 11398 1 328 . 1 1 32 32 ASN ND2 N 15 112.845 0.300 . 1 . . . . 32 ASN ND2 . 11398 1 329 . 1 1 33 33 ASP H H 1 8.520 0.030 . 1 . . . . 33 ASP H . 11398 1 330 . 1 1 33 33 ASP HA H 1 4.706 0.030 . 1 . . . . 33 ASP HA . 11398 1 331 . 1 1 33 33 ASP HB2 H 1 2.777 0.030 . 2 . . . . 33 ASP HB2 . 11398 1 332 . 1 1 33 33 ASP HB3 H 1 2.704 0.030 . 2 . . . . 33 ASP HB3 . 11398 1 333 . 1 1 33 33 ASP C C 13 176.225 0.300 . 1 . . . . 33 ASP C . 11398 1 334 . 1 1 33 33 ASP CA C 13 54.667 0.300 . 1 . . . . 33 ASP CA . 11398 1 335 . 1 1 33 33 ASP CB C 13 41.136 0.300 . 1 . . . . 33 ASP CB . 11398 1 336 . 1 1 33 33 ASP N N 15 119.758 0.300 . 1 . . . . 33 ASP N . 11398 1 337 . 1 1 34 34 SER H H 1 8.207 0.030 . 1 . . . . 34 SER H . 11398 1 338 . 1 1 34 34 SER HA H 1 4.470 0.030 . 1 . . . . 34 SER HA . 11398 1 339 . 1 1 34 34 SER HB2 H 1 4.024 0.030 . 2 . . . . 34 SER HB2 . 11398 1 340 . 1 1 34 34 SER HB3 H 1 3.916 0.030 . 2 . . . . 34 SER HB3 . 11398 1 341 . 1 1 34 34 SER C C 13 176.251 0.300 . 1 . . . . 34 SER C . 11398 1 342 . 1 1 34 34 SER CA C 13 59.111 0.300 . 1 . . . . 34 SER CA . 11398 1 343 . 1 1 34 34 SER CB C 13 64.052 0.300 . 1 . . . . 34 SER CB . 11398 1 344 . 1 1 34 34 SER N N 15 114.545 0.300 . 1 . . . . 34 SER N . 11398 1 345 . 1 1 35 35 GLY H H 1 8.490 0.030 . 1 . . . . 35 GLY H . 11398 1 346 . 1 1 35 35 GLY HA2 H 1 4.103 0.030 . 1 . . . . 35 GLY HA2 . 11398 1 347 . 1 1 35 35 GLY HA3 H 1 4.103 0.030 . 1 . . . . 35 GLY HA3 . 11398 1 348 . 1 1 35 35 GLY CA C 13 45.529 0.300 . 1 . . . . 35 GLY CA . 11398 1 349 . 1 1 35 35 GLY N N 15 110.430 0.300 . 1 . . . . 35 GLY N . 11398 1 350 . 1 1 36 36 SER H H 1 8.554 0.030 . 1 . . . . 36 SER H . 11398 1 351 . 1 1 36 36 SER HA H 1 4.402 0.030 . 1 . . . . 36 SER HA . 11398 1 352 . 1 1 36 36 SER HB2 H 1 3.918 0.030 . 2 . . . . 36 SER HB2 . 11398 1 353 . 1 1 36 36 SER HB3 H 1 4.087 0.030 . 2 . . . . 36 SER HB3 . 11398 1 354 . 1 1 36 36 SER C C 13 175.021 0.300 . 1 . . . . 36 SER C . 11398 1 355 . 1 1 36 36 SER CA C 13 59.417 0.300 . 1 . . . . 36 SER CA . 11398 1 356 . 1 1 36 36 SER CB C 13 63.431 0.300 . 1 . . . . 36 SER CB . 11398 1 357 . 1 1 37 37 ALA H H 1 8.349 0.030 . 1 . . . . 37 ALA H . 11398 1 358 . 1 1 37 37 ALA HA H 1 4.374 0.030 . 1 . . . . 37 ALA HA . 11398 1 359 . 1 1 37 37 ALA HB1 H 1 1.467 0.030 . 1 . . . . 37 ALA HB . 11398 1 360 . 1 1 37 37 ALA HB2 H 1 1.467 0.030 . 1 . . . . 37 ALA HB . 11398 1 361 . 1 1 37 37 ALA HB3 H 1 1.467 0.030 . 1 . . . . 37 ALA HB . 11398 1 362 . 1 1 37 37 ALA C C 13 178.841 0.300 . 1 . . . . 37 ALA C . 11398 1 363 . 1 1 37 37 ALA CA C 13 53.261 0.300 . 1 . . . . 37 ALA CA . 11398 1 364 . 1 1 37 37 ALA CB C 13 19.324 0.300 . 1 . . . . 37 ALA CB . 11398 1 365 . 1 1 37 37 ALA N N 15 124.440 0.300 . 1 . . . . 37 ALA N . 11398 1 366 . 1 1 38 38 GLY H H 1 8.019 0.030 . 1 . . . . 38 GLY H . 11398 1 367 . 1 1 38 38 GLY HA2 H 1 3.896 0.030 . 2 . . . . 38 GLY HA2 . 11398 1 368 . 1 1 38 38 GLY HA3 H 1 4.088 0.030 . 2 . . . . 38 GLY HA3 . 11398 1 369 . 1 1 38 38 GLY C C 13 174.613 0.300 . 1 . . . . 38 GLY C . 11398 1 370 . 1 1 38 38 GLY CA C 13 45.726 0.300 . 1 . . . . 38 GLY CA . 11398 1 371 . 1 1 38 38 GLY N N 15 106.045 0.300 . 1 . . . . 38 GLY N . 11398 1 372 . 1 1 39 39 LEU H H 1 8.740 0.030 . 1 . . . . 39 LEU H . 11398 1 373 . 1 1 39 39 LEU HA H 1 4.132 0.030 . 1 . . . . 39 LEU HA . 11398 1 374 . 1 1 39 39 LEU HB2 H 1 1.822 0.030 . 2 . . . . 39 LEU HB2 . 11398 1 375 . 1 1 39 39 LEU HB3 H 1 1.578 0.030 . 2 . . . . 39 LEU HB3 . 11398 1 376 . 1 1 39 39 LEU HD11 H 1 0.843 0.030 . 1 . . . . 39 LEU HD1 . 11398 1 377 . 1 1 39 39 LEU HD12 H 1 0.843 0.030 . 1 . . . . 39 LEU HD1 . 11398 1 378 . 1 1 39 39 LEU HD13 H 1 0.843 0.030 . 1 . . . . 39 LEU HD1 . 11398 1 379 . 1 1 39 39 LEU HD21 H 1 0.914 0.030 . 1 . . . . 39 LEU HD2 . 11398 1 380 . 1 1 39 39 LEU HD22 H 1 0.914 0.030 . 1 . . . . 39 LEU HD2 . 11398 1 381 . 1 1 39 39 LEU HD23 H 1 0.914 0.030 . 1 . . . . 39 LEU HD2 . 11398 1 382 . 1 1 39 39 LEU HG H 1 1.701 0.030 . 1 . . . . 39 LEU HG . 11398 1 383 . 1 1 39 39 LEU C C 13 177.022 0.300 . 1 . . . . 39 LEU C . 11398 1 384 . 1 1 39 39 LEU CA C 13 56.827 0.300 . 1 . . . . 39 LEU CA . 11398 1 385 . 1 1 39 39 LEU CB C 13 43.272 0.300 . 1 . . . . 39 LEU CB . 11398 1 386 . 1 1 39 39 LEU CD1 C 13 25.521 0.300 . 2 . . . . 39 LEU CD1 . 11398 1 387 . 1 1 39 39 LEU CD2 C 13 24.120 0.300 . 2 . . . . 39 LEU CD2 . 11398 1 388 . 1 1 39 39 LEU CG C 13 27.171 0.300 . 1 . . . . 39 LEU CG . 11398 1 389 . 1 1 39 39 LEU N N 15 123.475 0.300 . 1 . . . . 39 LEU N . 11398 1 390 . 1 1 40 40 GLY H H 1 8.472 0.030 . 1 . . . . 40 GLY H . 11398 1 391 . 1 1 40 40 GLY HA2 H 1 4.030 0.030 . 1 . . . . 40 GLY HA2 . 11398 1 392 . 1 1 40 40 GLY HA3 H 1 4.030 0.030 . 1 . . . . 40 GLY HA3 . 11398 1 393 . 1 1 40 40 GLY C C 13 175.451 0.300 . 1 . . . . 40 GLY C . 11398 1 394 . 1 1 40 40 GLY CA C 13 47.819 0.300 . 1 . . . . 40 GLY CA . 11398 1 395 . 1 1 40 40 GLY N N 15 106.371 0.300 . 1 . . . . 40 GLY N . 11398 1 396 . 1 1 41 41 VAL H H 1 7.917 0.030 . 1 . . . . 41 VAL H . 11398 1 397 . 1 1 41 41 VAL HA H 1 5.136 0.030 . 1 . . . . 41 VAL HA . 11398 1 398 . 1 1 41 41 VAL HB H 1 2.202 0.030 . 1 . . . . 41 VAL HB . 11398 1 399 . 1 1 41 41 VAL HG11 H 1 0.675 0.030 . 1 . . . . 41 VAL HG1 . 11398 1 400 . 1 1 41 41 VAL HG12 H 1 0.675 0.030 . 1 . . . . 41 VAL HG1 . 11398 1 401 . 1 1 41 41 VAL HG13 H 1 0.675 0.030 . 1 . . . . 41 VAL HG1 . 11398 1 402 . 1 1 41 41 VAL HG21 H 1 0.833 0.030 . 1 . . . . 41 VAL HG2 . 11398 1 403 . 1 1 41 41 VAL HG22 H 1 0.833 0.030 . 1 . . . . 41 VAL HG2 . 11398 1 404 . 1 1 41 41 VAL HG23 H 1 0.833 0.030 . 1 . . . . 41 VAL HG2 . 11398 1 405 . 1 1 41 41 VAL C C 13 174.363 0.300 . 1 . . . . 41 VAL C . 11398 1 406 . 1 1 41 41 VAL CA C 13 58.803 0.300 . 1 . . . . 41 VAL CA . 11398 1 407 . 1 1 41 41 VAL CB C 13 35.724 0.300 . 1 . . . . 41 VAL CB . 11398 1 408 . 1 1 41 41 VAL CG1 C 13 18.993 0.300 . 2 . . . . 41 VAL CG1 . 11398 1 409 . 1 1 41 41 VAL CG2 C 13 23.016 0.300 . 2 . . . . 41 VAL CG2 . 11398 1 410 . 1 1 41 41 VAL N N 15 112.386 0.300 . 1 . . . . 41 VAL N . 11398 1 411 . 1 1 42 42 SER H H 1 8.640 0.030 . 1 . . . . 42 SER H . 11398 1 412 . 1 1 42 42 SER HA H 1 4.980 0.030 . 1 . . . . 42 SER HA . 11398 1 413 . 1 1 42 42 SER HB2 H 1 3.862 0.030 . 1 . . . . 42 SER HB2 . 11398 1 414 . 1 1 42 42 SER HB3 H 1 3.862 0.030 . 1 . . . . 42 SER HB3 . 11398 1 415 . 1 1 42 42 SER C C 13 174.171 0.300 . 1 . . . . 42 SER C . 11398 1 416 . 1 1 42 42 SER CA C 13 56.827 0.300 . 1 . . . . 42 SER CA . 11398 1 417 . 1 1 42 42 SER CB C 13 65.051 0.300 . 1 . . . . 42 SER CB . 11398 1 418 . 1 1 42 42 SER N N 15 116.994 0.300 . 1 . . . . 42 SER N . 11398 1 419 . 1 1 43 43 LEU H H 1 9.027 0.030 . 1 . . . . 43 LEU H . 11398 1 420 . 1 1 43 43 LEU HA H 1 5.283 0.030 . 1 . . . . 43 LEU HA . 11398 1 421 . 1 1 43 43 LEU HB2 H 1 1.818 0.030 . 2 . . . . 43 LEU HB2 . 11398 1 422 . 1 1 43 43 LEU HB3 H 1 1.319 0.030 . 2 . . . . 43 LEU HB3 . 11398 1 423 . 1 1 43 43 LEU HD11 H 1 0.834 0.030 . 1 . . . . 43 LEU HD1 . 11398 1 424 . 1 1 43 43 LEU HD12 H 1 0.834 0.030 . 1 . . . . 43 LEU HD1 . 11398 1 425 . 1 1 43 43 LEU HD13 H 1 0.834 0.030 . 1 . . . . 43 LEU HD1 . 11398 1 426 . 1 1 43 43 LEU HD21 H 1 0.721 0.030 . 1 . . . . 43 LEU HD2 . 11398 1 427 . 1 1 43 43 LEU HD22 H 1 0.721 0.030 . 1 . . . . 43 LEU HD2 . 11398 1 428 . 1 1 43 43 LEU HD23 H 1 0.721 0.030 . 1 . . . . 43 LEU HD2 . 11398 1 429 . 1 1 43 43 LEU HG H 1 1.576 0.030 . 1 . . . . 43 LEU HG . 11398 1 430 . 1 1 43 43 LEU C C 13 175.583 0.300 . 1 . . . . 43 LEU C . 11398 1 431 . 1 1 43 43 LEU CA C 13 53.758 0.300 . 1 . . . . 43 LEU CA . 11398 1 432 . 1 1 43 43 LEU CB C 13 45.408 0.300 . 1 . . . . 43 LEU CB . 11398 1 433 . 1 1 43 43 LEU CD1 C 13 26.236 0.300 . 2 . . . . 43 LEU CD1 . 11398 1 434 . 1 1 43 43 LEU CD2 C 13 24.738 0.300 . 2 . . . . 43 LEU CD2 . 11398 1 435 . 1 1 43 43 LEU CG C 13 27.044 0.300 . 1 . . . . 43 LEU CG . 11398 1 436 . 1 1 43 43 LEU N N 15 125.829 0.300 . 1 . . . . 43 LEU N . 11398 1 437 . 1 1 44 44 LYS H H 1 9.174 0.030 . 1 . . . . 44 LYS H . 11398 1 438 . 1 1 44 44 LYS HA H 1 4.800 0.030 . 1 . . . . 44 LYS HA . 11398 1 439 . 1 1 44 44 LYS HB2 H 1 1.884 0.030 . 2 . . . . 44 LYS HB2 . 11398 1 440 . 1 1 44 44 LYS HB3 H 1 1.736 0.030 . 2 . . . . 44 LYS HB3 . 11398 1 441 . 1 1 44 44 LYS HD2 H 1 1.737 0.030 . 2 . . . . 44 LYS HD2 . 11398 1 442 . 1 1 44 44 LYS HD3 H 1 1.539 0.030 . 2 . . . . 44 LYS HD3 . 11398 1 443 . 1 1 44 44 LYS HE2 H 1 2.919 0.030 . 1 . . . . 44 LYS HE2 . 11398 1 444 . 1 1 44 44 LYS HE3 H 1 2.919 0.030 . 1 . . . . 44 LYS HE3 . 11398 1 445 . 1 1 44 44 LYS HG2 H 1 1.331 0.030 . 2 . . . . 44 LYS HG2 . 11398 1 446 . 1 1 44 44 LYS HG3 H 1 1.367 0.030 . 2 . . . . 44 LYS HG3 . 11398 1 447 . 1 1 44 44 LYS C C 13 174.204 0.300 . 1 . . . . 44 LYS C . 11398 1 448 . 1 1 44 44 LYS CA C 13 54.588 0.300 . 1 . . . . 44 LYS CA . 11398 1 449 . 1 1 44 44 LYS CB C 13 36.576 0.300 . 1 . . . . 44 LYS CB . 11398 1 450 . 1 1 44 44 LYS CD C 13 29.823 0.300 . 1 . . . . 44 LYS CD . 11398 1 451 . 1 1 44 44 LYS CE C 13 42.493 0.300 . 1 . . . . 44 LYS CE . 11398 1 452 . 1 1 44 44 LYS CG C 13 24.358 0.300 . 1 . . . . 44 LYS CG . 11398 1 453 . 1 1 44 44 LYS N N 15 118.566 0.300 . 1 . . . . 44 LYS N . 11398 1 454 . 1 1 45 45 GLY H H 1 8.903 0.030 . 1 . . . . 45 GLY H . 11398 1 455 . 1 1 45 45 GLY HA2 H 1 3.518 0.030 . 2 . . . . 45 GLY HA2 . 11398 1 456 . 1 1 45 45 GLY HA3 H 1 5.216 0.030 . 2 . . . . 45 GLY HA3 . 11398 1 457 . 1 1 45 45 GLY C C 13 173.373 0.300 . 1 . . . . 45 GLY C . 11398 1 458 . 1 1 45 45 GLY CA C 13 44.645 0.300 . 1 . . . . 45 GLY CA . 11398 1 459 . 1 1 45 45 GLY N N 15 111.201 0.300 . 1 . . . . 45 GLY N . 11398 1 460 . 1 1 46 46 ASN H H 1 8.696 0.030 . 1 . . . . 46 ASN H . 11398 1 461 . 1 1 46 46 ASN HA H 1 5.219 0.030 . 1 . . . . 46 ASN HA . 11398 1 462 . 1 1 46 46 ASN HB2 H 1 2.599 0.030 . 2 . . . . 46 ASN HB2 . 11398 1 463 . 1 1 46 46 ASN HB3 H 1 2.440 0.030 . 2 . . . . 46 ASN HB3 . 11398 1 464 . 1 1 46 46 ASN HD21 H 1 5.942 0.030 . 2 . . . . 46 ASN HD21 . 11398 1 465 . 1 1 46 46 ASN HD22 H 1 6.278 0.030 . 2 . . . . 46 ASN HD22 . 11398 1 466 . 1 1 46 46 ASN C C 13 175.556 0.300 . 1 . . . . 46 ASN C . 11398 1 467 . 1 1 46 46 ASN CA C 13 51.678 0.300 . 1 . . . . 46 ASN CA . 11398 1 468 . 1 1 46 46 ASN CB C 13 41.050 0.300 . 1 . . . . 46 ASN CB . 11398 1 469 . 1 1 46 46 ASN N N 15 122.629 0.300 . 1 . . . . 46 ASN N . 11398 1 470 . 1 1 46 46 ASN ND2 N 15 109.069 0.300 . 1 . . . . 46 ASN ND2 . 11398 1 471 . 1 1 47 47 LYS H H 1 8.834 0.030 . 1 . . . . 47 LYS H . 11398 1 472 . 1 1 47 47 LYS HA H 1 5.040 0.030 . 1 . . . . 47 LYS HA . 11398 1 473 . 1 1 47 47 LYS HB2 H 1 1.589 0.030 . 2 . . . . 47 LYS HB2 . 11398 1 474 . 1 1 47 47 LYS HB3 H 1 1.589 0.030 . 2 . . . . 47 LYS HB3 . 11398 1 475 . 1 1 47 47 LYS HD2 H 1 1.681 0.030 . 1 . . . . 47 LYS HD2 . 11398 1 476 . 1 1 47 47 LYS HD3 H 1 1.681 0.030 . 1 . . . . 47 LYS HD3 . 11398 1 477 . 1 1 47 47 LYS HE2 H 1 3.034 0.030 . 1 . . . . 47 LYS HE2 . 11398 1 478 . 1 1 47 47 LYS HE3 H 1 3.034 0.030 . 1 . . . . 47 LYS HE3 . 11398 1 479 . 1 1 47 47 LYS HG2 H 1 1.431 0.030 . 2 . . . . 47 LYS HG2 . 11398 1 480 . 1 1 47 47 LYS HG3 H 1 1.291 0.030 . 2 . . . . 47 LYS HG3 . 11398 1 481 . 1 1 47 47 LYS C C 13 175.504 0.300 . 1 . . . . 47 LYS C . 11398 1 482 . 1 1 47 47 LYS CA C 13 55.308 0.300 . 1 . . . . 47 LYS CA . 11398 1 483 . 1 1 47 47 LYS CB C 13 36.641 0.300 . 1 . . . . 47 LYS CB . 11398 1 484 . 1 1 47 47 LYS CD C 13 29.611 0.300 . 1 . . . . 47 LYS CD . 11398 1 485 . 1 1 47 47 LYS CE C 13 42.002 0.300 . 1 . . . . 47 LYS CE . 11398 1 486 . 1 1 47 47 LYS CG C 13 24.528 0.300 . 1 . . . . 47 LYS CG . 11398 1 487 . 1 1 47 47 LYS N N 15 123.897 0.300 . 1 . . . . 47 LYS N . 11398 1 488 . 1 1 48 48 SER H H 1 8.869 0.030 . 1 . . . . 48 SER H . 11398 1 489 . 1 1 48 48 SER HA H 1 4.551 0.030 . 1 . . . . 48 SER HA . 11398 1 490 . 1 1 48 48 SER HB2 H 1 4.061 0.030 . 2 . . . . 48 SER HB2 . 11398 1 491 . 1 1 48 48 SER HB3 H 1 4.007 0.030 . 2 . . . . 48 SER HB3 . 11398 1 492 . 1 1 48 48 SER C C 13 176.948 0.300 . 1 . . . . 48 SER C . 11398 1 493 . 1 1 48 48 SER CA C 13 57.427 0.300 . 1 . . . . 48 SER CA . 11398 1 494 . 1 1 48 48 SER CB C 13 63.652 0.300 . 1 . . . . 48 SER CB . 11398 1 495 . 1 1 48 48 SER N N 15 117.155 0.300 . 1 . . . . 48 SER N . 11398 1 496 . 1 1 49 49 ARG H H 1 9.266 0.030 . 1 . . . . 49 ARG H . 11398 1 497 . 1 1 49 49 ARG HA H 1 4.143 0.030 . 1 . . . . 49 ARG HA . 11398 1 498 . 1 1 49 49 ARG HB2 H 1 1.911 0.030 . 1 . . . . 49 ARG HB2 . 11398 1 499 . 1 1 49 49 ARG HB3 H 1 1.911 0.030 . 1 . . . . 49 ARG HB3 . 11398 1 500 . 1 1 49 49 ARG HD2 H 1 3.252 0.030 . 2 . . . . 49 ARG HD2 . 11398 1 501 . 1 1 49 49 ARG HD3 H 1 3.355 0.030 . 2 . . . . 49 ARG HD3 . 11398 1 502 . 1 1 49 49 ARG HG2 H 1 1.709 0.030 . 2 . . . . 49 ARG HG2 . 11398 1 503 . 1 1 49 49 ARG HG3 H 1 1.753 0.030 . 2 . . . . 49 ARG HG3 . 11398 1 504 . 1 1 49 49 ARG C C 13 177.479 0.300 . 1 . . . . 49 ARG C . 11398 1 505 . 1 1 49 49 ARG CA C 13 58.564 0.300 . 1 . . . . 49 ARG CA . 11398 1 506 . 1 1 49 49 ARG CB C 13 30.188 0.300 . 1 . . . . 49 ARG CB . 11398 1 507 . 1 1 49 49 ARG CD C 13 43.406 0.300 . 1 . . . . 49 ARG CD . 11398 1 508 . 1 1 49 49 ARG CG C 13 27.391 0.300 . 1 . . . . 49 ARG CG . 11398 1 509 . 1 1 49 49 ARG N N 15 129.772 0.300 . 1 . . . . 49 ARG N . 11398 1 510 . 1 1 50 50 GLU H H 1 8.554 0.030 . 1 . . . . 50 GLU H . 11398 1 511 . 1 1 50 50 GLU HA H 1 4.229 0.030 . 1 . . . . 50 GLU HA . 11398 1 512 . 1 1 50 50 GLU HB2 H 1 2.087 0.030 . 1 . . . . 50 GLU HB2 . 11398 1 513 . 1 1 50 50 GLU HB3 H 1 2.087 0.030 . 1 . . . . 50 GLU HB3 . 11398 1 514 . 1 1 50 50 GLU HG2 H 1 2.305 0.030 . 2 . . . . 50 GLU HG2 . 11398 1 515 . 1 1 50 50 GLU HG3 H 1 2.372 0.030 . 2 . . . . 50 GLU HG3 . 11398 1 516 . 1 1 50 50 GLU C C 13 178.216 0.300 . 1 . . . . 50 GLU C . 11398 1 517 . 1 1 50 50 GLU CA C 13 59.376 0.300 . 1 . . . . 50 GLU CA . 11398 1 518 . 1 1 50 50 GLU CB C 13 30.315 0.300 . 1 . . . . 50 GLU CB . 11398 1 519 . 1 1 50 50 GLU CG C 13 36.890 0.300 . 1 . . . . 50 GLU CG . 11398 1 520 . 1 1 50 50 GLU N N 15 117.593 0.300 . 1 . . . . 50 GLU N . 11398 1 521 . 1 1 51 51 THR H H 1 7.734 0.030 . 1 . . . . 51 THR H . 11398 1 522 . 1 1 51 51 THR HA H 1 4.570 0.030 . 1 . . . . 51 THR HA . 11398 1 523 . 1 1 51 51 THR HB H 1 4.476 0.030 . 1 . . . . 51 THR HB . 11398 1 524 . 1 1 51 51 THR HG21 H 1 1.213 0.030 . 1 . . . . 51 THR HG2 . 11398 1 525 . 1 1 51 51 THR HG22 H 1 1.213 0.030 . 1 . . . . 51 THR HG2 . 11398 1 526 . 1 1 51 51 THR HG23 H 1 1.213 0.030 . 1 . . . . 51 THR HG2 . 11398 1 527 . 1 1 51 51 THR C C 13 176.243 0.300 . 1 . . . . 51 THR C . 11398 1 528 . 1 1 51 51 THR CA C 13 61.450 0.300 . 1 . . . . 51 THR CA . 11398 1 529 . 1 1 51 51 THR CB C 13 70.863 0.300 . 1 . . . . 51 THR CB . 11398 1 530 . 1 1 51 51 THR CG2 C 13 21.658 0.300 . 1 . . . . 51 THR CG2 . 11398 1 531 . 1 1 51 51 THR N N 15 104.688 0.300 . 1 . . . . 51 THR N . 11398 1 532 . 1 1 52 52 GLY H H 1 7.940 0.030 . 1 . . . . 52 GLY H . 11398 1 533 . 1 1 52 52 GLY HA2 H 1 4.192 0.030 . 2 . . . . 52 GLY HA2 . 11398 1 534 . 1 1 52 52 GLY HA3 H 1 3.923 0.030 . 2 . . . . 52 GLY HA3 . 11398 1 535 . 1 1 52 52 GLY C C 13 173.907 0.300 . 1 . . . . 52 GLY C . 11398 1 536 . 1 1 52 52 GLY CA C 13 46.228 0.300 . 1 . . . . 52 GLY CA . 11398 1 537 . 1 1 52 52 GLY N N 15 111.250 0.300 . 1 . . . . 52 GLY N . 11398 1 538 . 1 1 53 53 THR H H 1 7.631 0.030 . 1 . . . . 53 THR H . 11398 1 539 . 1 1 53 53 THR HA H 1 4.290 0.030 . 1 . . . . 53 THR HA . 11398 1 540 . 1 1 53 53 THR HB H 1 4.060 0.030 . 1 . . . . 53 THR HB . 11398 1 541 . 1 1 53 53 THR HG21 H 1 1.260 0.030 . 1 . . . . 53 THR HG2 . 11398 1 542 . 1 1 53 53 THR HG22 H 1 1.260 0.030 . 1 . . . . 53 THR HG2 . 11398 1 543 . 1 1 53 53 THR HG23 H 1 1.260 0.030 . 1 . . . . 53 THR HG2 . 11398 1 544 . 1 1 53 53 THR C C 13 173.994 0.300 . 1 . . . . 53 THR C . 11398 1 545 . 1 1 53 53 THR CA C 13 62.191 0.300 . 1 . . . . 53 THR CA . 11398 1 546 . 1 1 53 53 THR CB C 13 70.254 0.300 . 1 . . . . 53 THR CB . 11398 1 547 . 1 1 53 53 THR CG2 C 13 21.822 0.300 . 1 . . . . 53 THR CG2 . 11398 1 548 . 1 1 53 53 THR N N 15 114.001 0.300 . 1 . . . . 53 THR N . 11398 1 549 . 1 1 54 54 ASP H H 1 8.798 0.030 . 1 . . . . 54 ASP H . 11398 1 550 . 1 1 54 54 ASP HA H 1 4.668 0.030 . 1 . . . . 54 ASP HA . 11398 1 551 . 1 1 54 54 ASP HB2 H 1 2.822 0.030 . 2 . . . . 54 ASP HB2 . 11398 1 552 . 1 1 54 54 ASP HB3 H 1 2.706 0.030 . 2 . . . . 54 ASP HB3 . 11398 1 553 . 1 1 54 54 ASP C C 13 176.954 0.300 . 1 . . . . 54 ASP C . 11398 1 554 . 1 1 54 54 ASP CA C 13 56.192 0.300 . 1 . . . . 54 ASP CA . 11398 1 555 . 1 1 54 54 ASP CB C 13 39.812 0.300 . 1 . . . . 54 ASP CB . 11398 1 556 . 1 1 54 54 ASP N N 15 126.181 0.300 . 1 . . . . 54 ASP N . 11398 1 557 . 1 1 55 55 LEU H H 1 8.794 0.030 . 1 . . . . 55 LEU H . 11398 1 558 . 1 1 55 55 LEU HA H 1 4.647 0.030 . 1 . . . . 55 LEU HA . 11398 1 559 . 1 1 55 55 LEU HB2 H 1 1.382 0.030 . 2 . . . . 55 LEU HB2 . 11398 1 560 . 1 1 55 55 LEU HB3 H 1 1.779 0.030 . 2 . . . . 55 LEU HB3 . 11398 1 561 . 1 1 55 55 LEU HD11 H 1 0.862 0.030 . 1 . . . . 55 LEU HD1 . 11398 1 562 . 1 1 55 55 LEU HD12 H 1 0.862 0.030 . 1 . . . . 55 LEU HD1 . 11398 1 563 . 1 1 55 55 LEU HD13 H 1 0.862 0.030 . 1 . . . . 55 LEU HD1 . 11398 1 564 . 1 1 55 55 LEU HD21 H 1 0.776 0.030 . 1 . . . . 55 LEU HD2 . 11398 1 565 . 1 1 55 55 LEU HD22 H 1 0.776 0.030 . 1 . . . . 55 LEU HD2 . 11398 1 566 . 1 1 55 55 LEU HD23 H 1 0.776 0.030 . 1 . . . . 55 LEU HD2 . 11398 1 567 . 1 1 55 55 LEU HG H 1 1.657 0.030 . 1 . . . . 55 LEU HG . 11398 1 568 . 1 1 55 55 LEU C C 13 176.539 0.300 . 1 . . . . 55 LEU C . 11398 1 569 . 1 1 55 55 LEU CA C 13 54.431 0.300 . 1 . . . . 55 LEU CA . 11398 1 570 . 1 1 55 55 LEU CB C 13 44.635 0.300 . 1 . . . . 55 LEU CB . 11398 1 571 . 1 1 55 55 LEU CD1 C 13 22.871 0.300 . 2 . . . . 55 LEU CD1 . 11398 1 572 . 1 1 55 55 LEU CD2 C 13 25.895 0.300 . 2 . . . . 55 LEU CD2 . 11398 1 573 . 1 1 55 55 LEU CG C 13 27.063 0.300 . 1 . . . . 55 LEU CG . 11398 1 574 . 1 1 55 55 LEU N N 15 121.019 0.300 . 1 . . . . 55 LEU N . 11398 1 575 . 1 1 56 56 GLY H H 1 7.828 0.030 . 1 . . . . 56 GLY H . 11398 1 576 . 1 1 56 56 GLY HA2 H 1 4.703 0.030 . 2 . . . . 56 GLY HA2 . 11398 1 577 . 1 1 56 56 GLY HA3 H 1 3.720 0.030 . 2 . . . . 56 GLY HA3 . 11398 1 578 . 1 1 56 56 GLY C C 13 171.546 0.300 . 1 . . . . 56 GLY C . 11398 1 579 . 1 1 56 56 GLY CA C 13 43.843 0.300 . 1 . . . . 56 GLY CA . 11398 1 580 . 1 1 56 56 GLY N N 15 106.516 0.300 . 1 . . . . 56 GLY N . 11398 1 581 . 1 1 57 57 ILE H H 1 8.762 0.030 . 1 . . . . 57 ILE H . 11398 1 582 . 1 1 57 57 ILE HA H 1 4.971 0.030 . 1 . . . . 57 ILE HA . 11398 1 583 . 1 1 57 57 ILE HB H 1 1.861 0.030 . 1 . . . . 57 ILE HB . 11398 1 584 . 1 1 57 57 ILE HD11 H 1 0.811 0.030 . 1 . . . . 57 ILE HD1 . 11398 1 585 . 1 1 57 57 ILE HD12 H 1 0.811 0.030 . 1 . . . . 57 ILE HD1 . 11398 1 586 . 1 1 57 57 ILE HD13 H 1 0.811 0.030 . 1 . . . . 57 ILE HD1 . 11398 1 587 . 1 1 57 57 ILE HG12 H 1 1.494 0.030 . 2 . . . . 57 ILE HG12 . 11398 1 588 . 1 1 57 57 ILE HG13 H 1 1.344 0.030 . 2 . . . . 57 ILE HG13 . 11398 1 589 . 1 1 57 57 ILE HG21 H 1 0.887 0.030 . 1 . . . . 57 ILE HG2 . 11398 1 590 . 1 1 57 57 ILE HG22 H 1 0.887 0.030 . 1 . . . . 57 ILE HG2 . 11398 1 591 . 1 1 57 57 ILE HG23 H 1 0.887 0.030 . 1 . . . . 57 ILE HG2 . 11398 1 592 . 1 1 57 57 ILE C C 13 174.409 0.300 . 1 . . . . 57 ILE C . 11398 1 593 . 1 1 57 57 ILE CA C 13 58.344 0.300 . 1 . . . . 57 ILE CA . 11398 1 594 . 1 1 57 57 ILE CB C 13 38.463 0.300 . 1 . . . . 57 ILE CB . 11398 1 595 . 1 1 57 57 ILE CD1 C 13 10.900 0.300 . 1 . . . . 57 ILE CD1 . 11398 1 596 . 1 1 57 57 ILE CG1 C 13 26.680 0.300 . 1 . . . . 57 ILE CG1 . 11398 1 597 . 1 1 57 57 ILE CG2 C 13 19.517 0.300 . 1 . . . . 57 ILE CG2 . 11398 1 598 . 1 1 57 57 ILE N N 15 115.533 0.300 . 1 . . . . 57 ILE N . 11398 1 599 . 1 1 58 58 PHE H H 1 9.114 0.030 . 1 . . . . 58 PHE H . 11398 1 600 . 1 1 58 58 PHE HA H 1 5.466 0.030 . 1 . . . . 58 PHE HA . 11398 1 601 . 1 1 58 58 PHE HB2 H 1 2.653 0.030 . 2 . . . . 58 PHE HB2 . 11398 1 602 . 1 1 58 58 PHE HB3 H 1 2.649 0.030 . 2 . . . . 58 PHE HB3 . 11398 1 603 . 1 1 58 58 PHE HD1 H 1 7.166 0.030 . 1 . . . . 58 PHE HD1 . 11398 1 604 . 1 1 58 58 PHE HD2 H 1 7.166 0.030 . 1 . . . . 58 PHE HD2 . 11398 1 605 . 1 1 58 58 PHE HE1 H 1 7.113 0.030 . 1 . . . . 58 PHE HE1 . 11398 1 606 . 1 1 58 58 PHE HE2 H 1 7.113 0.030 . 1 . . . . 58 PHE HE2 . 11398 1 607 . 1 1 58 58 PHE HZ H 1 7.375 0.030 . 1 . . . . 58 PHE HZ . 11398 1 608 . 1 1 58 58 PHE C C 13 176.065 0.300 . 1 . . . . 58 PHE C . 11398 1 609 . 1 1 58 58 PHE CA C 13 55.310 0.300 . 1 . . . . 58 PHE CA . 11398 1 610 . 1 1 58 58 PHE CB C 13 43.981 0.300 . 1 . . . . 58 PHE CB . 11398 1 611 . 1 1 58 58 PHE CD1 C 13 132.406 0.300 . 3 . . . . 58 PHE CD1 . 11398 1 612 . 1 1 58 58 PHE CD2 C 13 132.406 0.300 . 3 . . . . 58 PHE CD2 . 11398 1 613 . 1 1 58 58 PHE CE1 C 13 130.827 0.300 . 3 . . . . 58 PHE CE1 . 11398 1 614 . 1 1 58 58 PHE CE2 C 13 130.827 0.300 . 3 . . . . 58 PHE CE2 . 11398 1 615 . 1 1 58 58 PHE CZ C 13 132.588 0.300 . 1 . . . . 58 PHE CZ . 11398 1 616 . 1 1 58 58 PHE N N 15 123.080 0.300 . 1 . . . . 58 PHE N . 11398 1 617 . 1 1 59 59 ILE H H 1 8.722 0.030 . 1 . . . . 59 ILE H . 11398 1 618 . 1 1 59 59 ILE HA H 1 4.092 0.030 . 1 . . . . 59 ILE HA . 11398 1 619 . 1 1 59 59 ILE HB H 1 2.365 0.030 . 1 . . . . 59 ILE HB . 11398 1 620 . 1 1 59 59 ILE HD11 H 1 0.821 0.030 . 1 . . . . 59 ILE HD1 . 11398 1 621 . 1 1 59 59 ILE HD12 H 1 0.821 0.030 . 1 . . . . 59 ILE HD1 . 11398 1 622 . 1 1 59 59 ILE HD13 H 1 0.821 0.030 . 1 . . . . 59 ILE HD1 . 11398 1 623 . 1 1 59 59 ILE HG12 H 1 1.322 0.030 . 2 . . . . 59 ILE HG12 . 11398 1 624 . 1 1 59 59 ILE HG13 H 1 1.614 0.030 . 2 . . . . 59 ILE HG13 . 11398 1 625 . 1 1 59 59 ILE HG21 H 1 0.742 0.030 . 1 . . . . 59 ILE HG2 . 11398 1 626 . 1 1 59 59 ILE HG22 H 1 0.742 0.030 . 1 . . . . 59 ILE HG2 . 11398 1 627 . 1 1 59 59 ILE HG23 H 1 0.742 0.030 . 1 . . . . 59 ILE HG2 . 11398 1 628 . 1 1 59 59 ILE C C 13 176.558 0.300 . 1 . . . . 59 ILE C . 11398 1 629 . 1 1 59 59 ILE CA C 13 61.643 0.300 . 1 . . . . 59 ILE CA . 11398 1 630 . 1 1 59 59 ILE CB C 13 36.350 0.300 . 1 . . . . 59 ILE CB . 11398 1 631 . 1 1 59 59 ILE CD1 C 13 12.239 0.300 . 1 . . . . 59 ILE CD1 . 11398 1 632 . 1 1 59 59 ILE CG1 C 13 27.240 0.300 . 1 . . . . 59 ILE CG1 . 11398 1 633 . 1 1 59 59 ILE CG2 C 13 17.793 0.300 . 1 . . . . 59 ILE CG2 . 11398 1 634 . 1 1 59 59 ILE N N 15 118.877 0.300 . 1 . . . . 59 ILE N . 11398 1 635 . 1 1 60 60 LYS H H 1 9.429 0.030 . 1 . . . . 60 LYS H . 11398 1 636 . 1 1 60 60 LYS HA H 1 4.458 0.030 . 1 . . . . 60 LYS HA . 11398 1 637 . 1 1 60 60 LYS HB2 H 1 1.446 0.030 . 2 . . . . 60 LYS HB2 . 11398 1 638 . 1 1 60 60 LYS HB3 H 1 1.801 0.030 . 2 . . . . 60 LYS HB3 . 11398 1 639 . 1 1 60 60 LYS HD2 H 1 1.630 0.030 . 2 . . . . 60 LYS HD2 . 11398 1 640 . 1 1 60 60 LYS HD3 H 1 1.704 0.030 . 2 . . . . 60 LYS HD3 . 11398 1 641 . 1 1 60 60 LYS HE2 H 1 3.001 0.030 . 1 . . . . 60 LYS HE2 . 11398 1 642 . 1 1 60 60 LYS HE3 H 1 3.001 0.030 . 1 . . . . 60 LYS HE3 . 11398 1 643 . 1 1 60 60 LYS HG2 H 1 1.465 0.030 . 2 . . . . 60 LYS HG2 . 11398 1 644 . 1 1 60 60 LYS HG3 H 1 1.334 0.030 . 2 . . . . 60 LYS HG3 . 11398 1 645 . 1 1 60 60 LYS CA C 13 57.160 0.300 . 1 . . . . 60 LYS CA . 11398 1 646 . 1 1 60 60 LYS CB C 13 33.649 0.300 . 1 . . . . 60 LYS CB . 11398 1 647 . 1 1 60 60 LYS CD C 13 29.447 0.300 . 1 . . . . 60 LYS CD . 11398 1 648 . 1 1 60 60 LYS CE C 13 42.148 0.300 . 1 . . . . 60 LYS CE . 11398 1 649 . 1 1 60 60 LYS CG C 13 24.912 0.300 . 1 . . . . 60 LYS CG . 11398 1 650 . 1 1 60 60 LYS N N 15 132.791 0.300 . 1 . . . . 60 LYS N . 11398 1 651 . 1 1 61 61 SER H H 1 7.671 0.030 . 1 . . . . 61 SER H . 11398 1 652 . 1 1 61 61 SER HA H 1 4.628 0.030 . 1 . . . . 61 SER HA . 11398 1 653 . 1 1 61 61 SER HB2 H 1 3.774 0.030 . 1 . . . . 61 SER HB2 . 11398 1 654 . 1 1 61 61 SER HB3 H 1 3.774 0.030 . 1 . . . . 61 SER HB3 . 11398 1 655 . 1 1 61 61 SER C C 13 171.749 0.300 . 1 . . . . 61 SER C . 11398 1 656 . 1 1 61 61 SER CA C 13 57.560 0.300 . 1 . . . . 61 SER CA . 11398 1 657 . 1 1 61 61 SER CB C 13 65.537 0.300 . 1 . . . . 61 SER CB . 11398 1 658 . 1 1 61 61 SER N N 15 110.497 0.300 . 1 . . . . 61 SER N . 11398 1 659 . 1 1 62 62 ILE H H 1 8.702 0.030 . 1 . . . . 62 ILE H . 11398 1 660 . 1 1 62 62 ILE HA H 1 4.387 0.030 . 1 . . . . 62 ILE HA . 11398 1 661 . 1 1 62 62 ILE HB H 1 1.940 0.030 . 1 . . . . 62 ILE HB . 11398 1 662 . 1 1 62 62 ILE HD11 H 1 0.646 0.030 . 1 . . . . 62 ILE HD1 . 11398 1 663 . 1 1 62 62 ILE HD12 H 1 0.646 0.030 . 1 . . . . 62 ILE HD1 . 11398 1 664 . 1 1 62 62 ILE HD13 H 1 0.646 0.030 . 1 . . . . 62 ILE HD1 . 11398 1 665 . 1 1 62 62 ILE HG12 H 1 1.028 0.030 . 2 . . . . 62 ILE HG12 . 11398 1 666 . 1 1 62 62 ILE HG13 H 1 1.414 0.030 . 2 . . . . 62 ILE HG13 . 11398 1 667 . 1 1 62 62 ILE HG21 H 1 1.018 0.030 . 1 . . . . 62 ILE HG2 . 11398 1 668 . 1 1 62 62 ILE HG22 H 1 1.018 0.030 . 1 . . . . 62 ILE HG2 . 11398 1 669 . 1 1 62 62 ILE HG23 H 1 1.018 0.030 . 1 . . . . 62 ILE HG2 . 11398 1 670 . 1 1 62 62 ILE C C 13 175.576 0.300 . 1 . . . . 62 ILE C . 11398 1 671 . 1 1 62 62 ILE CA C 13 60.564 0.300 . 1 . . . . 62 ILE CA . 11398 1 672 . 1 1 62 62 ILE CB C 13 38.906 0.300 . 1 . . . . 62 ILE CB . 11398 1 673 . 1 1 62 62 ILE CD1 C 13 13.338 0.300 . 1 . . . . 62 ILE CD1 . 11398 1 674 . 1 1 62 62 ILE CG1 C 13 27.856 0.300 . 1 . . . . 62 ILE CG1 . 11398 1 675 . 1 1 62 62 ILE CG2 C 13 18.217 0.300 . 1 . . . . 62 ILE CG2 . 11398 1 676 . 1 1 62 62 ILE N N 15 123.298 0.300 . 1 . . . . 62 ILE N . 11398 1 677 . 1 1 63 63 ILE H H 1 8.240 0.030 . 1 . . . . 63 ILE H . 11398 1 678 . 1 1 63 63 ILE HA H 1 3.977 0.030 . 1 . . . . 63 ILE HA . 11398 1 679 . 1 1 63 63 ILE HB H 1 1.652 0.030 . 1 . . . . 63 ILE HB . 11398 1 680 . 1 1 63 63 ILE HD11 H 1 0.719 0.030 . 1 . . . . 63 ILE HD1 . 11398 1 681 . 1 1 63 63 ILE HD12 H 1 0.719 0.030 . 1 . . . . 63 ILE HD1 . 11398 1 682 . 1 1 63 63 ILE HD13 H 1 0.719 0.030 . 1 . . . . 63 ILE HD1 . 11398 1 683 . 1 1 63 63 ILE HG12 H 1 1.098 0.030 . 2 . . . . 63 ILE HG12 . 11398 1 684 . 1 1 63 63 ILE HG13 H 1 1.348 0.030 . 2 . . . . 63 ILE HG13 . 11398 1 685 . 1 1 63 63 ILE HG21 H 1 0.903 0.030 . 1 . . . . 63 ILE HG2 . 11398 1 686 . 1 1 63 63 ILE HG22 H 1 0.903 0.030 . 1 . . . . 63 ILE HG2 . 11398 1 687 . 1 1 63 63 ILE HG23 H 1 0.903 0.030 . 1 . . . . 63 ILE HG2 . 11398 1 688 . 1 1 63 63 ILE C C 13 177.100 0.300 . 1 . . . . 63 ILE C . 11398 1 689 . 1 1 63 63 ILE CA C 13 61.298 0.300 . 1 . . . . 63 ILE CA . 11398 1 690 . 1 1 63 63 ILE CB C 13 37.711 0.300 . 1 . . . . 63 ILE CB . 11398 1 691 . 1 1 63 63 ILE CD1 C 13 12.039 0.300 . 1 . . . . 63 ILE CD1 . 11398 1 692 . 1 1 63 63 ILE CG1 C 13 28.130 0.300 . 1 . . . . 63 ILE CG1 . 11398 1 693 . 1 1 63 63 ILE CG2 C 13 17.036 0.300 . 1 . . . . 63 ILE CG2 . 11398 1 694 . 1 1 63 63 ILE N N 15 128.129 0.300 . 1 . . . . 63 ILE N . 11398 1 695 . 1 1 64 64 HIS H H 1 9.248 0.030 . 1 . . . . 64 HIS H . 11398 1 696 . 1 1 64 64 HIS HA H 1 3.071 0.030 . 1 . . . . 64 HIS HA . 11398 1 697 . 1 1 64 64 HIS HB2 H 1 2.798 0.030 . 2 . . . . 64 HIS HB2 . 11398 1 698 . 1 1 64 64 HIS HB3 H 1 2.953 0.030 . 2 . . . . 64 HIS HB3 . 11398 1 699 . 1 1 64 64 HIS HD2 H 1 6.776 0.030 . 1 . . . . 64 HIS HD2 . 11398 1 700 . 1 1 64 64 HIS HE1 H 1 8.064 0.030 . 1 . . . . 64 HIS HE1 . 11398 1 701 . 1 1 64 64 HIS C C 13 175.940 0.300 . 1 . . . . 64 HIS C . 11398 1 702 . 1 1 64 64 HIS CA C 13 59.099 0.300 . 1 . . . . 64 HIS CA . 11398 1 703 . 1 1 64 64 HIS CB C 13 28.953 0.300 . 1 . . . . 64 HIS CB . 11398 1 704 . 1 1 64 64 HIS CD2 C 13 119.620 0.300 . 1 . . . . 64 HIS CD2 . 11398 1 705 . 1 1 64 64 HIS CE1 C 13 137.686 0.300 . 1 . . . . 64 HIS CE1 . 11398 1 706 . 1 1 64 64 HIS N N 15 130.367 0.300 . 1 . . . . 64 HIS N . 11398 1 707 . 1 1 65 65 GLY H H 1 5.472 0.030 . 1 . . . . 65 GLY H . 11398 1 708 . 1 1 65 65 GLY HA2 H 1 4.121 0.030 . 2 . . . . 65 GLY HA2 . 11398 1 709 . 1 1 65 65 GLY HA3 H 1 3.544 0.030 . 2 . . . . 65 GLY HA3 . 11398 1 710 . 1 1 65 65 GLY C C 13 173.875 0.300 . 1 . . . . 65 GLY C . 11398 1 711 . 1 1 65 65 GLY CA C 13 45.115 0.300 . 1 . . . . 65 GLY CA . 11398 1 712 . 1 1 65 65 GLY N N 15 111.319 0.300 . 1 . . . . 65 GLY N . 11398 1 713 . 1 1 66 66 GLY H H 1 7.366 0.030 . 1 . . . . 66 GLY H . 11398 1 714 . 1 1 66 66 GLY HA2 H 1 4.433 0.030 . 2 . . . . 66 GLY HA2 . 11398 1 715 . 1 1 66 66 GLY HA3 H 1 3.951 0.030 . 2 . . . . 66 GLY HA3 . 11398 1 716 . 1 1 66 66 GLY C C 13 173.554 0.300 . 1 . . . . 66 GLY C . 11398 1 717 . 1 1 66 66 GLY CA C 13 44.909 0.300 . 1 . . . . 66 GLY CA . 11398 1 718 . 1 1 66 66 GLY N N 15 105.611 0.300 . 1 . . . . 66 GLY N . 11398 1 719 . 1 1 67 67 ALA H H 1 8.788 0.030 . 1 . . . . 67 ALA H . 11398 1 720 . 1 1 67 67 ALA HA H 1 4.118 0.030 . 1 . . . . 67 ALA HA . 11398 1 721 . 1 1 67 67 ALA HB1 H 1 1.583 0.030 . 1 . . . . 67 ALA HB . 11398 1 722 . 1 1 67 67 ALA HB2 H 1 1.583 0.030 . 1 . . . . 67 ALA HB . 11398 1 723 . 1 1 67 67 ALA HB3 H 1 1.583 0.030 . 1 . . . . 67 ALA HB . 11398 1 724 . 1 1 67 67 ALA C C 13 181.338 0.300 . 1 . . . . 67 ALA C . 11398 1 725 . 1 1 67 67 ALA CA C 13 55.725 0.300 . 1 . . . . 67 ALA CA . 11398 1 726 . 1 1 67 67 ALA CB C 13 19.190 0.300 . 1 . . . . 67 ALA CB . 11398 1 727 . 1 1 67 67 ALA N N 15 120.202 0.300 . 1 . . . . 67 ALA N . 11398 1 728 . 1 1 68 68 ALA H H 1 8.898 0.030 . 1 . . . . 68 ALA H . 11398 1 729 . 1 1 68 68 ALA HA H 1 4.136 0.030 . 1 . . . . 68 ALA HA . 11398 1 730 . 1 1 68 68 ALA HB1 H 1 1.405 0.030 . 1 . . . . 68 ALA HB . 11398 1 731 . 1 1 68 68 ALA HB2 H 1 1.405 0.030 . 1 . . . . 68 ALA HB . 11398 1 732 . 1 1 68 68 ALA HB3 H 1 1.405 0.030 . 1 . . . . 68 ALA HB . 11398 1 733 . 1 1 68 68 ALA C C 13 180.914 0.300 . 1 . . . . 68 ALA C . 11398 1 734 . 1 1 68 68 ALA CA C 13 55.177 0.300 . 1 . . . . 68 ALA CA . 11398 1 735 . 1 1 68 68 ALA CB C 13 19.272 0.300 . 1 . . . . 68 ALA CB . 11398 1 736 . 1 1 68 68 ALA N N 15 120.097 0.300 . 1 . . . . 68 ALA N . 11398 1 737 . 1 1 69 69 PHE H H 1 9.323 0.030 . 1 . . . . 69 PHE H . 11398 1 738 . 1 1 69 69 PHE HA H 1 3.980 0.030 . 1 . . . . 69 PHE HA . 11398 1 739 . 1 1 69 69 PHE HB2 H 1 3.233 0.030 . 2 . . . . 69 PHE HB2 . 11398 1 740 . 1 1 69 69 PHE HB3 H 1 3.230 0.030 . 2 . . . . 69 PHE HB3 . 11398 1 741 . 1 1 69 69 PHE HD1 H 1 7.126 0.030 . 1 . . . . 69 PHE HD1 . 11398 1 742 . 1 1 69 69 PHE HD2 H 1 7.126 0.030 . 1 . . . . 69 PHE HD2 . 11398 1 743 . 1 1 69 69 PHE HE1 H 1 7.352 0.030 . 1 . . . . 69 PHE HE1 . 11398 1 744 . 1 1 69 69 PHE HE2 H 1 7.352 0.030 . 1 . . . . 69 PHE HE2 . 11398 1 745 . 1 1 69 69 PHE HZ H 1 7.258 0.030 . 1 . . . . 69 PHE HZ . 11398 1 746 . 1 1 69 69 PHE C C 13 176.902 0.300 . 1 . . . . 69 PHE C . 11398 1 747 . 1 1 69 69 PHE CA C 13 61.203 0.300 . 1 . . . . 69 PHE CA . 11398 1 748 . 1 1 69 69 PHE CB C 13 39.425 0.300 . 1 . . . . 69 PHE CB . 11398 1 749 . 1 1 69 69 PHE CD1 C 13 131.363 0.300 . 3 . . . . 69 PHE CD1 . 11398 1 750 . 1 1 69 69 PHE CD2 C 13 131.363 0.300 . 3 . . . . 69 PHE CD2 . 11398 1 751 . 1 1 69 69 PHE CE1 C 13 131.384 0.300 . 3 . . . . 69 PHE CE1 . 11398 1 752 . 1 1 69 69 PHE CE2 C 13 131.384 0.300 . 3 . . . . 69 PHE CE2 . 11398 1 753 . 1 1 69 69 PHE CZ C 13 131.981 0.300 . 1 . . . . 69 PHE CZ . 11398 1 754 . 1 1 69 69 PHE N N 15 124.628 0.300 . 1 . . . . 69 PHE N . 11398 1 755 . 1 1 70 70 LYS H H 1 8.472 0.030 . 1 . . . . 70 LYS H . 11398 1 756 . 1 1 70 70 LYS HA H 1 3.801 0.030 . 1 . . . . 70 LYS HA . 11398 1 757 . 1 1 70 70 LYS HB2 H 1 1.879 0.030 . 2 . . . . 70 LYS HB2 . 11398 1 758 . 1 1 70 70 LYS HB3 H 1 1.885 0.030 . 2 . . . . 70 LYS HB3 . 11398 1 759 . 1 1 70 70 LYS HD2 H 1 1.701 0.030 . 1 . . . . 70 LYS HD2 . 11398 1 760 . 1 1 70 70 LYS HD3 H 1 1.701 0.030 . 1 . . . . 70 LYS HD3 . 11398 1 761 . 1 1 70 70 LYS HE2 H 1 2.997 0.030 . 1 . . . . 70 LYS HE2 . 11398 1 762 . 1 1 70 70 LYS HE3 H 1 2.997 0.030 . 1 . . . . 70 LYS HE3 . 11398 1 763 . 1 1 70 70 LYS HG2 H 1 1.516 0.030 . 2 . . . . 70 LYS HG2 . 11398 1 764 . 1 1 70 70 LYS HG3 H 1 1.678 0.030 . 2 . . . . 70 LYS HG3 . 11398 1 765 . 1 1 70 70 LYS C C 13 178.070 0.300 . 1 . . . . 70 LYS C . 11398 1 766 . 1 1 70 70 LYS CA C 13 59.352 0.300 . 1 . . . . 70 LYS CA . 11398 1 767 . 1 1 70 70 LYS CB C 13 32.594 0.300 . 1 . . . . 70 LYS CB . 11398 1 768 . 1 1 70 70 LYS CD C 13 29.302 0.300 . 1 . . . . 70 LYS CD . 11398 1 769 . 1 1 70 70 LYS CE C 13 42.119 0.300 . 1 . . . . 70 LYS CE . 11398 1 770 . 1 1 70 70 LYS CG C 13 25.760 0.300 . 1 . . . . 70 LYS CG . 11398 1 771 . 1 1 70 70 LYS N N 15 119.538 0.300 . 1 . . . . 70 LYS N . 11398 1 772 . 1 1 71 71 ASP H H 1 7.769 0.030 . 1 . . . . 71 ASP H . 11398 1 773 . 1 1 71 71 ASP HA H 1 4.394 0.030 . 1 . . . . 71 ASP HA . 11398 1 774 . 1 1 71 71 ASP HB2 H 1 2.849 0.030 . 2 . . . . 71 ASP HB2 . 11398 1 775 . 1 1 71 71 ASP HB3 H 1 2.661 0.030 . 2 . . . . 71 ASP HB3 . 11398 1 776 . 1 1 71 71 ASP C C 13 178.097 0.300 . 1 . . . . 71 ASP C . 11398 1 777 . 1 1 71 71 ASP CA C 13 57.074 0.300 . 1 . . . . 71 ASP CA . 11398 1 778 . 1 1 71 71 ASP CB C 13 44.196 0.300 . 1 . . . . 71 ASP CB . 11398 1 779 . 1 1 71 71 ASP N N 15 118.335 0.300 . 1 . . . . 71 ASP N . 11398 1 780 . 1 1 72 72 GLY H H 1 7.601 0.030 . 1 . . . . 72 GLY H . 11398 1 781 . 1 1 72 72 GLY HA2 H 1 3.963 0.030 . 2 . . . . 72 GLY HA2 . 11398 1 782 . 1 1 72 72 GLY HA3 H 1 3.741 0.030 . 2 . . . . 72 GLY HA3 . 11398 1 783 . 1 1 72 72 GLY C C 13 175.082 0.300 . 1 . . . . 72 GLY C . 11398 1 784 . 1 1 72 72 GLY CA C 13 46.295 0.300 . 1 . . . . 72 GLY CA . 11398 1 785 . 1 1 72 72 GLY N N 15 102.783 0.300 . 1 . . . . 72 GLY N . 11398 1 786 . 1 1 73 73 ARG H H 1 7.903 0.030 . 1 . . . . 73 ARG H . 11398 1 787 . 1 1 73 73 ARG HA H 1 4.347 0.030 . 1 . . . . 73 ARG HA . 11398 1 788 . 1 1 73 73 ARG HB2 H 1 2.015 0.030 . 2 . . . . 73 ARG HB2 . 11398 1 789 . 1 1 73 73 ARG HB3 H 1 1.701 0.030 . 2 . . . . 73 ARG HB3 . 11398 1 790 . 1 1 73 73 ARG HD2 H 1 3.042 0.030 . 2 . . . . 73 ARG HD2 . 11398 1 791 . 1 1 73 73 ARG HD3 H 1 3.343 0.030 . 2 . . . . 73 ARG HD3 . 11398 1 792 . 1 1 73 73 ARG HE H 1 8.608 0.030 . 1 . . . . 73 ARG HE . 11398 1 793 . 1 1 73 73 ARG HG2 H 1 1.697 0.030 . 2 . . . . 73 ARG HG2 . 11398 1 794 . 1 1 73 73 ARG HG3 H 1 0.753 0.030 . 2 . . . . 73 ARG HG3 . 11398 1 795 . 1 1 73 73 ARG C C 13 177.694 0.300 . 1 . . . . 73 ARG C . 11398 1 796 . 1 1 73 73 ARG CA C 13 58.452 0.300 . 1 . . . . 73 ARG CA . 11398 1 797 . 1 1 73 73 ARG CB C 13 33.041 0.300 . 1 . . . . 73 ARG CB . 11398 1 798 . 1 1 73 73 ARG CD C 13 43.564 0.300 . 1 . . . . 73 ARG CD . 11398 1 799 . 1 1 73 73 ARG CG C 13 27.148 0.300 . 1 . . . . 73 ARG CG . 11398 1 800 . 1 1 73 73 ARG N N 15 119.221 0.300 . 1 . . . . 73 ARG N . 11398 1 801 . 1 1 73 73 ARG NE N 15 118.527 0.300 . 1 . . . . 73 ARG NE . 11398 1 802 . 1 1 74 74 LEU H H 1 9.184 0.030 . 1 . . . . 74 LEU H . 11398 1 803 . 1 1 74 74 LEU HA H 1 3.974 0.030 . 1 . . . . 74 LEU HA . 11398 1 804 . 1 1 74 74 LEU HB2 H 1 1.575 0.030 . 2 . . . . 74 LEU HB2 . 11398 1 805 . 1 1 74 74 LEU HB3 H 1 1.206 0.030 . 2 . . . . 74 LEU HB3 . 11398 1 806 . 1 1 74 74 LEU HD11 H 1 0.816 0.030 . 1 . . . . 74 LEU HD1 . 11398 1 807 . 1 1 74 74 LEU HD12 H 1 0.816 0.030 . 1 . . . . 74 LEU HD1 . 11398 1 808 . 1 1 74 74 LEU HD13 H 1 0.816 0.030 . 1 . . . . 74 LEU HD1 . 11398 1 809 . 1 1 74 74 LEU HD21 H 1 0.788 0.030 . 1 . . . . 74 LEU HD2 . 11398 1 810 . 1 1 74 74 LEU HD22 H 1 0.788 0.030 . 1 . . . . 74 LEU HD2 . 11398 1 811 . 1 1 74 74 LEU HD23 H 1 0.788 0.030 . 1 . . . . 74 LEU HD2 . 11398 1 812 . 1 1 74 74 LEU HG H 1 1.659 0.030 . 1 . . . . 74 LEU HG . 11398 1 813 . 1 1 74 74 LEU C C 13 175.721 0.300 . 1 . . . . 74 LEU C . 11398 1 814 . 1 1 74 74 LEU CA C 13 55.592 0.300 . 1 . . . . 74 LEU CA . 11398 1 815 . 1 1 74 74 LEU CB C 13 43.761 0.300 . 1 . . . . 74 LEU CB . 11398 1 816 . 1 1 74 74 LEU CD1 C 13 24.965 0.300 . 2 . . . . 74 LEU CD1 . 11398 1 817 . 1 1 74 74 LEU CD2 C 13 25.390 0.300 . 2 . . . . 74 LEU CD2 . 11398 1 818 . 1 1 74 74 LEU CG C 13 26.704 0.300 . 1 . . . . 74 LEU CG . 11398 1 819 . 1 1 74 74 LEU N N 15 121.586 0.300 . 1 . . . . 74 LEU N . 11398 1 820 . 1 1 75 75 ARG H H 1 8.838 0.030 . 1 . . . . 75 ARG H . 11398 1 821 . 1 1 75 75 ARG HA H 1 4.600 0.030 . 1 . . . . 75 ARG HA . 11398 1 822 . 1 1 75 75 ARG HB2 H 1 1.819 0.030 . 2 . . . . 75 ARG HB2 . 11398 1 823 . 1 1 75 75 ARG HB3 H 1 1.730 0.030 . 2 . . . . 75 ARG HB3 . 11398 1 824 . 1 1 75 75 ARG HD2 H 1 3.192 0.030 . 2 . . . . 75 ARG HD2 . 11398 1 825 . 1 1 75 75 ARG HD3 H 1 2.990 0.030 . 2 . . . . 75 ARG HD3 . 11398 1 826 . 1 1 75 75 ARG HE H 1 7.266 0.030 . 1 . . . . 75 ARG HE . 11398 1 827 . 1 1 75 75 ARG HG2 H 1 1.613 0.030 . 1 . . . . 75 ARG HG2 . 11398 1 828 . 1 1 75 75 ARG HG3 H 1 1.613 0.030 . 1 . . . . 75 ARG HG3 . 11398 1 829 . 1 1 75 75 ARG C C 13 175.623 0.300 . 1 . . . . 75 ARG C . 11398 1 830 . 1 1 75 75 ARG CA C 13 53.955 0.300 . 1 . . . . 75 ARG CA . 11398 1 831 . 1 1 75 75 ARG CB C 13 34.826 0.300 . 1 . . . . 75 ARG CB . 11398 1 832 . 1 1 75 75 ARG CD C 13 44.035 0.300 . 1 . . . . 75 ARG CD . 11398 1 833 . 1 1 75 75 ARG CG C 13 26.649 0.300 . 1 . . . . 75 ARG CG . 11398 1 834 . 1 1 75 75 ARG N N 15 120.423 0.300 . 1 . . . . 75 ARG N . 11398 1 835 . 1 1 75 75 ARG NE N 15 118.322 0.300 . 1 . . . . 75 ARG NE . 11398 1 836 . 1 1 76 76 MET H H 1 8.640 0.030 . 1 . . . . 76 MET H . 11398 1 837 . 1 1 76 76 MET HA H 1 3.679 0.030 . 1 . . . . 76 MET HA . 11398 1 838 . 1 1 76 76 MET HB2 H 1 2.005 0.030 . 2 . . . . 76 MET HB2 . 11398 1 839 . 1 1 76 76 MET HB3 H 1 1.966 0.030 . 2 . . . . 76 MET HB3 . 11398 1 840 . 1 1 76 76 MET HE1 H 1 2.208 0.030 . 1 . . . . 76 MET HE . 11398 1 841 . 1 1 76 76 MET HE2 H 1 2.208 0.030 . 1 . . . . 76 MET HE . 11398 1 842 . 1 1 76 76 MET HE3 H 1 2.208 0.030 . 1 . . . . 76 MET HE . 11398 1 843 . 1 1 76 76 MET HG2 H 1 2.424 0.030 . 2 . . . . 76 MET HG2 . 11398 1 844 . 1 1 76 76 MET HG3 H 1 2.639 0.030 . 2 . . . . 76 MET HG3 . 11398 1 845 . 1 1 76 76 MET C C 13 177.357 0.300 . 1 . . . . 76 MET C . 11398 1 846 . 1 1 76 76 MET CA C 13 58.113 0.300 . 1 . . . . 76 MET CA . 11398 1 847 . 1 1 76 76 MET CB C 13 33.010 0.300 . 1 . . . . 76 MET CB . 11398 1 848 . 1 1 76 76 MET CE C 13 16.735 0.300 . 1 . . . . 76 MET CE . 11398 1 849 . 1 1 76 76 MET CG C 13 31.849 0.300 . 1 . . . . 76 MET CG . 11398 1 850 . 1 1 76 76 MET N N 15 119.356 0.300 . 1 . . . . 76 MET N . 11398 1 851 . 1 1 77 77 ASN H H 1 9.599 0.030 . 1 . . . . 77 ASN H . 11398 1 852 . 1 1 77 77 ASN HA H 1 4.417 0.030 . 1 . . . . 77 ASN HA . 11398 1 853 . 1 1 77 77 ASN HB2 H 1 3.348 0.030 . 2 . . . . 77 ASN HB2 . 11398 1 854 . 1 1 77 77 ASN HB3 H 1 3.214 0.030 . 2 . . . . 77 ASN HB3 . 11398 1 855 . 1 1 77 77 ASN HD21 H 1 7.072 0.030 . 2 . . . . 77 ASN HD21 . 11398 1 856 . 1 1 77 77 ASN HD22 H 1 7.772 0.030 . 2 . . . . 77 ASN HD22 . 11398 1 857 . 1 1 77 77 ASN C C 13 174.646 0.300 . 1 . . . . 77 ASN C . 11398 1 858 . 1 1 77 77 ASN CA C 13 56.127 0.300 . 1 . . . . 77 ASN CA . 11398 1 859 . 1 1 77 77 ASN CB C 13 37.280 0.300 . 1 . . . . 77 ASN CB . 11398 1 860 . 1 1 77 77 ASN N N 15 117.893 0.300 . 1 . . . . 77 ASN N . 11398 1 861 . 1 1 77 77 ASN ND2 N 15 113.895 0.300 . 1 . . . . 77 ASN ND2 . 11398 1 862 . 1 1 78 78 ASP H H 1 7.920 0.030 . 1 . . . . 78 ASP H . 11398 1 863 . 1 1 78 78 ASP HA H 1 4.782 0.030 . 1 . . . . 78 ASP HA . 11398 1 864 . 1 1 78 78 ASP HB2 H 1 2.786 0.030 . 2 . . . . 78 ASP HB2 . 11398 1 865 . 1 1 78 78 ASP HB3 H 1 2.290 0.030 . 2 . . . . 78 ASP HB3 . 11398 1 866 . 1 1 78 78 ASP C C 13 175.326 0.300 . 1 . . . . 78 ASP C . 11398 1 867 . 1 1 78 78 ASP CA C 13 56.615 0.300 . 1 . . . . 78 ASP CA . 11398 1 868 . 1 1 78 78 ASP CB C 13 41.573 0.300 . 1 . . . . 78 ASP CB . 11398 1 869 . 1 1 78 78 ASP N N 15 121.908 0.300 . 1 . . . . 78 ASP N . 11398 1 870 . 1 1 79 79 GLN H H 1 8.706 0.030 . 1 . . . . 79 GLN H . 11398 1 871 . 1 1 79 79 GLN HA H 1 4.356 0.030 . 1 . . . . 79 GLN HA . 11398 1 872 . 1 1 79 79 GLN HB2 H 1 1.555 0.030 . 2 . . . . 79 GLN HB2 . 11398 1 873 . 1 1 79 79 GLN HB3 H 1 1.884 0.030 . 2 . . . . 79 GLN HB3 . 11398 1 874 . 1 1 79 79 GLN HE21 H 1 6.424 0.030 . 2 . . . . 79 GLN HE21 . 11398 1 875 . 1 1 79 79 GLN HE22 H 1 7.766 0.030 . 2 . . . . 79 GLN HE22 . 11398 1 876 . 1 1 79 79 GLN HG2 H 1 1.665 0.030 . 2 . . . . 79 GLN HG2 . 11398 1 877 . 1 1 79 79 GLN HG3 H 1 1.168 0.030 . 2 . . . . 79 GLN HG3 . 11398 1 878 . 1 1 79 79 GLN C C 13 176.230 0.300 . 1 . . . . 79 GLN C . 11398 1 879 . 1 1 79 79 GLN CA C 13 53.796 0.300 . 1 . . . . 79 GLN CA . 11398 1 880 . 1 1 79 79 GLN CB C 13 29.815 0.300 . 1 . . . . 79 GLN CB . 11398 1 881 . 1 1 79 79 GLN CG C 13 32.609 0.300 . 1 . . . . 79 GLN CG . 11398 1 882 . 1 1 79 79 GLN N N 15 122.694 0.300 . 1 . . . . 79 GLN N . 11398 1 883 . 1 1 79 79 GLN NE2 N 15 107.907 0.300 . 1 . . . . 79 GLN NE2 . 11398 1 884 . 1 1 80 80 LEU H H 1 8.379 0.030 . 1 . . . . 80 LEU H . 11398 1 885 . 1 1 80 80 LEU HA H 1 4.544 0.030 . 1 . . . . 80 LEU HA . 11398 1 886 . 1 1 80 80 LEU HB2 H 1 1.196 0.030 . 2 . . . . 80 LEU HB2 . 11398 1 887 . 1 1 80 80 LEU HB3 H 1 1.494 0.030 . 2 . . . . 80 LEU HB3 . 11398 1 888 . 1 1 80 80 LEU HD11 H 1 0.782 0.030 . 1 . . . . 80 LEU HD1 . 11398 1 889 . 1 1 80 80 LEU HD12 H 1 0.782 0.030 . 1 . . . . 80 LEU HD1 . 11398 1 890 . 1 1 80 80 LEU HD13 H 1 0.782 0.030 . 1 . . . . 80 LEU HD1 . 11398 1 891 . 1 1 80 80 LEU HD21 H 1 0.766 0.030 . 1 . . . . 80 LEU HD2 . 11398 1 892 . 1 1 80 80 LEU HD22 H 1 0.766 0.030 . 1 . . . . 80 LEU HD2 . 11398 1 893 . 1 1 80 80 LEU HD23 H 1 0.766 0.030 . 1 . . . . 80 LEU HD2 . 11398 1 894 . 1 1 80 80 LEU HG H 1 1.529 0.030 . 1 . . . . 80 LEU HG . 11398 1 895 . 1 1 80 80 LEU C C 13 175.121 0.300 . 1 . . . . 80 LEU C . 11398 1 896 . 1 1 80 80 LEU CA C 13 55.058 0.300 . 1 . . . . 80 LEU CA . 11398 1 897 . 1 1 80 80 LEU CB C 13 41.747 0.300 . 1 . . . . 80 LEU CB . 11398 1 898 . 1 1 80 80 LEU CD1 C 13 25.933 0.300 . 2 . . . . 80 LEU CD1 . 11398 1 899 . 1 1 80 80 LEU CD2 C 13 25.767 0.300 . 2 . . . . 80 LEU CD2 . 11398 1 900 . 1 1 80 80 LEU CG C 13 28.411 0.300 . 1 . . . . 80 LEU CG . 11398 1 901 . 1 1 80 80 LEU N N 15 127.442 0.300 . 1 . . . . 80 LEU N . 11398 1 902 . 1 1 81 81 ILE H H 1 9.009 0.030 . 1 . . . . 81 ILE H . 11398 1 903 . 1 1 81 81 ILE HA H 1 4.567 0.030 . 1 . . . . 81 ILE HA . 11398 1 904 . 1 1 81 81 ILE HB H 1 1.970 0.030 . 1 . . . . 81 ILE HB . 11398 1 905 . 1 1 81 81 ILE HD11 H 1 0.716 0.030 . 1 . . . . 81 ILE HD1 . 11398 1 906 . 1 1 81 81 ILE HD12 H 1 0.716 0.030 . 1 . . . . 81 ILE HD1 . 11398 1 907 . 1 1 81 81 ILE HD13 H 1 0.716 0.030 . 1 . . . . 81 ILE HD1 . 11398 1 908 . 1 1 81 81 ILE HG12 H 1 1.061 0.030 . 2 . . . . 81 ILE HG12 . 11398 1 909 . 1 1 81 81 ILE HG13 H 1 0.823 0.030 . 2 . . . . 81 ILE HG13 . 11398 1 910 . 1 1 81 81 ILE HG21 H 1 0.759 0.030 . 1 . . . . 81 ILE HG2 . 11398 1 911 . 1 1 81 81 ILE HG22 H 1 0.759 0.030 . 1 . . . . 81 ILE HG2 . 11398 1 912 . 1 1 81 81 ILE HG23 H 1 0.759 0.030 . 1 . . . . 81 ILE HG2 . 11398 1 913 . 1 1 81 81 ILE C C 13 176.058 0.300 . 1 . . . . 81 ILE C . 11398 1 914 . 1 1 81 81 ILE CA C 13 61.379 0.300 . 1 . . . . 81 ILE CA . 11398 1 915 . 1 1 81 81 ILE CB C 13 39.433 0.300 . 1 . . . . 81 ILE CB . 11398 1 916 . 1 1 81 81 ILE CD1 C 13 13.398 0.300 . 1 . . . . 81 ILE CD1 . 11398 1 917 . 1 1 81 81 ILE CG1 C 13 26.826 0.300 . 1 . . . . 81 ILE CG1 . 11398 1 918 . 1 1 81 81 ILE CG2 C 13 18.431 0.300 . 1 . . . . 81 ILE CG2 . 11398 1 919 . 1 1 81 81 ILE N N 15 116.923 0.300 . 1 . . . . 81 ILE N . 11398 1 920 . 1 1 82 82 ALA H H 1 8.013 0.030 . 1 . . . . 82 ALA H . 11398 1 921 . 1 1 82 82 ALA HA H 1 4.989 0.030 . 1 . . . . 82 ALA HA . 11398 1 922 . 1 1 82 82 ALA HB1 H 1 1.239 0.030 . 1 . . . . 82 ALA HB . 11398 1 923 . 1 1 82 82 ALA HB2 H 1 1.239 0.030 . 1 . . . . 82 ALA HB . 11398 1 924 . 1 1 82 82 ALA HB3 H 1 1.239 0.030 . 1 . . . . 82 ALA HB . 11398 1 925 . 1 1 82 82 ALA C C 13 175.010 0.300 . 1 . . . . 82 ALA C . 11398 1 926 . 1 1 82 82 ALA CA C 13 53.091 0.300 . 1 . . . . 82 ALA CA . 11398 1 927 . 1 1 82 82 ALA CB C 13 22.196 0.300 . 1 . . . . 82 ALA CB . 11398 1 928 . 1 1 82 82 ALA N N 15 123.937 0.300 . 1 . . . . 82 ALA N . 11398 1 929 . 1 1 83 83 VAL H H 1 8.641 0.030 . 1 . . . . 83 VAL H . 11398 1 930 . 1 1 83 83 VAL HA H 1 5.160 0.030 . 1 . . . . 83 VAL HA . 11398 1 931 . 1 1 83 83 VAL HB H 1 1.850 0.030 . 1 . . . . 83 VAL HB . 11398 1 932 . 1 1 83 83 VAL HG11 H 1 0.945 0.030 . 1 . . . . 83 VAL HG1 . 11398 1 933 . 1 1 83 83 VAL HG12 H 1 0.945 0.030 . 1 . . . . 83 VAL HG1 . 11398 1 934 . 1 1 83 83 VAL HG13 H 1 0.945 0.030 . 1 . . . . 83 VAL HG1 . 11398 1 935 . 1 1 83 83 VAL HG21 H 1 0.961 0.030 . 1 . . . . 83 VAL HG2 . 11398 1 936 . 1 1 83 83 VAL HG22 H 1 0.961 0.030 . 1 . . . . 83 VAL HG2 . 11398 1 937 . 1 1 83 83 VAL HG23 H 1 0.961 0.030 . 1 . . . . 83 VAL HG2 . 11398 1 938 . 1 1 83 83 VAL CA C 13 58.801 0.300 . 1 . . . . 83 VAL CA . 11398 1 939 . 1 1 83 83 VAL CB C 13 34.305 0.300 . 1 . . . . 83 VAL CB . 11398 1 940 . 1 1 83 83 VAL CG1 C 13 19.408 0.300 . 2 . . . . 83 VAL CG1 . 11398 1 941 . 1 1 83 83 VAL CG2 C 13 21.691 0.300 . 2 . . . . 83 VAL CG2 . 11398 1 942 . 1 1 83 83 VAL N N 15 116.775 0.300 . 1 . . . . 83 VAL N . 11398 1 943 . 1 1 84 84 ASN H H 1 9.983 0.030 . 1 . . . . 84 ASN H . 11398 1 944 . 1 1 84 84 ASN HA H 1 4.482 0.030 . 1 . . . . 84 ASN HA . 11398 1 945 . 1 1 84 84 ASN HB2 H 1 3.164 0.030 . 2 . . . . 84 ASN HB2 . 11398 1 946 . 1 1 84 84 ASN HB3 H 1 2.949 0.030 . 2 . . . . 84 ASN HB3 . 11398 1 947 . 1 1 84 84 ASN HD21 H 1 7.329 0.030 . 2 . . . . 84 ASN HD21 . 11398 1 948 . 1 1 84 84 ASN HD22 H 1 7.741 0.030 . 2 . . . . 84 ASN HD22 . 11398 1 949 . 1 1 84 84 ASN C C 13 175.100 0.300 . 1 . . . . 84 ASN C . 11398 1 950 . 1 1 84 84 ASN CA C 13 54.083 0.300 . 1 . . . . 84 ASN CA . 11398 1 951 . 1 1 84 84 ASN CB C 13 37.420 0.300 . 1 . . . . 84 ASN CB . 11398 1 952 . 1 1 84 84 ASN N N 15 127.886 0.300 . 1 . . . . 84 ASN N . 11398 1 953 . 1 1 84 84 ASN ND2 N 15 112.186 0.300 . 1 . . . . 84 ASN ND2 . 11398 1 954 . 1 1 85 85 GLY H H 1 9.087 0.030 . 1 . . . . 85 GLY H . 11398 1 955 . 1 1 85 85 GLY HA2 H 1 4.189 0.030 . 2 . . . . 85 GLY HA2 . 11398 1 956 . 1 1 85 85 GLY HA3 H 1 3.589 0.030 . 2 . . . . 85 GLY HA3 . 11398 1 957 . 1 1 85 85 GLY C C 13 173.822 0.300 . 1 . . . . 85 GLY C . 11398 1 958 . 1 1 85 85 GLY CA C 13 45.367 0.300 . 1 . . . . 85 GLY CA . 11398 1 959 . 1 1 85 85 GLY N N 15 104.207 0.300 . 1 . . . . 85 GLY N . 11398 1 960 . 1 1 86 86 GLU H H 1 8.305 0.030 . 1 . . . . 86 GLU H . 11398 1 961 . 1 1 86 86 GLU HA H 1 4.617 0.030 . 1 . . . . 86 GLU HA . 11398 1 962 . 1 1 86 86 GLU HB2 H 1 2.020 0.030 . 1 . . . . 86 GLU HB2 . 11398 1 963 . 1 1 86 86 GLU HB3 H 1 2.020 0.030 . 1 . . . . 86 GLU HB3 . 11398 1 964 . 1 1 86 86 GLU HG2 H 1 2.263 0.030 . 2 . . . . 86 GLU HG2 . 11398 1 965 . 1 1 86 86 GLU HG3 H 1 2.239 0.030 . 2 . . . . 86 GLU HG3 . 11398 1 966 . 1 1 86 86 GLU C C 13 175.681 0.300 . 1 . . . . 86 GLU C . 11398 1 967 . 1 1 86 86 GLU CA C 13 54.781 0.300 . 1 . . . . 86 GLU CA . 11398 1 968 . 1 1 86 86 GLU CB C 13 30.680 0.300 . 1 . . . . 86 GLU CB . 11398 1 969 . 1 1 86 86 GLU CG C 13 35.820 0.300 . 1 . . . . 86 GLU CG . 11398 1 970 . 1 1 86 86 GLU N N 15 123.135 0.300 . 1 . . . . 86 GLU N . 11398 1 971 . 1 1 87 87 THR H H 1 8.576 0.030 . 1 . . . . 87 THR H . 11398 1 972 . 1 1 87 87 THR HA H 1 4.420 0.030 . 1 . . . . 87 THR HA . 11398 1 973 . 1 1 87 87 THR HB H 1 4.310 0.030 . 1 . . . . 87 THR HB . 11398 1 974 . 1 1 87 87 THR HG21 H 1 1.318 0.030 . 1 . . . . 87 THR HG2 . 11398 1 975 . 1 1 87 87 THR HG22 H 1 1.318 0.030 . 1 . . . . 87 THR HG2 . 11398 1 976 . 1 1 87 87 THR HG23 H 1 1.318 0.030 . 1 . . . . 87 THR HG2 . 11398 1 977 . 1 1 87 87 THR C C 13 173.531 0.300 . 1 . . . . 87 THR C . 11398 1 978 . 1 1 87 87 THR CA C 13 62.669 0.300 . 1 . . . . 87 THR CA . 11398 1 979 . 1 1 87 87 THR CB C 13 69.289 0.300 . 1 . . . . 87 THR CB . 11398 1 980 . 1 1 87 87 THR CG2 C 13 20.621 0.300 . 1 . . . . 87 THR CG2 . 11398 1 981 . 1 1 87 87 THR N N 15 120.087 0.300 . 1 . . . . 87 THR N . 11398 1 982 . 1 1 88 88 LEU H H 1 8.671 0.030 . 1 . . . . 88 LEU H . 11398 1 983 . 1 1 88 88 LEU HA H 1 4.442 0.030 . 1 . . . . 88 LEU HA . 11398 1 984 . 1 1 88 88 LEU HB2 H 1 1.392 0.030 . 2 . . . . 88 LEU HB2 . 11398 1 985 . 1 1 88 88 LEU HB3 H 1 1.619 0.030 . 2 . . . . 88 LEU HB3 . 11398 1 986 . 1 1 88 88 LEU HD11 H 1 0.833 0.030 . 1 . . . . 88 LEU HD1 . 11398 1 987 . 1 1 88 88 LEU HD12 H 1 0.833 0.030 . 1 . . . . 88 LEU HD1 . 11398 1 988 . 1 1 88 88 LEU HD13 H 1 0.833 0.030 . 1 . . . . 88 LEU HD1 . 11398 1 989 . 1 1 88 88 LEU HD21 H 1 0.638 0.030 . 1 . . . . 88 LEU HD2 . 11398 1 990 . 1 1 88 88 LEU HD22 H 1 0.638 0.030 . 1 . . . . 88 LEU HD2 . 11398 1 991 . 1 1 88 88 LEU HD23 H 1 0.638 0.030 . 1 . . . . 88 LEU HD2 . 11398 1 992 . 1 1 88 88 LEU HG H 1 1.494 0.030 . 1 . . . . 88 LEU HG . 11398 1 993 . 1 1 88 88 LEU C C 13 178.063 0.300 . 1 . . . . 88 LEU C . 11398 1 994 . 1 1 88 88 LEU CA C 13 54.115 0.300 . 1 . . . . 88 LEU CA . 11398 1 995 . 1 1 88 88 LEU CB C 13 42.053 0.300 . 1 . . . . 88 LEU CB . 11398 1 996 . 1 1 88 88 LEU CD1 C 13 23.028 0.300 . 2 . . . . 88 LEU CD1 . 11398 1 997 . 1 1 88 88 LEU CD2 C 13 25.490 0.300 . 2 . . . . 88 LEU CD2 . 11398 1 998 . 1 1 88 88 LEU CG C 13 27.255 0.300 . 1 . . . . 88 LEU CG . 11398 1 999 . 1 1 88 88 LEU N N 15 123.644 0.300 . 1 . . . . 88 LEU N . 11398 1 1000 . 1 1 89 89 LEU H H 1 8.072 0.030 . 1 . . . . 89 LEU H . 11398 1 1001 . 1 1 89 89 LEU HA H 1 4.337 0.030 . 1 . . . . 89 LEU HA . 11398 1 1002 . 1 1 89 89 LEU HB2 H 1 1.498 0.030 . 2 . . . . 89 LEU HB2 . 11398 1 1003 . 1 1 89 89 LEU HB3 H 1 1.760 0.030 . 2 . . . . 89 LEU HB3 . 11398 1 1004 . 1 1 89 89 LEU HD11 H 1 0.940 0.030 . 1 . . . . 89 LEU HD1 . 11398 1 1005 . 1 1 89 89 LEU HD12 H 1 0.940 0.030 . 1 . . . . 89 LEU HD1 . 11398 1 1006 . 1 1 89 89 LEU HD13 H 1 0.940 0.030 . 1 . . . . 89 LEU HD1 . 11398 1 1007 . 1 1 89 89 LEU HD21 H 1 0.890 0.030 . 1 . . . . 89 LEU HD2 . 11398 1 1008 . 1 1 89 89 LEU HD22 H 1 0.890 0.030 . 1 . . . . 89 LEU HD2 . 11398 1 1009 . 1 1 89 89 LEU HD23 H 1 0.890 0.030 . 1 . . . . 89 LEU HD2 . 11398 1 1010 . 1 1 89 89 LEU HG H 1 1.769 0.030 . 1 . . . . 89 LEU HG . 11398 1 1011 . 1 1 89 89 LEU C C 13 177.772 0.300 . 1 . . . . 89 LEU C . 11398 1 1012 . 1 1 89 89 LEU CA C 13 55.688 0.300 . 1 . . . . 89 LEU CA . 11398 1 1013 . 1 1 89 89 LEU CB C 13 41.592 0.300 . 1 . . . . 89 LEU CB . 11398 1 1014 . 1 1 89 89 LEU CD1 C 13 25.421 0.300 . 2 . . . . 89 LEU CD1 . 11398 1 1015 . 1 1 89 89 LEU CD2 C 13 22.680 0.300 . 2 . . . . 89 LEU CD2 . 11398 1 1016 . 1 1 89 89 LEU CG C 13 26.896 0.300 . 1 . . . . 89 LEU CG . 11398 1 1017 . 1 1 89 89 LEU N N 15 122.542 0.300 . 1 . . . . 89 LEU N . 11398 1 1018 . 1 1 90 90 GLY H H 1 9.042 0.030 . 1 . . . . 90 GLY H . 11398 1 1019 . 1 1 90 90 GLY HA2 H 1 4.131 0.030 . 2 . . . . 90 GLY HA2 . 11398 1 1020 . 1 1 90 90 GLY HA3 H 1 3.727 0.030 . 2 . . . . 90 GLY HA3 . 11398 1 1021 . 1 1 90 90 GLY C C 13 174.106 0.300 . 1 . . . . 90 GLY C . 11398 1 1022 . 1 1 90 90 GLY CA C 13 45.606 0.300 . 1 . . . . 90 GLY CA . 11398 1 1023 . 1 1 90 90 GLY N N 15 110.805 0.300 . 1 . . . . 90 GLY N . 11398 1 1024 . 1 1 91 91 LYS H H 1 7.086 0.030 . 1 . . . . 91 LYS H . 11398 1 1025 . 1 1 91 91 LYS HA H 1 4.660 0.030 . 1 . . . . 91 LYS HA . 11398 1 1026 . 1 1 91 91 LYS HB2 H 1 1.916 0.030 . 2 . . . . 91 LYS HB2 . 11398 1 1027 . 1 1 91 91 LYS HB3 H 1 1.760 0.030 . 2 . . . . 91 LYS HB3 . 11398 1 1028 . 1 1 91 91 LYS HD2 H 1 1.465 0.030 . 1 . . . . 91 LYS HD2 . 11398 1 1029 . 1 1 91 91 LYS HD3 H 1 1.465 0.030 . 1 . . . . 91 LYS HD3 . 11398 1 1030 . 1 1 91 91 LYS HE2 H 1 3.131 0.030 . 2 . . . . 91 LYS HE2 . 11398 1 1031 . 1 1 91 91 LYS HE3 H 1 3.058 0.030 . 2 . . . . 91 LYS HE3 . 11398 1 1032 . 1 1 91 91 LYS HG2 H 1 1.333 0.030 . 1 . . . . 91 LYS HG2 . 11398 1 1033 . 1 1 91 91 LYS HG3 H 1 1.333 0.030 . 1 . . . . 91 LYS HG3 . 11398 1 1034 . 1 1 91 91 LYS C C 13 176.975 0.300 . 1 . . . . 91 LYS C . 11398 1 1035 . 1 1 91 91 LYS CA C 13 54.752 0.300 . 1 . . . . 91 LYS CA . 11398 1 1036 . 1 1 91 91 LYS CB C 13 35.600 0.300 . 1 . . . . 91 LYS CB . 11398 1 1037 . 1 1 91 91 LYS CD C 13 29.910 0.300 . 1 . . . . 91 LYS CD . 11398 1 1038 . 1 1 91 91 LYS CE C 13 42.482 0.300 . 1 . . . . 91 LYS CE . 11398 1 1039 . 1 1 91 91 LYS CG C 13 25.494 0.300 . 1 . . . . 91 LYS CG . 11398 1 1040 . 1 1 91 91 LYS N N 15 117.633 0.300 . 1 . . . . 91 LYS N . 11398 1 1041 . 1 1 92 92 SER H H 1 9.058 0.030 . 1 . . . . 92 SER H . 11398 1 1042 . 1 1 92 92 SER HA H 1 4.509 0.030 . 1 . . . . 92 SER HA . 11398 1 1043 . 1 1 92 92 SER HB2 H 1 4.149 0.030 . 2 . . . . 92 SER HB2 . 11398 1 1044 . 1 1 92 92 SER HB3 H 1 4.450 0.030 . 2 . . . . 92 SER HB3 . 11398 1 1045 . 1 1 92 92 SER C C 13 174.382 0.300 . 1 . . . . 92 SER C . 11398 1 1046 . 1 1 92 92 SER CA C 13 57.956 0.300 . 1 . . . . 92 SER CA . 11398 1 1047 . 1 1 92 92 SER CB C 13 64.520 0.300 . 1 . . . . 92 SER CB . 11398 1 1048 . 1 1 92 92 SER N N 15 119.034 0.300 . 1 . . . . 92 SER N . 11398 1 1049 . 1 1 93 93 ASN H H 1 10.450 0.030 . 1 . . . . 93 ASN H . 11398 1 1050 . 1 1 93 93 ASN HA H 1 4.416 0.030 . 1 . . . . 93 ASN HA . 11398 1 1051 . 1 1 93 93 ASN HB2 H 1 2.954 0.030 . 2 . . . . 93 ASN HB2 . 11398 1 1052 . 1 1 93 93 ASN HB3 H 1 2.727 0.030 . 2 . . . . 93 ASN HB3 . 11398 1 1053 . 1 1 93 93 ASN HD21 H 1 7.780 0.030 . 2 . . . . 93 ASN HD21 . 11398 1 1054 . 1 1 93 93 ASN HD22 H 1 7.070 0.030 . 2 . . . . 93 ASN HD22 . 11398 1 1055 . 1 1 93 93 ASN C C 13 177.924 0.300 . 1 . . . . 93 ASN C . 11398 1 1056 . 1 1 93 93 ASN CA C 13 56.030 0.300 . 1 . . . . 93 ASN CA . 11398 1 1057 . 1 1 93 93 ASN CB C 13 36.340 0.300 . 1 . . . . 93 ASN CB . 11398 1 1058 . 1 1 93 93 ASN N N 15 122.359 0.300 . 1 . . . . 93 ASN N . 11398 1 1059 . 1 1 93 93 ASN ND2 N 15 109.222 0.300 . 1 . . . . 93 ASN ND2 . 11398 1 1060 . 1 1 94 94 HIS H H 1 8.846 0.030 . 1 . . . . 94 HIS H . 11398 1 1061 . 1 1 94 94 HIS HA H 1 4.330 0.030 . 1 . . . . 94 HIS HA . 11398 1 1062 . 1 1 94 94 HIS HB2 H 1 3.292 0.030 . 2 . . . . 94 HIS HB2 . 11398 1 1063 . 1 1 94 94 HIS HB3 H 1 3.124 0.030 . 2 . . . . 94 HIS HB3 . 11398 1 1064 . 1 1 94 94 HIS HD2 H 1 7.181 0.030 . 1 . . . . 94 HIS HD2 . 11398 1 1065 . 1 1 94 94 HIS HE1 H 1 8.223 0.030 . 1 . . . . 94 HIS HE1 . 11398 1 1066 . 1 1 94 94 HIS C C 13 177.509 0.300 . 1 . . . . 94 HIS C . 11398 1 1067 . 1 1 94 94 HIS CA C 13 60.038 0.300 . 1 . . . . 94 HIS CA . 11398 1 1068 . 1 1 94 94 HIS CB C 13 29.576 0.300 . 1 . . . . 94 HIS CB . 11398 1 1069 . 1 1 94 94 HIS CD2 C 13 119.731 0.300 . 1 . . . . 94 HIS CD2 . 11398 1 1070 . 1 1 94 94 HIS CE1 C 13 137.876 0.300 . 1 . . . . 94 HIS CE1 . 11398 1 1071 . 1 1 94 94 HIS N N 15 117.806 0.300 . 1 . . . . 94 HIS N . 11398 1 1072 . 1 1 95 95 GLU H H 1 7.995 0.030 . 1 . . . . 95 GLU H . 11398 1 1073 . 1 1 95 95 GLU HA H 1 3.990 0.030 . 1 . . . . 95 GLU HA . 11398 1 1074 . 1 1 95 95 GLU HB2 H 1 2.249 0.030 . 2 . . . . 95 GLU HB2 . 11398 1 1075 . 1 1 95 95 GLU HB3 H 1 2.027 0.030 . 2 . . . . 95 GLU HB3 . 11398 1 1076 . 1 1 95 95 GLU HG2 H 1 2.291 0.030 . 2 . . . . 95 GLU HG2 . 11398 1 1077 . 1 1 95 95 GLU HG3 H 1 2.381 0.030 . 2 . . . . 95 GLU HG3 . 11398 1 1078 . 1 1 95 95 GLU C C 13 179.869 0.300 . 1 . . . . 95 GLU C . 11398 1 1079 . 1 1 95 95 GLU CA C 13 59.003 0.300 . 1 . . . . 95 GLU CA . 11398 1 1080 . 1 1 95 95 GLU CB C 13 29.961 0.300 . 1 . . . . 95 GLU CB . 11398 1 1081 . 1 1 95 95 GLU CG C 13 36.876 0.300 . 1 . . . . 95 GLU CG . 11398 1 1082 . 1 1 95 95 GLU N N 15 120.243 0.300 . 1 . . . . 95 GLU N . 11398 1 1083 . 1 1 96 96 ALA H H 1 9.189 0.030 . 1 . . . . 96 ALA H . 11398 1 1084 . 1 1 96 96 ALA HA H 1 4.124 0.030 . 1 . . . . 96 ALA HA . 11398 1 1085 . 1 1 96 96 ALA HB1 H 1 1.575 0.030 . 1 . . . . 96 ALA HB . 11398 1 1086 . 1 1 96 96 ALA HB2 H 1 1.575 0.030 . 1 . . . . 96 ALA HB . 11398 1 1087 . 1 1 96 96 ALA HB3 H 1 1.575 0.030 . 1 . . . . 96 ALA HB . 11398 1 1088 . 1 1 96 96 ALA C C 13 179.241 0.300 . 1 . . . . 96 ALA C . 11398 1 1089 . 1 1 96 96 ALA CA C 13 55.584 0.300 . 1 . . . . 96 ALA CA . 11398 1 1090 . 1 1 96 96 ALA CB C 13 18.908 0.300 . 1 . . . . 96 ALA CB . 11398 1 1091 . 1 1 96 96 ALA N N 15 124.328 0.300 . 1 . . . . 96 ALA N . 11398 1 1092 . 1 1 97 97 MET H H 1 8.533 0.030 . 1 . . . . 97 MET H . 11398 1 1093 . 1 1 97 97 MET HA H 1 4.110 0.030 . 1 . . . . 97 MET HA . 11398 1 1094 . 1 1 97 97 MET HB2 H 1 2.089 0.030 . 2 . . . . 97 MET HB2 . 11398 1 1095 . 1 1 97 97 MET HB3 H 1 2.289 0.030 . 2 . . . . 97 MET HB3 . 11398 1 1096 . 1 1 97 97 MET HE1 H 1 1.995 0.030 . 1 . . . . 97 MET HE . 11398 1 1097 . 1 1 97 97 MET HE2 H 1 1.995 0.030 . 1 . . . . 97 MET HE . 11398 1 1098 . 1 1 97 97 MET HE3 H 1 1.995 0.030 . 1 . . . . 97 MET HE . 11398 1 1099 . 1 1 97 97 MET HG2 H 1 2.705 0.030 . 2 . . . . 97 MET HG2 . 11398 1 1100 . 1 1 97 97 MET HG3 H 1 2.637 0.030 . 2 . . . . 97 MET HG3 . 11398 1 1101 . 1 1 97 97 MET C C 13 179.028 0.300 . 1 . . . . 97 MET C . 11398 1 1102 . 1 1 97 97 MET CA C 13 58.397 0.300 . 1 . . . . 97 MET CA . 11398 1 1103 . 1 1 97 97 MET CB C 13 31.560 0.300 . 1 . . . . 97 MET CB . 11398 1 1104 . 1 1 97 97 MET CE C 13 16.927 0.300 . 1 . . . . 97 MET CE . 11398 1 1105 . 1 1 97 97 MET CG C 13 33.189 0.300 . 1 . . . . 97 MET CG . 11398 1 1106 . 1 1 97 97 MET N N 15 116.736 0.300 . 1 . . . . 97 MET N . 11398 1 1107 . 1 1 98 98 GLU H H 1 7.947 0.030 . 1 . . . . 98 GLU H . 11398 1 1108 . 1 1 98 98 GLU HA H 1 4.115 0.030 . 1 . . . . 98 GLU HA . 11398 1 1109 . 1 1 98 98 GLU HB2 H 1 2.074 0.030 . 1 . . . . 98 GLU HB2 . 11398 1 1110 . 1 1 98 98 GLU HB3 H 1 2.074 0.030 . 1 . . . . 98 GLU HB3 . 11398 1 1111 . 1 1 98 98 GLU HG2 H 1 2.162 0.030 . 1 . . . . 98 GLU HG2 . 11398 1 1112 . 1 1 98 98 GLU HG3 H 1 2.162 0.030 . 1 . . . . 98 GLU HG3 . 11398 1 1113 . 1 1 98 98 GLU C C 13 178.919 0.300 . 1 . . . . 98 GLU C . 11398 1 1114 . 1 1 98 98 GLU CA C 13 59.147 0.300 . 1 . . . . 98 GLU CA . 11398 1 1115 . 1 1 98 98 GLU CB C 13 29.314 0.300 . 1 . . . . 98 GLU CB . 11398 1 1116 . 1 1 98 98 GLU CG C 13 36.053 0.300 . 1 . . . . 98 GLU CG . 11398 1 1117 . 1 1 98 98 GLU N N 15 120.112 0.300 . 1 . . . . 98 GLU N . 11398 1 1118 . 1 1 99 99 THR H H 1 8.207 0.030 . 1 . . . . 99 THR H . 11398 1 1119 . 1 1 99 99 THR HA H 1 3.876 0.030 . 1 . . . . 99 THR HA . 11398 1 1120 . 1 1 99 99 THR HB H 1 4.238 0.030 . 1 . . . . 99 THR HB . 11398 1 1121 . 1 1 99 99 THR HG21 H 1 1.069 0.030 . 1 . . . . 99 THR HG2 . 11398 1 1122 . 1 1 99 99 THR HG22 H 1 1.069 0.030 . 1 . . . . 99 THR HG2 . 11398 1 1123 . 1 1 99 99 THR HG23 H 1 1.069 0.030 . 1 . . . . 99 THR HG2 . 11398 1 1124 . 1 1 99 99 THR C C 13 177.055 0.300 . 1 . . . . 99 THR C . 11398 1 1125 . 1 1 99 99 THR CA C 13 67.346 0.300 . 1 . . . . 99 THR CA . 11398 1 1126 . 1 1 99 99 THR CB C 13 68.639 0.300 . 1 . . . . 99 THR CB . 11398 1 1127 . 1 1 99 99 THR CG2 C 13 21.396 0.300 . 1 . . . . 99 THR CG2 . 11398 1 1128 . 1 1 99 99 THR N N 15 118.348 0.300 . 1 . . . . 99 THR N . 11398 1 1129 . 1 1 100 100 LEU H H 1 8.168 0.030 . 1 . . . . 100 LEU H . 11398 1 1130 . 1 1 100 100 LEU HA H 1 3.918 0.030 . 1 . . . . 100 LEU HA . 11398 1 1131 . 1 1 100 100 LEU HB2 H 1 1.625 0.030 . 2 . . . . 100 LEU HB2 . 11398 1 1132 . 1 1 100 100 LEU HB3 H 1 1.760 0.030 . 2 . . . . 100 LEU HB3 . 11398 1 1133 . 1 1 100 100 LEU HD11 H 1 0.756 0.030 . 1 . . . . 100 LEU HD1 . 11398 1 1134 . 1 1 100 100 LEU HD12 H 1 0.756 0.030 . 1 . . . . 100 LEU HD1 . 11398 1 1135 . 1 1 100 100 LEU HD13 H 1 0.756 0.030 . 1 . . . . 100 LEU HD1 . 11398 1 1136 . 1 1 100 100 LEU HD21 H 1 0.812 0.030 . 1 . . . . 100 LEU HD2 . 11398 1 1137 . 1 1 100 100 LEU HD22 H 1 0.812 0.030 . 1 . . . . 100 LEU HD2 . 11398 1 1138 . 1 1 100 100 LEU HD23 H 1 0.812 0.030 . 1 . . . . 100 LEU HD2 . 11398 1 1139 . 1 1 100 100 LEU HG H 1 1.679 0.030 . 1 . . . . 100 LEU HG . 11398 1 1140 . 1 1 100 100 LEU C C 13 177.990 0.300 . 1 . . . . 100 LEU C . 11398 1 1141 . 1 1 100 100 LEU CA C 13 58.721 0.300 . 1 . . . . 100 LEU CA . 11398 1 1142 . 1 1 100 100 LEU CB C 13 41.699 0.300 . 1 . . . . 100 LEU CB . 11398 1 1143 . 1 1 100 100 LEU CD1 C 13 25.112 0.300 . 2 . . . . 100 LEU CD1 . 11398 1 1144 . 1 1 100 100 LEU CD2 C 13 25.752 0.300 . 2 . . . . 100 LEU CD2 . 11398 1 1145 . 1 1 100 100 LEU CG C 13 27.602 0.300 . 1 . . . . 100 LEU CG . 11398 1 1146 . 1 1 100 100 LEU N N 15 123.149 0.300 . 1 . . . . 100 LEU N . 11398 1 1147 . 1 1 101 101 ARG H H 1 8.500 0.030 . 1 . . . . 101 ARG H . 11398 1 1148 . 1 1 101 101 ARG HA H 1 3.912 0.030 . 1 . . . . 101 ARG HA . 11398 1 1149 . 1 1 101 101 ARG HB2 H 1 1.957 0.030 . 1 . . . . 101 ARG HB2 . 11398 1 1150 . 1 1 101 101 ARG HB3 H 1 1.957 0.030 . 1 . . . . 101 ARG HB3 . 11398 1 1151 . 1 1 101 101 ARG HD2 H 1 3.260 0.030 . 1 . . . . 101 ARG HD2 . 11398 1 1152 . 1 1 101 101 ARG HD3 H 1 3.260 0.030 . 1 . . . . 101 ARG HD3 . 11398 1 1153 . 1 1 101 101 ARG HE H 1 7.657 0.030 . 1 . . . . 101 ARG HE . 11398 1 1154 . 1 1 101 101 ARG HG2 H 1 1.786 0.030 . 2 . . . . 101 ARG HG2 . 11398 1 1155 . 1 1 101 101 ARG HG3 H 1 1.604 0.030 . 2 . . . . 101 ARG HG3 . 11398 1 1156 . 1 1 101 101 ARG C C 13 179.719 0.300 . 1 . . . . 101 ARG C . 11398 1 1157 . 1 1 101 101 ARG CA C 13 60.184 0.300 . 1 . . . . 101 ARG CA . 11398 1 1158 . 1 1 101 101 ARG CB C 13 30.094 0.300 . 1 . . . . 101 ARG CB . 11398 1 1159 . 1 1 101 101 ARG CD C 13 43.257 0.300 . 1 . . . . 101 ARG CD . 11398 1 1160 . 1 1 101 101 ARG CG C 13 27.572 0.300 . 1 . . . . 101 ARG CG . 11398 1 1161 . 1 1 101 101 ARG N N 15 119.450 0.300 . 1 . . . . 101 ARG N . 11398 1 1162 . 1 1 101 101 ARG NE N 15 116.746 0.300 . 1 . . . . 101 ARG NE . 11398 1 1163 . 1 1 102 102 ARG H H 1 8.134 0.030 . 1 . . . . 102 ARG H . 11398 1 1164 . 1 1 102 102 ARG HA H 1 4.099 0.030 . 1 . . . . 102 ARG HA . 11398 1 1165 . 1 1 102 102 ARG HB2 H 1 1.932 0.030 . 2 . . . . 102 ARG HB2 . 11398 1 1166 . 1 1 102 102 ARG HB3 H 1 1.984 0.030 . 2 . . . . 102 ARG HB3 . 11398 1 1167 . 1 1 102 102 ARG HD2 H 1 3.278 0.030 . 1 . . . . 102 ARG HD2 . 11398 1 1168 . 1 1 102 102 ARG HD3 H 1 3.278 0.030 . 1 . . . . 102 ARG HD3 . 11398 1 1169 . 1 1 102 102 ARG HE H 1 7.462 0.030 . 1 . . . . 102 ARG HE . 11398 1 1170 . 1 1 102 102 ARG HG2 H 1 1.678 0.030 . 2 . . . . 102 ARG HG2 . 11398 1 1171 . 1 1 102 102 ARG HG3 H 1 1.839 0.030 . 2 . . . . 102 ARG HG3 . 11398 1 1172 . 1 1 102 102 ARG C C 13 179.065 0.300 . 1 . . . . 102 ARG C . 11398 1 1173 . 1 1 102 102 ARG CA C 13 59.421 0.300 . 1 . . . . 102 ARG CA . 11398 1 1174 . 1 1 102 102 ARG CB C 13 30.186 0.300 . 1 . . . . 102 ARG CB . 11398 1 1175 . 1 1 102 102 ARG CD C 13 43.394 0.300 . 1 . . . . 102 ARG CD . 11398 1 1176 . 1 1 102 102 ARG CG C 13 27.764 0.300 . 1 . . . . 102 ARG CG . 11398 1 1177 . 1 1 102 102 ARG N N 15 118.458 0.300 . 1 . . . . 102 ARG N . 11398 1 1178 . 1 1 102 102 ARG NE N 15 117.272 0.300 . 1 . . . . 102 ARG NE . 11398 1 1179 . 1 1 103 103 SER H H 1 7.992 0.030 . 1 . . . . 103 SER H . 11398 1 1180 . 1 1 103 103 SER HA H 1 4.369 0.030 . 1 . . . . 103 SER HA . 11398 1 1181 . 1 1 103 103 SER HB2 H 1 3.971 0.030 . 2 . . . . 103 SER HB2 . 11398 1 1182 . 1 1 103 103 SER HB3 H 1 3.851 0.030 . 2 . . . . 103 SER HB3 . 11398 1 1183 . 1 1 103 103 SER C C 13 175.279 0.300 . 1 . . . . 103 SER C . 11398 1 1184 . 1 1 103 103 SER CA C 13 61.767 0.300 . 1 . . . . 103 SER CA . 11398 1 1185 . 1 1 103 103 SER CB C 13 63.867 0.300 . 1 . . . . 103 SER CB . 11398 1 1186 . 1 1 103 103 SER N N 15 114.696 0.300 . 1 . . . . 103 SER N . 11398 1 1187 . 1 1 104 104 MET H H 1 7.845 0.030 . 1 . . . . 104 MET H . 11398 1 1188 . 1 1 104 104 MET HA H 1 4.309 0.030 . 1 . . . . 104 MET HA . 11398 1 1189 . 1 1 104 104 MET HB2 H 1 2.148 0.030 . 1 . . . . 104 MET HB2 . 11398 1 1190 . 1 1 104 104 MET HB3 H 1 2.148 0.030 . 1 . . . . 104 MET HB3 . 11398 1 1191 . 1 1 104 104 MET HE1 H 1 2.021 0.030 . 1 . . . . 104 MET HE . 11398 1 1192 . 1 1 104 104 MET HE2 H 1 2.021 0.030 . 1 . . . . 104 MET HE . 11398 1 1193 . 1 1 104 104 MET HE3 H 1 2.021 0.030 . 1 . . . . 104 MET HE . 11398 1 1194 . 1 1 104 104 MET HG2 H 1 2.755 0.030 . 2 . . . . 104 MET HG2 . 11398 1 1195 . 1 1 104 104 MET HG3 H 1 2.433 0.030 . 2 . . . . 104 MET HG3 . 11398 1 1196 . 1 1 104 104 MET C C 13 175.708 0.300 . 1 . . . . 104 MET C . 11398 1 1197 . 1 1 104 104 MET CA C 13 56.742 0.300 . 1 . . . . 104 MET CA . 11398 1 1198 . 1 1 104 104 MET CB C 13 33.273 0.300 . 1 . . . . 104 MET CB . 11398 1 1199 . 1 1 104 104 MET CE C 13 16.935 0.300 . 1 . . . . 104 MET CE . 11398 1 1200 . 1 1 104 104 MET CG C 13 32.401 0.300 . 1 . . . . 104 MET CG . 11398 1 1201 . 1 1 104 104 MET N N 15 116.999 0.300 . 1 . . . . 104 MET N . 11398 1 1202 . 1 1 105 105 SER H H 1 7.528 0.030 . 1 . . . . 105 SER H . 11398 1 1203 . 1 1 105 105 SER HA H 1 4.536 0.030 . 1 . . . . 105 SER HA . 11398 1 1204 . 1 1 105 105 SER HB2 H 1 4.017 0.030 . 2 . . . . 105 SER HB2 . 11398 1 1205 . 1 1 105 105 SER HB3 H 1 4.074 0.030 . 2 . . . . 105 SER HB3 . 11398 1 1206 . 1 1 105 105 SER C C 13 174.649 0.300 . 1 . . . . 105 SER C . 11398 1 1207 . 1 1 105 105 SER CA C 13 58.777 0.300 . 1 . . . . 105 SER CA . 11398 1 1208 . 1 1 105 105 SER CB C 13 64.341 0.300 . 1 . . . . 105 SER CB . 11398 1 1209 . 1 1 105 105 SER N N 15 113.833 0.300 . 1 . . . . 105 SER N . 11398 1 1210 . 1 1 106 106 MET H H 1 8.324 0.030 . 1 . . . . 106 MET H . 11398 1 1211 . 1 1 106 106 MET HA H 1 4.506 0.030 . 1 . . . . 106 MET HA . 11398 1 1212 . 1 1 106 106 MET HB2 H 1 2.207 0.030 . 2 . . . . 106 MET HB2 . 11398 1 1213 . 1 1 106 106 MET HB3 H 1 2.145 0.030 . 2 . . . . 106 MET HB3 . 11398 1 1214 . 1 1 106 106 MET HE1 H 1 2.129 0.030 . 1 . . . . 106 MET HE . 11398 1 1215 . 1 1 106 106 MET HE2 H 1 2.129 0.030 . 1 . . . . 106 MET HE . 11398 1 1216 . 1 1 106 106 MET HE3 H 1 2.129 0.030 . 1 . . . . 106 MET HE . 11398 1 1217 . 1 1 106 106 MET HG2 H 1 2.597 0.030 . 2 . . . . 106 MET HG2 . 11398 1 1218 . 1 1 106 106 MET HG3 H 1 2.699 0.030 . 2 . . . . 106 MET HG3 . 11398 1 1219 . 1 1 106 106 MET C C 13 176.716 0.300 . 1 . . . . 106 MET C . 11398 1 1220 . 1 1 106 106 MET CA C 13 56.401 0.300 . 1 . . . . 106 MET CA . 11398 1 1221 . 1 1 106 106 MET CB C 13 32.695 0.300 . 1 . . . . 106 MET CB . 11398 1 1222 . 1 1 106 106 MET CE C 13 17.108 0.300 . 1 . . . . 106 MET CE . 11398 1 1223 . 1 1 106 106 MET CG C 13 32.199 0.300 . 1 . . . . 106 MET CG . 11398 1 1224 . 1 1 106 106 MET N N 15 121.381 0.300 . 1 . . . . 106 MET N . 11398 1 1225 . 1 1 107 107 GLU H H 1 8.469 0.030 . 1 . . . . 107 GLU H . 11398 1 1226 . 1 1 107 107 GLU HA H 1 4.246 0.030 . 1 . . . . 107 GLU HA . 11398 1 1227 . 1 1 107 107 GLU HB2 H 1 2.028 0.030 . 2 . . . . 107 GLU HB2 . 11398 1 1228 . 1 1 107 107 GLU HB3 H 1 1.971 0.030 . 2 . . . . 107 GLU HB3 . 11398 1 1229 . 1 1 107 107 GLU HG2 H 1 2.321 0.030 . 1 . . . . 107 GLU HG2 . 11398 1 1230 . 1 1 107 107 GLU HG3 H 1 2.321 0.030 . 1 . . . . 107 GLU HG3 . 11398 1 1231 . 1 1 107 107 GLU C C 13 177.489 0.300 . 1 . . . . 107 GLU C . 11398 1 1232 . 1 1 107 107 GLU CA C 13 57.850 0.300 . 1 . . . . 107 GLU CA . 11398 1 1233 . 1 1 107 107 GLU CB C 13 29.779 0.300 . 1 . . . . 107 GLU CB . 11398 1 1234 . 1 1 107 107 GLU CG C 13 36.396 0.300 . 1 . . . . 107 GLU CG . 11398 1 1235 . 1 1 107 107 GLU N N 15 120.340 0.300 . 1 . . . . 107 GLU N . 11398 1 1236 . 1 1 108 108 GLY H H 1 8.424 0.030 . 1 . . . . 108 GLY H . 11398 1 1237 . 1 1 108 108 GLY HA2 H 1 3.982 0.030 . 1 . . . . 108 GLY HA2 . 11398 1 1238 . 1 1 108 108 GLY HA3 H 1 3.982 0.030 . 1 . . . . 108 GLY HA3 . 11398 1 1239 . 1 1 108 108 GLY C C 13 174.165 0.300 . 1 . . . . 108 GLY C . 11398 1 1240 . 1 1 108 108 GLY CA C 13 45.879 0.300 . 1 . . . . 108 GLY CA . 11398 1 1241 . 1 1 108 108 GLY N N 15 109.723 0.300 . 1 . . . . 108 GLY N . 11398 1 1242 . 1 1 109 109 ASN H H 1 8.035 0.030 . 1 . . . . 109 ASN H . 11398 1 1243 . 1 1 109 109 ASN HA H 1 4.743 0.030 . 1 . . . . 109 ASN HA . 11398 1 1244 . 1 1 109 109 ASN HB2 H 1 2.914 0.030 . 2 . . . . 109 ASN HB2 . 11398 1 1245 . 1 1 109 109 ASN HB3 H 1 2.770 0.030 . 2 . . . . 109 ASN HB3 . 11398 1 1246 . 1 1 109 109 ASN HD21 H 1 6.855 0.030 . 2 . . . . 109 ASN HD21 . 11398 1 1247 . 1 1 109 109 ASN HD22 H 1 7.598 0.030 . 2 . . . . 109 ASN HD22 . 11398 1 1248 . 1 1 109 109 ASN C C 13 175.583 0.300 . 1 . . . . 109 ASN C . 11398 1 1249 . 1 1 109 109 ASN CA C 13 53.581 0.300 . 1 . . . . 109 ASN CA . 11398 1 1250 . 1 1 109 109 ASN CB C 13 38.786 0.300 . 1 . . . . 109 ASN CB . 11398 1 1251 . 1 1 109 109 ASN N N 15 118.594 0.300 . 1 . . . . 109 ASN N . 11398 1 1252 . 1 1 109 109 ASN ND2 N 15 111.914 0.300 . 1 . . . . 109 ASN ND2 . 11398 1 1253 . 1 1 110 110 ILE H H 1 8.096 0.030 . 1 . . . . 110 ILE H . 11398 1 1254 . 1 1 110 110 ILE HA H 1 4.165 0.030 . 1 . . . . 110 ILE HA . 11398 1 1255 . 1 1 110 110 ILE HB H 1 1.955 0.030 . 1 . . . . 110 ILE HB . 11398 1 1256 . 1 1 110 110 ILE HD11 H 1 0.889 0.030 . 1 . . . . 110 ILE HD1 . 11398 1 1257 . 1 1 110 110 ILE HD12 H 1 0.889 0.030 . 1 . . . . 110 ILE HD1 . 11398 1 1258 . 1 1 110 110 ILE HD13 H 1 0.889 0.030 . 1 . . . . 110 ILE HD1 . 11398 1 1259 . 1 1 110 110 ILE HG12 H 1 1.249 0.030 . 2 . . . . 110 ILE HG12 . 11398 1 1260 . 1 1 110 110 ILE HG13 H 1 1.496 0.030 . 2 . . . . 110 ILE HG13 . 11398 1 1261 . 1 1 110 110 ILE HG21 H 1 0.938 0.030 . 1 . . . . 110 ILE HG2 . 11398 1 1262 . 1 1 110 110 ILE HG22 H 1 0.938 0.030 . 1 . . . . 110 ILE HG2 . 11398 1 1263 . 1 1 110 110 ILE HG23 H 1 0.938 0.030 . 1 . . . . 110 ILE HG2 . 11398 1 1264 . 1 1 110 110 ILE C C 13 176.592 0.300 . 1 . . . . 110 ILE C . 11398 1 1265 . 1 1 110 110 ILE CA C 13 62.024 0.300 . 1 . . . . 110 ILE CA . 11398 1 1266 . 1 1 110 110 ILE CB C 13 38.379 0.300 . 1 . . . . 110 ILE CB . 11398 1 1267 . 1 1 110 110 ILE CD1 C 13 13.012 0.300 . 1 . . . . 110 ILE CD1 . 11398 1 1268 . 1 1 110 110 ILE CG1 C 13 27.455 0.300 . 1 . . . . 110 ILE CG1 . 11398 1 1269 . 1 1 110 110 ILE CG2 C 13 17.748 0.300 . 1 . . . . 110 ILE CG2 . 11398 1 1270 . 1 1 110 110 ILE N N 15 120.610 0.300 . 1 . . . . 110 ILE N . 11398 1 1271 . 1 1 111 111 ARG H H 1 8.361 0.030 . 1 . . . . 111 ARG H . 11398 1 1272 . 1 1 111 111 ARG HA H 1 4.364 0.030 . 1 . . . . 111 ARG HA . 11398 1 1273 . 1 1 111 111 ARG HB2 H 1 1.888 0.030 . 2 . . . . 111 ARG HB2 . 11398 1 1274 . 1 1 111 111 ARG HB3 H 1 1.957 0.030 . 2 . . . . 111 ARG HB3 . 11398 1 1275 . 1 1 111 111 ARG HD2 H 1 3.254 0.030 . 1 . . . . 111 ARG HD2 . 11398 1 1276 . 1 1 111 111 ARG HD3 H 1 3.254 0.030 . 1 . . . . 111 ARG HD3 . 11398 1 1277 . 1 1 111 111 ARG HE H 1 7.299 0.030 . 1 . . . . 111 ARG HE . 11398 1 1278 . 1 1 111 111 ARG HG2 H 1 1.675 0.030 . 2 . . . . 111 ARG HG2 . 11398 1 1279 . 1 1 111 111 ARG HG3 H 1 1.738 0.030 . 2 . . . . 111 ARG HG3 . 11398 1 1280 . 1 1 111 111 ARG C C 13 176.968 0.300 . 1 . . . . 111 ARG C . 11398 1 1281 . 1 1 111 111 ARG CA C 13 56.621 0.300 . 1 . . . . 111 ARG CA . 11398 1 1282 . 1 1 111 111 ARG CB C 13 31.071 0.300 . 1 . . . . 111 ARG CB . 11398 1 1283 . 1 1 111 111 ARG CD C 13 43.411 0.300 . 1 . . . . 111 ARG CD . 11398 1 1284 . 1 1 111 111 ARG CG C 13 27.783 0.300 . 1 . . . . 111 ARG CG . 11398 1 1285 . 1 1 111 111 ARG N N 15 121.665 0.300 . 1 . . . . 111 ARG N . 11398 1 1286 . 1 1 111 111 ARG NE N 15 117.701 0.300 . 1 . . . . 111 ARG NE . 11398 1 1287 . 1 1 112 112 GLY H H 1 8.326 0.030 . 1 . . . . 112 GLY H . 11398 1 1288 . 1 1 112 112 GLY HA2 H 1 3.981 0.030 . 1 . . . . 112 GLY HA2 . 11398 1 1289 . 1 1 112 112 GLY HA3 H 1 3.981 0.030 . 1 . . . . 112 GLY HA3 . 11398 1 1290 . 1 1 112 112 GLY C C 13 173.590 0.300 . 1 . . . . 112 GLY C . 11398 1 1291 . 1 1 112 112 GLY CA C 13 46.091 0.300 . 1 . . . . 112 GLY CA . 11398 1 1292 . 1 1 112 112 GLY N N 15 108.094 0.300 . 1 . . . . 112 GLY N . 11398 1 1293 . 1 1 113 113 MET H H 1 7.741 0.030 . 1 . . . . 113 MET H . 11398 1 1294 . 1 1 113 113 MET HA H 1 5.119 0.030 . 1 . . . . 113 MET HA . 11398 1 1295 . 1 1 113 113 MET HB2 H 1 1.939 0.030 . 2 . . . . 113 MET HB2 . 11398 1 1296 . 1 1 113 113 MET HB3 H 1 1.820 0.030 . 2 . . . . 113 MET HB3 . 11398 1 1297 . 1 1 113 113 MET HE1 H 1 1.952 0.030 . 1 . . . . 113 MET HE . 11398 1 1298 . 1 1 113 113 MET HE2 H 1 1.952 0.030 . 1 . . . . 113 MET HE . 11398 1 1299 . 1 1 113 113 MET HE3 H 1 1.952 0.030 . 1 . . . . 113 MET HE . 11398 1 1300 . 1 1 113 113 MET HG2 H 1 2.361 0.030 . 1 . . . . 113 MET HG2 . 11398 1 1301 . 1 1 113 113 MET HG3 H 1 2.361 0.030 . 1 . . . . 113 MET HG3 . 11398 1 1302 . 1 1 113 113 MET C C 13 174.276 0.300 . 1 . . . . 113 MET C . 11398 1 1303 . 1 1 113 113 MET CA C 13 54.040 0.300 . 1 . . . . 113 MET CA . 11398 1 1304 . 1 1 113 113 MET CB C 13 35.737 0.300 . 1 . . . . 113 MET CB . 11398 1 1305 . 1 1 113 113 MET CE C 13 17.505 0.300 . 1 . . . . 113 MET CE . 11398 1 1306 . 1 1 113 113 MET CG C 13 31.354 0.300 . 1 . . . . 113 MET CG . 11398 1 1307 . 1 1 113 113 MET N N 15 117.871 0.300 . 1 . . . . 113 MET N . 11398 1 1308 . 1 1 114 114 ILE H H 1 8.654 0.030 . 1 . . . . 114 ILE H . 11398 1 1309 . 1 1 114 114 ILE HA H 1 4.746 0.030 . 1 . . . . 114 ILE HA . 11398 1 1310 . 1 1 114 114 ILE HB H 1 1.737 0.030 . 1 . . . . 114 ILE HB . 11398 1 1311 . 1 1 114 114 ILE HD11 H 1 0.830 0.030 . 1 . . . . 114 ILE HD1 . 11398 1 1312 . 1 1 114 114 ILE HD12 H 1 0.830 0.030 . 1 . . . . 114 ILE HD1 . 11398 1 1313 . 1 1 114 114 ILE HD13 H 1 0.830 0.030 . 1 . . . . 114 ILE HD1 . 11398 1 1314 . 1 1 114 114 ILE HG12 H 1 0.970 0.030 . 2 . . . . 114 ILE HG12 . 11398 1 1315 . 1 1 114 114 ILE HG13 H 1 1.648 0.030 . 2 . . . . 114 ILE HG13 . 11398 1 1316 . 1 1 114 114 ILE HG21 H 1 0.959 0.030 . 1 . . . . 114 ILE HG2 . 11398 1 1317 . 1 1 114 114 ILE HG22 H 1 0.959 0.030 . 1 . . . . 114 ILE HG2 . 11398 1 1318 . 1 1 114 114 ILE HG23 H 1 0.959 0.030 . 1 . . . . 114 ILE HG2 . 11398 1 1319 . 1 1 114 114 ILE C C 13 172.166 0.300 . 1 . . . . 114 ILE C . 11398 1 1320 . 1 1 114 114 ILE CA C 13 59.574 0.300 . 1 . . . . 114 ILE CA . 11398 1 1321 . 1 1 114 114 ILE CB C 13 41.980 0.300 . 1 . . . . 114 ILE CB . 11398 1 1322 . 1 1 114 114 ILE CD1 C 13 14.893 0.300 . 1 . . . . 114 ILE CD1 . 11398 1 1323 . 1 1 114 114 ILE CG1 C 13 28.820 0.300 . 1 . . . . 114 ILE CG1 . 11398 1 1324 . 1 1 114 114 ILE CG2 C 13 16.705 0.300 . 1 . . . . 114 ILE CG2 . 11398 1 1325 . 1 1 114 114 ILE N N 15 121.318 0.300 . 1 . . . . 114 ILE N . 11398 1 1326 . 1 1 115 115 GLN H H 1 8.548 0.030 . 1 . . . . 115 GLN H . 11398 1 1327 . 1 1 115 115 GLN HA H 1 5.277 0.030 . 1 . . . . 115 GLN HA . 11398 1 1328 . 1 1 115 115 GLN HB2 H 1 1.989 0.030 . 2 . . . . 115 GLN HB2 . 11398 1 1329 . 1 1 115 115 GLN HB3 H 1 2.171 0.030 . 2 . . . . 115 GLN HB3 . 11398 1 1330 . 1 1 115 115 GLN HE21 H 1 6.794 0.030 . 2 . . . . 115 GLN HE21 . 11398 1 1331 . 1 1 115 115 GLN HE22 H 1 7.892 0.030 . 2 . . . . 115 GLN HE22 . 11398 1 1332 . 1 1 115 115 GLN HG2 H 1 2.253 0.030 . 2 . . . . 115 GLN HG2 . 11398 1 1333 . 1 1 115 115 GLN HG3 H 1 1.831 0.030 . 2 . . . . 115 GLN HG3 . 11398 1 1334 . 1 1 115 115 GLN C C 13 174.756 0.300 . 1 . . . . 115 GLN C . 11398 1 1335 . 1 1 115 115 GLN CA C 13 54.130 0.300 . 1 . . . . 115 GLN CA . 11398 1 1336 . 1 1 115 115 GLN CB C 13 31.487 0.300 . 1 . . . . 115 GLN CB . 11398 1 1337 . 1 1 115 115 GLN CG C 13 35.070 0.300 . 1 . . . . 115 GLN CG . 11398 1 1338 . 1 1 115 115 GLN N N 15 127.100 0.300 . 1 . . . . 115 GLN N . 11398 1 1339 . 1 1 115 115 GLN NE2 N 15 112.862 0.300 . 1 . . . . 115 GLN NE2 . 11398 1 1340 . 1 1 116 116 LEU H H 1 9.277 0.030 . 1 . . . . 116 LEU H . 11398 1 1341 . 1 1 116 116 LEU HA H 1 5.242 0.030 . 1 . . . . 116 LEU HA . 11398 1 1342 . 1 1 116 116 LEU HB2 H 1 1.599 0.030 . 2 . . . . 116 LEU HB2 . 11398 1 1343 . 1 1 116 116 LEU HB3 H 1 1.342 0.030 . 2 . . . . 116 LEU HB3 . 11398 1 1344 . 1 1 116 116 LEU HD11 H 1 0.825 0.030 . 1 . . . . 116 LEU HD1 . 11398 1 1345 . 1 1 116 116 LEU HD12 H 1 0.825 0.030 . 1 . . . . 116 LEU HD1 . 11398 1 1346 . 1 1 116 116 LEU HD13 H 1 0.825 0.030 . 1 . . . . 116 LEU HD1 . 11398 1 1347 . 1 1 116 116 LEU HD21 H 1 0.871 0.030 . 1 . . . . 116 LEU HD2 . 11398 1 1348 . 1 1 116 116 LEU HD22 H 1 0.871 0.030 . 1 . . . . 116 LEU HD2 . 11398 1 1349 . 1 1 116 116 LEU HD23 H 1 0.871 0.030 . 1 . . . . 116 LEU HD2 . 11398 1 1350 . 1 1 116 116 LEU HG H 1 0.830 0.030 . 1 . . . . 116 LEU HG . 11398 1 1351 . 1 1 116 116 LEU CA C 13 53.110 0.300 . 1 . . . . 116 LEU CA . 11398 1 1352 . 1 1 116 116 LEU CB C 13 46.490 0.300 . 1 . . . . 116 LEU CB . 11398 1 1353 . 1 1 116 116 LEU CD1 C 13 26.313 0.300 . 2 . . . . 116 LEU CD1 . 11398 1 1354 . 1 1 116 116 LEU CD2 C 13 23.897 0.300 . 2 . . . . 116 LEU CD2 . 11398 1 1355 . 1 1 116 116 LEU CG C 13 26.242 0.300 . 1 . . . . 116 LEU CG . 11398 1 1356 . 1 1 116 116 LEU N N 15 127.364 0.300 . 1 . . . . 116 LEU N . 11398 1 1357 . 1 1 117 117 VAL H H 1 8.199 0.030 . 1 . . . . 117 VAL H . 11398 1 1358 . 1 1 117 117 VAL HA H 1 5.021 0.030 . 1 . . . . 117 VAL HA . 11398 1 1359 . 1 1 117 117 VAL HB H 1 1.779 0.030 . 1 . . . . 117 VAL HB . 11398 1 1360 . 1 1 117 117 VAL HG11 H 1 0.936 0.030 . 1 . . . . 117 VAL HG1 . 11398 1 1361 . 1 1 117 117 VAL HG12 H 1 0.936 0.030 . 1 . . . . 117 VAL HG1 . 11398 1 1362 . 1 1 117 117 VAL HG13 H 1 0.936 0.030 . 1 . . . . 117 VAL HG1 . 11398 1 1363 . 1 1 117 117 VAL HG21 H 1 0.818 0.030 . 1 . . . . 117 VAL HG2 . 11398 1 1364 . 1 1 117 117 VAL HG22 H 1 0.818 0.030 . 1 . . . . 117 VAL HG2 . 11398 1 1365 . 1 1 117 117 VAL HG23 H 1 0.818 0.030 . 1 . . . . 117 VAL HG2 . 11398 1 1366 . 1 1 117 117 VAL C C 13 175.921 0.300 . 1 . . . . 117 VAL C . 11398 1 1367 . 1 1 117 117 VAL CA C 13 61.655 0.300 . 1 . . . . 117 VAL CA . 11398 1 1368 . 1 1 117 117 VAL CB C 13 32.649 0.300 . 1 . . . . 117 VAL CB . 11398 1 1369 . 1 1 117 117 VAL CG1 C 13 21.013 0.300 . 2 . . . . 117 VAL CG1 . 11398 1 1370 . 1 1 117 117 VAL CG2 C 13 21.382 0.300 . 2 . . . . 117 VAL CG2 . 11398 1 1371 . 1 1 117 117 VAL N N 15 122.151 0.300 . 1 . . . . 117 VAL N . 11398 1 1372 . 1 1 118 118 ILE H H 1 9.267 0.030 . 1 . . . . 118 ILE H . 11398 1 1373 . 1 1 118 118 ILE HA H 1 5.589 0.030 . 1 . . . . 118 ILE HA . 11398 1 1374 . 1 1 118 118 ILE HB H 1 1.800 0.030 . 1 . . . . 118 ILE HB . 11398 1 1375 . 1 1 118 118 ILE HD11 H 1 0.780 0.030 . 1 . . . . 118 ILE HD1 . 11398 1 1376 . 1 1 118 118 ILE HD12 H 1 0.780 0.030 . 1 . . . . 118 ILE HD1 . 11398 1 1377 . 1 1 118 118 ILE HD13 H 1 0.780 0.030 . 1 . . . . 118 ILE HD1 . 11398 1 1378 . 1 1 118 118 ILE HG12 H 1 1.067 0.030 . 2 . . . . 118 ILE HG12 . 11398 1 1379 . 1 1 118 118 ILE HG13 H 1 1.380 0.030 . 2 . . . . 118 ILE HG13 . 11398 1 1380 . 1 1 118 118 ILE HG21 H 1 0.788 0.030 . 1 . . . . 118 ILE HG2 . 11398 1 1381 . 1 1 118 118 ILE HG22 H 1 0.788 0.030 . 1 . . . . 118 ILE HG2 . 11398 1 1382 . 1 1 118 118 ILE HG23 H 1 0.788 0.030 . 1 . . . . 118 ILE HG2 . 11398 1 1383 . 1 1 118 118 ILE C C 13 174.475 0.300 . 1 . . . . 118 ILE C . 11398 1 1384 . 1 1 118 118 ILE CA C 13 57.415 0.300 . 1 . . . . 118 ILE CA . 11398 1 1385 . 1 1 118 118 ILE CB C 13 42.750 0.300 . 1 . . . . 118 ILE CB . 11398 1 1386 . 1 1 118 118 ILE CD1 C 13 15.593 0.300 . 1 . . . . 118 ILE CD1 . 11398 1 1387 . 1 1 118 118 ILE CG1 C 13 27.325 0.300 . 1 . . . . 118 ILE CG1 . 11398 1 1388 . 1 1 118 118 ILE CG2 C 13 19.621 0.300 . 1 . . . . 118 ILE CG2 . 11398 1 1389 . 1 1 118 118 ILE N N 15 122.700 0.300 . 1 . . . . 118 ILE N . 11398 1 1390 . 1 1 119 119 LEU H H 1 9.005 0.030 . 1 . . . . 119 LEU H . 11398 1 1391 . 1 1 119 119 LEU HA H 1 5.239 0.030 . 1 . . . . 119 LEU HA . 11398 1 1392 . 1 1 119 119 LEU HB2 H 1 1.588 0.030 . 2 . . . . 119 LEU HB2 . 11398 1 1393 . 1 1 119 119 LEU HB3 H 1 1.419 0.030 . 2 . . . . 119 LEU HB3 . 11398 1 1394 . 1 1 119 119 LEU HD11 H 1 0.861 0.030 . 1 . . . . 119 LEU HD1 . 11398 1 1395 . 1 1 119 119 LEU HD12 H 1 0.861 0.030 . 1 . . . . 119 LEU HD1 . 11398 1 1396 . 1 1 119 119 LEU HD13 H 1 0.861 0.030 . 1 . . . . 119 LEU HD1 . 11398 1 1397 . 1 1 119 119 LEU HD21 H 1 0.873 0.030 . 1 . . . . 119 LEU HD2 . 11398 1 1398 . 1 1 119 119 LEU HD22 H 1 0.873 0.030 . 1 . . . . 119 LEU HD2 . 11398 1 1399 . 1 1 119 119 LEU HD23 H 1 0.873 0.030 . 1 . . . . 119 LEU HD2 . 11398 1 1400 . 1 1 119 119 LEU HG H 1 1.458 0.030 . 1 . . . . 119 LEU HG . 11398 1 1401 . 1 1 119 119 LEU C C 13 175.589 0.300 . 1 . . . . 119 LEU C . 11398 1 1402 . 1 1 119 119 LEU CA C 13 53.648 0.300 . 1 . . . . 119 LEU CA . 11398 1 1403 . 1 1 119 119 LEU CB C 13 46.004 0.300 . 1 . . . . 119 LEU CB . 11398 1 1404 . 1 1 119 119 LEU CD1 C 13 24.872 0.300 . 2 . . . . 119 LEU CD1 . 11398 1 1405 . 1 1 119 119 LEU CD2 C 13 24.478 0.300 . 2 . . . . 119 LEU CD2 . 11398 1 1406 . 1 1 119 119 LEU CG C 13 27.450 0.300 . 1 . . . . 119 LEU CG . 11398 1 1407 . 1 1 119 119 LEU N N 15 121.421 0.300 . 1 . . . . 119 LEU N . 11398 1 1408 . 1 1 120 120 ARG H H 1 9.285 0.030 . 1 . . . . 120 ARG H . 11398 1 1409 . 1 1 120 120 ARG HA H 1 4.840 0.030 . 1 . . . . 120 ARG HA . 11398 1 1410 . 1 1 120 120 ARG HB2 H 1 1.703 0.030 . 2 . . . . 120 ARG HB2 . 11398 1 1411 . 1 1 120 120 ARG HB3 H 1 1.807 0.030 . 2 . . . . 120 ARG HB3 . 11398 1 1412 . 1 1 120 120 ARG HD2 H 1 2.997 0.030 . 2 . . . . 120 ARG HD2 . 11398 1 1413 . 1 1 120 120 ARG HD3 H 1 3.221 0.030 . 2 . . . . 120 ARG HD3 . 11398 1 1414 . 1 1 120 120 ARG HE H 1 9.077 0.030 . 1 . . . . 120 ARG HE . 11398 1 1415 . 1 1 120 120 ARG HG2 H 1 1.570 0.030 . 2 . . . . 120 ARG HG2 . 11398 1 1416 . 1 1 120 120 ARG HG3 H 1 1.641 0.030 . 2 . . . . 120 ARG HG3 . 11398 1 1417 . 1 1 120 120 ARG C C 13 174.956 0.300 . 1 . . . . 120 ARG C . 11398 1 1418 . 1 1 120 120 ARG CA C 13 54.886 0.300 . 1 . . . . 120 ARG CA . 11398 1 1419 . 1 1 120 120 ARG CB C 13 33.798 0.300 . 1 . . . . 120 ARG CB . 11398 1 1420 . 1 1 120 120 ARG CD C 13 43.532 0.300 . 1 . . . . 120 ARG CD . 11398 1 1421 . 1 1 120 120 ARG CG C 13 25.851 0.300 . 1 . . . . 120 ARG CG . 11398 1 1422 . 1 1 120 120 ARG N N 15 128.431 0.300 . 1 . . . . 120 ARG N . 11398 1 1423 . 1 1 120 120 ARG NE N 15 117.132 0.300 . 1 . . . . 120 ARG NE . 11398 1 1424 . 1 1 121 121 ARG H H 1 8.927 0.030 . 1 . . . . 121 ARG H . 11398 1 1425 . 1 1 121 121 ARG HA H 1 4.361 0.030 . 1 . . . . 121 ARG HA . 11398 1 1426 . 1 1 121 121 ARG HB2 H 1 1.778 0.030 . 2 . . . . 121 ARG HB2 . 11398 1 1427 . 1 1 121 121 ARG HB3 H 1 1.997 0.030 . 2 . . . . 121 ARG HB3 . 11398 1 1428 . 1 1 121 121 ARG HD2 H 1 3.263 0.030 . 1 . . . . 121 ARG HD2 . 11398 1 1429 . 1 1 121 121 ARG HD3 H 1 3.263 0.030 . 1 . . . . 121 ARG HD3 . 11398 1 1430 . 1 1 121 121 ARG HE H 1 7.359 0.030 . 1 . . . . 121 ARG HE . 11398 1 1431 . 1 1 121 121 ARG HG2 H 1 1.721 0.030 . 2 . . . . 121 ARG HG2 . 11398 1 1432 . 1 1 121 121 ARG HG3 H 1 1.759 0.030 . 2 . . . . 121 ARG HG3 . 11398 1 1433 . 1 1 121 121 ARG C C 13 176.302 0.300 . 1 . . . . 121 ARG C . 11398 1 1434 . 1 1 121 121 ARG CA C 13 56.054 0.300 . 1 . . . . 121 ARG CA . 11398 1 1435 . 1 1 121 121 ARG CB C 13 31.524 0.300 . 1 . . . . 121 ARG CB . 11398 1 1436 . 1 1 121 121 ARG CD C 13 43.419 0.300 . 1 . . . . 121 ARG CD . 11398 1 1437 . 1 1 121 121 ARG CG C 13 27.986 0.300 . 1 . . . . 121 ARG CG . 11398 1 1438 . 1 1 121 121 ARG N N 15 127.580 0.300 . 1 . . . . 121 ARG N . 11398 1 1439 . 1 1 121 121 ARG NE N 15 118.174 0.300 . 1 . . . . 121 ARG NE . 11398 1 1440 . 1 1 122 122 SER H H 1 8.558 0.030 . 1 . . . . 122 SER H . 11398 1 1441 . 1 1 122 122 SER HA H 1 4.557 0.030 . 1 . . . . 122 SER HA . 11398 1 1442 . 1 1 122 122 SER HB2 H 1 3.863 0.030 . 1 . . . . 122 SER HB2 . 11398 1 1443 . 1 1 122 122 SER HB3 H 1 3.863 0.030 . 1 . . . . 122 SER HB3 . 11398 1 1444 . 1 1 122 122 SER C C 13 178.200 0.300 . 1 . . . . 122 SER C . 11398 1 1445 . 1 1 122 122 SER CA C 13 59.049 0.300 . 1 . . . . 122 SER CA . 11398 1 1446 . 1 1 122 122 SER CB C 13 63.997 0.300 . 1 . . . . 122 SER CB . 11398 1 1447 . 1 1 122 122 SER N N 15 118.045 0.300 . 1 . . . . 122 SER N . 11398 1 1448 . 1 1 123 123 GLY H H 1 8.359 0.030 . 1 . . . . 123 GLY H . 11398 1 1449 . 1 1 123 123 GLY HA2 H 1 4.193 0.030 . 1 . . . . 123 GLY HA2 . 11398 1 1450 . 1 1 123 123 GLY HA3 H 1 4.193 0.030 . 1 . . . . 123 GLY HA3 . 11398 1 1451 . 1 1 123 123 GLY CA C 13 44.753 0.300 . 1 . . . . 123 GLY CA . 11398 1 1452 . 1 1 123 123 GLY N N 15 110.586 0.300 . 1 . . . . 123 GLY N . 11398 1 1453 . 1 1 124 124 PRO HA H 1 4.510 0.030 . 1 . . . . 124 PRO HA . 11398 1 1454 . 1 1 124 124 PRO HB2 H 1 2.015 0.030 . 2 . . . . 124 PRO HB2 . 11398 1 1455 . 1 1 124 124 PRO HB3 H 1 2.329 0.030 . 2 . . . . 124 PRO HB3 . 11398 1 1456 . 1 1 124 124 PRO HD2 H 1 3.653 0.030 . 1 . . . . 124 PRO HD2 . 11398 1 1457 . 1 1 124 124 PRO HD3 H 1 3.653 0.030 . 1 . . . . 124 PRO HD3 . 11398 1 1458 . 1 1 124 124 PRO HG2 H 1 2.057 0.030 . 1 . . . . 124 PRO HG2 . 11398 1 1459 . 1 1 124 124 PRO HG3 H 1 2.057 0.030 . 1 . . . . 124 PRO HG3 . 11398 1 1460 . 1 1 124 124 PRO CA C 13 63.351 0.300 . 1 . . . . 124 PRO CA . 11398 1 1461 . 1 1 124 124 PRO CB C 13 32.297 0.300 . 1 . . . . 124 PRO CB . 11398 1 1462 . 1 1 124 124 PRO CD C 13 49.851 0.300 . 1 . . . . 124 PRO CD . 11398 1 1463 . 1 1 124 124 PRO CG C 13 27.213 0.300 . 1 . . . . 124 PRO CG . 11398 1 1464 . 1 1 125 125 SER H H 1 8.559 0.030 . 1 . . . . 125 SER H . 11398 1 1465 . 1 1 125 125 SER HA H 1 4.505 0.030 . 1 . . . . 125 SER HA . 11398 1 1466 . 1 1 125 125 SER HB2 H 1 3.923 0.030 . 1 . . . . 125 SER HB2 . 11398 1 1467 . 1 1 125 125 SER HB3 H 1 3.923 0.030 . 1 . . . . 125 SER HB3 . 11398 1 1468 . 1 1 125 125 SER CA C 13 58.481 0.300 . 1 . . . . 125 SER CA . 11398 1 1469 . 1 1 125 125 SER CB C 13 63.887 0.300 . 1 . . . . 125 SER CB . 11398 1 1470 . 1 1 125 125 SER N N 15 116.333 0.300 . 1 . . . . 125 SER N . 11398 1 stop_ save_