data_11129 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11129 _Entry.Title ; Solution structure of the CH domain of human Rho guanine nucleotide exchange factor 6 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-31 _Entry.Accession_date 2010-03-31 _Entry.Last_release_date 2011-04-01 _Entry.Original_release_date 2011-04-01 _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 T. Tomizawa . . . 11129 2 T. Kigawa . . . 11129 3 S. Koshiba . . . 11129 4 M. Inoue . . . 11129 5 S. Yokoyama . . . 11129 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)' . 11129 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11129 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 509 11129 '15N chemical shifts' 117 11129 '1H chemical shifts' 807 11129 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 . . 2011-04-01 2010-03-31 original author . 11129 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WYR 'BMRB Entry Tracking System' 11129 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11129 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the CH domain of human Rho guanine nucleotide exchange factor 6 ; _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 T. Tomizawa . . . 11129 1 2 T. Kigawa . . . 11129 1 3 S. Koshiba . . . 11129 1 4 M. Inoue . . . 11129 1 5 S. Yokoyama . . . 11129 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11129 _Assembly.ID 1 _Assembly.Name 'Rho guanine nucleotide exchange factor 6' _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 'CH domain' 1 $entity_1 A . yes native no no . . . 11129 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 1wyr . . . . . . 11129 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11129 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'CH 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 ; GSSGSSGEEQIVTWLISLGV LESPKKTICDPEEFLKSSLK NGVVLCKLINRLMPGSVEKF CLDPQTEADCINNINDFLKG CATLQVEIFDPDDLYSGVNF SKVLSTLLAVNKATESGPSS G ; _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 121 _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 1WYR . "Solution Structure Of The Ch Domain Of Human Rho Guanine Nucleotide Exchange Factor 6" . . . . . 100.00 121 100.00 100.00 2.24e-79 . . . . 11129 1 2 no DBJ BAF84431 . "unnamed protein product [Homo sapiens]" . . . . . 89.26 776 100.00 100.00 1.05e-65 . . . . 11129 1 3 no EMBL CAD97632 . "hypothetical protein [Homo sapiens]" . . . . . 89.26 776 100.00 100.00 1.15e-65 . . . . 11129 1 4 no GB AAH39856 . "Rac/Cdc42 guanine nucleotide exchange factor (GEF) 6 [Homo sapiens]" . . . . . 89.26 776 100.00 100.00 1.05e-65 . . . . 11129 1 5 no GB EAW88460 . "Rac/Cdc42 guanine nucleotide exchange factor (GEF) 6, isoform CRA_a [Homo sapiens]" . . . . . 89.26 776 100.00 100.00 1.05e-65 . . . . 11129 1 6 no GB EHH31126 . "hypothetical protein EGK_20986 [Macaca mulatta]" . . . . . 89.26 776 98.15 100.00 6.39e-65 . . . . 11129 1 7 no GB EHH61270 . "hypothetical protein EGM_19238 [Macaca fascicularis]" . . . . . 89.26 776 98.15 100.00 6.39e-65 . . . . 11129 1 8 no REF NP_001253502 . "rho guanine nucleotide exchange factor 6 [Macaca mulatta]" . . . . . 89.26 776 98.15 100.00 6.39e-65 . . . . 11129 1 9 no REF NP_004831 . "rho guanine nucleotide exchange factor 6 isoform 1 [Homo sapiens]" . . . . . 89.26 776 100.00 100.00 1.05e-65 . . . . 11129 1 10 no REF XP_002763367 . "PREDICTED: rho guanine nucleotide exchange factor 6 isoform X1 [Callithrix jacchus]" . . . . . 89.26 776 98.15 100.00 6.26e-65 . . . . 11129 1 11 no REF XP_002832212 . "PREDICTED: rho guanine nucleotide exchange factor 6 isoform X2 [Pongo abelii]" . . . . . 89.26 776 98.15 100.00 6.14e-65 . . . . 11129 1 12 no REF XP_003272624 . "PREDICTED: rho guanine nucleotide exchange factor 6 isoform X1 [Nomascus leucogenys]" . . . . . 89.26 776 98.15 100.00 6.14e-65 . . . . 11129 1 13 no SP Q15052 . "RecName: Full=Rho guanine nucleotide exchange factor 6; AltName: Full=Alpha-Pix; AltName: Full=COOL-2; AltName: Full=PAK-intera" . . . . . 89.26 776 100.00 100.00 1.05e-65 . . . . 11129 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CH domain' . 11129 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 . 11129 1 2 . SER . 11129 1 3 . SER . 11129 1 4 . GLY . 11129 1 5 . SER . 11129 1 6 . SER . 11129 1 7 . GLY . 11129 1 8 . GLU . 11129 1 9 . GLU . 11129 1 10 . GLN . 11129 1 11 . ILE . 11129 1 12 . VAL . 11129 1 13 . THR . 11129 1 14 . TRP . 11129 1 15 . LEU . 11129 1 16 . ILE . 11129 1 17 . SER . 11129 1 18 . LEU . 11129 1 19 . GLY . 11129 1 20 . VAL . 11129 1 21 . LEU . 11129 1 22 . GLU . 11129 1 23 . SER . 11129 1 24 . PRO . 11129 1 25 . LYS . 11129 1 26 . LYS . 11129 1 27 . THR . 11129 1 28 . ILE . 11129 1 29 . CYS . 11129 1 30 . ASP . 11129 1 31 . PRO . 11129 1 32 . GLU . 11129 1 33 . GLU . 11129 1 34 . PHE . 11129 1 35 . LEU . 11129 1 36 . LYS . 11129 1 37 . SER . 11129 1 38 . SER . 11129 1 39 . LEU . 11129 1 40 . LYS . 11129 1 41 . ASN . 11129 1 42 . GLY . 11129 1 43 . VAL . 11129 1 44 . VAL . 11129 1 45 . LEU . 11129 1 46 . CYS . 11129 1 47 . LYS . 11129 1 48 . LEU . 11129 1 49 . ILE . 11129 1 50 . ASN . 11129 1 51 . ARG . 11129 1 52 . LEU . 11129 1 53 . MET . 11129 1 54 . PRO . 11129 1 55 . GLY . 11129 1 56 . SER . 11129 1 57 . VAL . 11129 1 58 . GLU . 11129 1 59 . LYS . 11129 1 60 . PHE . 11129 1 61 . CYS . 11129 1 62 . LEU . 11129 1 63 . ASP . 11129 1 64 . PRO . 11129 1 65 . GLN . 11129 1 66 . THR . 11129 1 67 . GLU . 11129 1 68 . ALA . 11129 1 69 . ASP . 11129 1 70 . CYS . 11129 1 71 . ILE . 11129 1 72 . ASN . 11129 1 73 . ASN . 11129 1 74 . ILE . 11129 1 75 . ASN . 11129 1 76 . ASP . 11129 1 77 . PHE . 11129 1 78 . LEU . 11129 1 79 . LYS . 11129 1 80 . GLY . 11129 1 81 . CYS . 11129 1 82 . ALA . 11129 1 83 . THR . 11129 1 84 . LEU . 11129 1 85 . GLN . 11129 1 86 . VAL . 11129 1 87 . GLU . 11129 1 88 . ILE . 11129 1 89 . PHE . 11129 1 90 . ASP . 11129 1 91 . PRO . 11129 1 92 . ASP . 11129 1 93 . ASP . 11129 1 94 . LEU . 11129 1 95 . TYR . 11129 1 96 . SER . 11129 1 97 . GLY . 11129 1 98 . VAL . 11129 1 99 . ASN . 11129 1 100 . PHE . 11129 1 101 . SER . 11129 1 102 . LYS . 11129 1 103 . VAL . 11129 1 104 . LEU . 11129 1 105 . SER . 11129 1 106 . THR . 11129 1 107 . LEU . 11129 1 108 . LEU . 11129 1 109 . ALA . 11129 1 110 . VAL . 11129 1 111 . ASN . 11129 1 112 . LYS . 11129 1 113 . ALA . 11129 1 114 . THR . 11129 1 115 . GLU . 11129 1 116 . SER . 11129 1 117 . GLY . 11129 1 118 . PRO . 11129 1 119 . SER . 11129 1 120 . SER . 11129 1 121 . GLY . 11129 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 11129 1 . SER 2 2 11129 1 . SER 3 3 11129 1 . GLY 4 4 11129 1 . SER 5 5 11129 1 . SER 6 6 11129 1 . GLY 7 7 11129 1 . GLU 8 8 11129 1 . GLU 9 9 11129 1 . GLN 10 10 11129 1 . ILE 11 11 11129 1 . VAL 12 12 11129 1 . THR 13 13 11129 1 . TRP 14 14 11129 1 . LEU 15 15 11129 1 . ILE 16 16 11129 1 . SER 17 17 11129 1 . LEU 18 18 11129 1 . GLY 19 19 11129 1 . VAL 20 20 11129 1 . LEU 21 21 11129 1 . GLU 22 22 11129 1 . SER 23 23 11129 1 . PRO 24 24 11129 1 . LYS 25 25 11129 1 . LYS 26 26 11129 1 . THR 27 27 11129 1 . ILE 28 28 11129 1 . CYS 29 29 11129 1 . ASP 30 30 11129 1 . PRO 31 31 11129 1 . GLU 32 32 11129 1 . GLU 33 33 11129 1 . PHE 34 34 11129 1 . LEU 35 35 11129 1 . LYS 36 36 11129 1 . SER 37 37 11129 1 . SER 38 38 11129 1 . LEU 39 39 11129 1 . LYS 40 40 11129 1 . ASN 41 41 11129 1 . GLY 42 42 11129 1 . VAL 43 43 11129 1 . VAL 44 44 11129 1 . LEU 45 45 11129 1 . CYS 46 46 11129 1 . LYS 47 47 11129 1 . LEU 48 48 11129 1 . ILE 49 49 11129 1 . ASN 50 50 11129 1 . ARG 51 51 11129 1 . LEU 52 52 11129 1 . MET 53 53 11129 1 . PRO 54 54 11129 1 . GLY 55 55 11129 1 . SER 56 56 11129 1 . VAL 57 57 11129 1 . GLU 58 58 11129 1 . LYS 59 59 11129 1 . PHE 60 60 11129 1 . CYS 61 61 11129 1 . LEU 62 62 11129 1 . ASP 63 63 11129 1 . PRO 64 64 11129 1 . GLN 65 65 11129 1 . THR 66 66 11129 1 . GLU 67 67 11129 1 . ALA 68 68 11129 1 . ASP 69 69 11129 1 . CYS 70 70 11129 1 . ILE 71 71 11129 1 . ASN 72 72 11129 1 . ASN 73 73 11129 1 . ILE 74 74 11129 1 . ASN 75 75 11129 1 . ASP 76 76 11129 1 . PHE 77 77 11129 1 . LEU 78 78 11129 1 . LYS 79 79 11129 1 . GLY 80 80 11129 1 . CYS 81 81 11129 1 . ALA 82 82 11129 1 . THR 83 83 11129 1 . LEU 84 84 11129 1 . GLN 85 85 11129 1 . VAL 86 86 11129 1 . GLU 87 87 11129 1 . ILE 88 88 11129 1 . PHE 89 89 11129 1 . ASP 90 90 11129 1 . PRO 91 91 11129 1 . ASP 92 92 11129 1 . ASP 93 93 11129 1 . LEU 94 94 11129 1 . TYR 95 95 11129 1 . SER 96 96 11129 1 . GLY 97 97 11129 1 . VAL 98 98 11129 1 . ASN 99 99 11129 1 . PHE 100 100 11129 1 . SER 101 101 11129 1 . LYS 102 102 11129 1 . VAL 103 103 11129 1 . LEU 104 104 11129 1 . SER 105 105 11129 1 . THR 106 106 11129 1 . LEU 107 107 11129 1 . LEU 108 108 11129 1 . ALA 109 109 11129 1 . VAL 110 110 11129 1 . ASN 111 111 11129 1 . LYS 112 112 11129 1 . ALA 113 113 11129 1 . THR 114 114 11129 1 . GLU 115 115 11129 1 . SER 116 116 11129 1 . GLY 117 117 11129 1 . PRO 118 118 11129 1 . SER 119 119 11129 1 . SER 120 120 11129 1 . GLY 121 121 11129 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 11129 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11129 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 11129 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' . . 562 Escherichia coli . . . . . . . . . . . . . . . . P040910-16 . . . . . . 11129 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11129 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.32mM CH domain {U-15N,13C;} 20mM d-Tris-HCl(pH {7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 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 'CH domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.32 . . mM . . . . 11129 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11129 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11129 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11129 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11129 1 6 H2O . . . . . . solvent 90 . . % . . . . 11129 1 7 D2O . . . . . . solvent 10 . . % . . . . 11129 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 11129 _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 11129 1 pH 7.0 0.05 pH 11129 1 pressure 1 0.001 atm 11129 1 temperature 298 0.1 K 11129 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11129 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11129 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11129 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11129 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11129 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11129 2 stop_ save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 11129 _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.' . . 11129 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11129 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11129 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9295 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11129 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11129 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11129 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11129 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11129 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 11129 _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 11129 _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 . . . 11129 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 11129 _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 . . . . . . . . . . . . . . . . 11129 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11129 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 11129 _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 . . . . . . . . . 11129 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11129 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11129 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 11129 _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 11129 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11129 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 . . 11129 1 2 $NMRPipe . . 11129 1 3 $NMRview . . 11129 1 4 $Kujira . . 11129 1 5 $CYANA . . 11129 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 5 5 SER HA H 1 4.539 0.030 . 1 . . . . 5 SER HA . 11129 1 2 . 1 1 5 5 SER HB2 H 1 3.793 0.030 . 2 . . . . 5 SER HB2 . 11129 1 3 . 1 1 5 5 SER CA C 13 55.801 0.300 . 1 . . . . 5 SER CA . 11129 1 4 . 1 1 5 5 SER CB C 13 61.680 0.300 . 1 . . . . 5 SER CB . 11129 1 5 . 1 1 6 6 SER H H 1 8.527 0.030 . 1 . . . . 6 SER H . 11129 1 6 . 1 1 6 6 SER HA H 1 4.442 0.030 . 1 . . . . 6 SER HA . 11129 1 7 . 1 1 6 6 SER HB2 H 1 4.069 0.030 . 2 . . . . 6 SER HB2 . 11129 1 8 . 1 1 6 6 SER HB3 H 1 3.908 0.030 . 2 . . . . 6 SER HB3 . 11129 1 9 . 1 1 6 6 SER C C 13 173.189 0.300 . 1 . . . . 6 SER C . 11129 1 10 . 1 1 6 6 SER CA C 13 56.083 0.300 . 1 . . . . 6 SER CA . 11129 1 11 . 1 1 6 6 SER CB C 13 62.089 0.300 . 1 . . . . 6 SER CB . 11129 1 12 . 1 1 6 6 SER N N 15 118.293 0.300 . 1 . . . . 6 SER N . 11129 1 13 . 1 1 7 7 GLY H H 1 8.808 0.030 . 1 . . . . 7 GLY H . 11129 1 14 . 1 1 7 7 GLY HA2 H 1 3.742 0.030 . 2 . . . . 7 GLY HA2 . 11129 1 15 . 1 1 7 7 GLY HA3 H 1 3.819 0.030 . 2 . . . . 7 GLY HA3 . 11129 1 16 . 1 1 7 7 GLY C C 13 172.911 0.300 . 1 . . . . 7 GLY C . 11129 1 17 . 1 1 7 7 GLY CA C 13 44.946 0.300 . 1 . . . . 7 GLY CA . 11129 1 18 . 1 1 7 7 GLY N N 15 110.255 0.300 . 1 . . . . 7 GLY N . 11129 1 19 . 1 1 8 8 GLU H H 1 10.101 0.030 . 1 . . . . 8 GLU H . 11129 1 20 . 1 1 8 8 GLU HA H 1 3.690 0.030 . 1 . . . . 8 GLU HA . 11129 1 21 . 1 1 8 8 GLU HB2 H 1 1.638 0.030 . 2 . . . . 8 GLU HB2 . 11129 1 22 . 1 1 8 8 GLU HB3 H 1 2.021 0.030 . 2 . . . . 8 GLU HB3 . 11129 1 23 . 1 1 8 8 GLU HG2 H 1 2.194 0.030 . 2 . . . . 8 GLU HG2 . 11129 1 24 . 1 1 8 8 GLU HG3 H 1 2.361 0.030 . 2 . . . . 8 GLU HG3 . 11129 1 25 . 1 1 8 8 GLU C C 13 176.010 0.300 . 1 . . . . 8 GLU C . 11129 1 26 . 1 1 8 8 GLU CA C 13 59.192 0.300 . 1 . . . . 8 GLU CA . 11129 1 27 . 1 1 8 8 GLU CB C 13 26.340 0.300 . 1 . . . . 8 GLU CB . 11129 1 28 . 1 1 8 8 GLU CG C 13 35.339 0.300 . 1 . . . . 8 GLU CG . 11129 1 29 . 1 1 8 8 GLU N N 15 120.566 0.300 . 1 . . . . 8 GLU N . 11129 1 30 . 1 1 9 9 GLU H H 1 8.205 0.030 . 1 . . . . 9 GLU H . 11129 1 31 . 1 1 9 9 GLU HA H 1 3.794 0.030 . 1 . . . . 9 GLU HA . 11129 1 32 . 1 1 9 9 GLU HB2 H 1 2.017 0.030 . 1 . . . . 9 GLU HB2 . 11129 1 33 . 1 1 9 9 GLU HB3 H 1 2.017 0.030 . 1 . . . . 9 GLU HB3 . 11129 1 34 . 1 1 9 9 GLU HG2 H 1 2.172 0.030 . 2 . . . . 9 GLU HG2 . 11129 1 35 . 1 1 9 9 GLU HG3 H 1 2.222 0.030 . 2 . . . . 9 GLU HG3 . 11129 1 36 . 1 1 9 9 GLU C C 13 176.541 0.300 . 1 . . . . 9 GLU C . 11129 1 37 . 1 1 9 9 GLU CA C 13 57.634 0.300 . 1 . . . . 9 GLU CA . 11129 1 38 . 1 1 9 9 GLU CB C 13 27.225 0.300 . 1 . . . . 9 GLU CB . 11129 1 39 . 1 1 9 9 GLU CG C 13 35.046 0.300 . 1 . . . . 9 GLU CG . 11129 1 40 . 1 1 9 9 GLU N N 15 118.216 0.300 . 1 . . . . 9 GLU N . 11129 1 41 . 1 1 10 10 GLN H H 1 8.029 0.030 . 1 . . . . 10 GLN H . 11129 1 42 . 1 1 10 10 GLN HA H 1 3.941 0.030 . 1 . . . . 10 GLN HA . 11129 1 43 . 1 1 10 10 GLN HB2 H 1 2.133 0.030 . 2 . . . . 10 GLN HB2 . 11129 1 44 . 1 1 10 10 GLN HB3 H 1 1.965 0.030 . 2 . . . . 10 GLN HB3 . 11129 1 45 . 1 1 10 10 GLN HE21 H 1 6.981 0.030 . 2 . . . . 10 GLN HE21 . 11129 1 46 . 1 1 10 10 GLN HE22 H 1 6.501 0.030 . 2 . . . . 10 GLN HE22 . 11129 1 47 . 1 1 10 10 GLN HG2 H 1 2.075 0.030 . 2 . . . . 10 GLN HG2 . 11129 1 48 . 1 1 10 10 GLN HG3 H 1 2.313 0.030 . 2 . . . . 10 GLN HG3 . 11129 1 49 . 1 1 10 10 GLN C C 13 176.982 0.300 . 1 . . . . 10 GLN C . 11129 1 50 . 1 1 10 10 GLN CA C 13 56.775 0.300 . 1 . . . . 10 GLN CA . 11129 1 51 . 1 1 10 10 GLN CB C 13 25.758 0.300 . 1 . . . . 10 GLN CB . 11129 1 52 . 1 1 10 10 GLN CG C 13 31.295 0.300 . 1 . . . . 10 GLN CG . 11129 1 53 . 1 1 10 10 GLN N N 15 119.172 0.300 . 1 . . . . 10 GLN N . 11129 1 54 . 1 1 10 10 GLN NE2 N 15 110.252 0.300 . 1 . . . . 10 GLN NE2 . 11129 1 55 . 1 1 11 11 ILE H H 1 8.056 0.030 . 1 . . . . 11 ILE H . 11129 1 56 . 1 1 11 11 ILE HA H 1 4.083 0.030 . 1 . . . . 11 ILE HA . 11129 1 57 . 1 1 11 11 ILE HB H 1 2.209 0.030 . 1 . . . . 11 ILE HB . 11129 1 58 . 1 1 11 11 ILE HD11 H 1 0.564 0.030 . 1 . . . . 11 ILE HD1 . 11129 1 59 . 1 1 11 11 ILE HD12 H 1 0.564 0.030 . 1 . . . . 11 ILE HD1 . 11129 1 60 . 1 1 11 11 ILE HD13 H 1 0.564 0.030 . 1 . . . . 11 ILE HD1 . 11129 1 61 . 1 1 11 11 ILE HG12 H 1 1.222 0.030 . 2 . . . . 11 ILE HG12 . 11129 1 62 . 1 1 11 11 ILE HG13 H 1 1.690 0.030 . 2 . . . . 11 ILE HG13 . 11129 1 63 . 1 1 11 11 ILE HG21 H 1 0.964 0.030 . 1 . . . . 11 ILE HG2 . 11129 1 64 . 1 1 11 11 ILE HG22 H 1 0.964 0.030 . 1 . . . . 11 ILE HG2 . 11129 1 65 . 1 1 11 11 ILE HG23 H 1 0.964 0.030 . 1 . . . . 11 ILE HG2 . 11129 1 66 . 1 1 11 11 ILE C C 13 175.387 0.300 . 1 . . . . 11 ILE C . 11129 1 67 . 1 1 11 11 ILE CA C 13 60.046 0.300 . 1 . . . . 11 ILE CA . 11129 1 68 . 1 1 11 11 ILE CB C 13 32.980 0.300 . 1 . . . . 11 ILE CB . 11129 1 69 . 1 1 11 11 ILE CD1 C 13 8.023 0.300 . 1 . . . . 11 ILE CD1 . 11129 1 70 . 1 1 11 11 ILE CG1 C 13 25.188 0.300 . 1 . . . . 11 ILE CG1 . 11129 1 71 . 1 1 11 11 ILE CG2 C 13 16.755 0.300 . 1 . . . . 11 ILE CG2 . 11129 1 72 . 1 1 11 11 ILE N N 15 119.118 0.300 . 1 . . . . 11 ILE N . 11129 1 73 . 1 1 12 12 VAL H H 1 8.428 0.030 . 1 . . . . 12 VAL H . 11129 1 74 . 1 1 12 12 VAL HA H 1 3.367 0.030 . 1 . . . . 12 VAL HA . 11129 1 75 . 1 1 12 12 VAL HB H 1 2.227 0.030 . 1 . . . . 12 VAL HB . 11129 1 76 . 1 1 12 12 VAL HG11 H 1 0.876 0.030 . 1 . . . . 12 VAL HG1 . 11129 1 77 . 1 1 12 12 VAL HG12 H 1 0.876 0.030 . 1 . . . . 12 VAL HG1 . 11129 1 78 . 1 1 12 12 VAL HG13 H 1 0.876 0.030 . 1 . . . . 12 VAL HG1 . 11129 1 79 . 1 1 12 12 VAL HG21 H 1 1.115 0.030 . 1 . . . . 12 VAL HG2 . 11129 1 80 . 1 1 12 12 VAL HG22 H 1 1.115 0.030 . 1 . . . . 12 VAL HG2 . 11129 1 81 . 1 1 12 12 VAL HG23 H 1 1.115 0.030 . 1 . . . . 12 VAL HG2 . 11129 1 82 . 1 1 12 12 VAL C C 13 174.716 0.300 . 1 . . . . 12 VAL C . 11129 1 83 . 1 1 12 12 VAL CA C 13 66.278 0.300 . 1 . . . . 12 VAL CA . 11129 1 84 . 1 1 12 12 VAL CB C 13 29.551 0.300 . 1 . . . . 12 VAL CB . 11129 1 85 . 1 1 12 12 VAL CG1 C 13 19.939 0.300 . 2 . . . . 12 VAL CG1 . 11129 1 86 . 1 1 12 12 VAL CG2 C 13 21.980 0.300 . 2 . . . . 12 VAL CG2 . 11129 1 87 . 1 1 12 12 VAL N N 15 120.855 0.300 . 1 . . . . 12 VAL N . 11129 1 88 . 1 1 13 13 THR H H 1 8.092 0.030 . 1 . . . . 13 THR H . 11129 1 89 . 1 1 13 13 THR HA H 1 3.727 0.030 . 1 . . . . 13 THR HA . 11129 1 90 . 1 1 13 13 THR HB H 1 4.155 0.030 . 1 . . . . 13 THR HB . 11129 1 91 . 1 1 13 13 THR HG21 H 1 1.215 0.030 . 1 . . . . 13 THR HG2 . 11129 1 92 . 1 1 13 13 THR HG22 H 1 1.215 0.030 . 1 . . . . 13 THR HG2 . 11129 1 93 . 1 1 13 13 THR HG23 H 1 1.215 0.030 . 1 . . . . 13 THR HG2 . 11129 1 94 . 1 1 13 13 THR C C 13 174.500 0.300 . 1 . . . . 13 THR C . 11129 1 95 . 1 1 13 13 THR CA C 13 64.462 0.300 . 1 . . . . 13 THR CA . 11129 1 96 . 1 1 13 13 THR CB C 13 66.659 0.300 . 1 . . . . 13 THR CB . 11129 1 97 . 1 1 13 13 THR CG2 C 13 19.549 0.300 . 1 . . . . 13 THR CG2 . 11129 1 98 . 1 1 13 13 THR N N 15 112.897 0.300 . 1 . . . . 13 THR N . 11129 1 99 . 1 1 14 14 TRP H H 1 8.171 0.030 . 1 . . . . 14 TRP H . 11129 1 100 . 1 1 14 14 TRP HA H 1 4.544 0.030 . 1 . . . . 14 TRP HA . 11129 1 101 . 1 1 14 14 TRP HB2 H 1 3.561 0.030 . 2 . . . . 14 TRP HB2 . 11129 1 102 . 1 1 14 14 TRP HB3 H 1 3.157 0.030 . 2 . . . . 14 TRP HB3 . 11129 1 103 . 1 1 14 14 TRP HD1 H 1 7.214 0.030 . 1 . . . . 14 TRP HD1 . 11129 1 104 . 1 1 14 14 TRP HE1 H 1 10.523 0.030 . 1 . . . . 14 TRP HE1 . 11129 1 105 . 1 1 14 14 TRP HE3 H 1 7.446 0.030 . 1 . . . . 14 TRP HE3 . 11129 1 106 . 1 1 14 14 TRP HH2 H 1 6.811 0.030 . 1 . . . . 14 TRP HH2 . 11129 1 107 . 1 1 14 14 TRP HZ2 H 1 7.271 0.030 . 1 . . . . 14 TRP HZ2 . 11129 1 108 . 1 1 14 14 TRP HZ3 H 1 6.740 0.030 . 1 . . . . 14 TRP HZ3 . 11129 1 109 . 1 1 14 14 TRP C C 13 175.538 0.300 . 1 . . . . 14 TRP C . 11129 1 110 . 1 1 14 14 TRP CA C 13 57.187 0.300 . 1 . . . . 14 TRP CA . 11129 1 111 . 1 1 14 14 TRP CB C 13 26.177 0.300 . 1 . . . . 14 TRP CB . 11129 1 112 . 1 1 14 14 TRP CD1 C 13 124.931 0.300 . 1 . . . . 14 TRP CD1 . 11129 1 113 . 1 1 14 14 TRP CE3 C 13 117.636 0.300 . 1 . . . . 14 TRP CE3 . 11129 1 114 . 1 1 14 14 TRP CH2 C 13 121.053 0.300 . 1 . . . . 14 TRP CH2 . 11129 1 115 . 1 1 14 14 TRP CZ2 C 13 111.790 0.300 . 1 . . . . 14 TRP CZ2 . 11129 1 116 . 1 1 14 14 TRP CZ3 C 13 118.729 0.300 . 1 . . . . 14 TRP CZ3 . 11129 1 117 . 1 1 14 14 TRP N N 15 124.285 0.300 . 1 . . . . 14 TRP N . 11129 1 118 . 1 1 14 14 TRP NE1 N 15 132.935 0.300 . 1 . . . . 14 TRP NE1 . 11129 1 119 . 1 1 15 15 LEU H H 1 8.626 0.030 . 1 . . . . 15 LEU H . 11129 1 120 . 1 1 15 15 LEU HA H 1 3.292 0.030 . 1 . . . . 15 LEU HA . 11129 1 121 . 1 1 15 15 LEU HB2 H 1 1.859 0.030 . 2 . . . . 15 LEU HB2 . 11129 1 122 . 1 1 15 15 LEU HB3 H 1 0.918 0.030 . 2 . . . . 15 LEU HB3 . 11129 1 123 . 1 1 15 15 LEU HD11 H 1 0.547 0.030 . 1 . . . . 15 LEU HD1 . 11129 1 124 . 1 1 15 15 LEU HD12 H 1 0.547 0.030 . 1 . . . . 15 LEU HD1 . 11129 1 125 . 1 1 15 15 LEU HD13 H 1 0.547 0.030 . 1 . . . . 15 LEU HD1 . 11129 1 126 . 1 1 15 15 LEU HD21 H 1 0.114 0.030 . 1 . . . . 15 LEU HD2 . 11129 1 127 . 1 1 15 15 LEU HD22 H 1 0.114 0.030 . 1 . . . . 15 LEU HD2 . 11129 1 128 . 1 1 15 15 LEU HD23 H 1 0.114 0.030 . 1 . . . . 15 LEU HD2 . 11129 1 129 . 1 1 15 15 LEU HG H 1 2.053 0.030 . 1 . . . . 15 LEU HG . 11129 1 130 . 1 1 15 15 LEU C C 13 177.433 0.300 . 1 . . . . 15 LEU C . 11129 1 131 . 1 1 15 15 LEU CA C 13 55.707 0.300 . 1 . . . . 15 LEU CA . 11129 1 132 . 1 1 15 15 LEU CB C 13 39.468 0.300 . 1 . . . . 15 LEU CB . 11129 1 133 . 1 1 15 15 LEU CD1 C 13 24.596 0.300 . 2 . . . . 15 LEU CD1 . 11129 1 134 . 1 1 15 15 LEU CD2 C 13 21.629 0.300 . 2 . . . . 15 LEU CD2 . 11129 1 135 . 1 1 15 15 LEU CG C 13 23.999 0.300 . 1 . . . . 15 LEU CG . 11129 1 136 . 1 1 15 15 LEU N N 15 117.542 0.300 . 1 . . . . 15 LEU N . 11129 1 137 . 1 1 16 16 ILE H H 1 8.169 0.030 . 1 . . . . 16 ILE H . 11129 1 138 . 1 1 16 16 ILE HA H 1 4.105 0.030 . 1 . . . . 16 ILE HA . 11129 1 139 . 1 1 16 16 ILE HB H 1 1.762 0.030 . 1 . . . . 16 ILE HB . 11129 1 140 . 1 1 16 16 ILE HD11 H 1 0.720 0.030 . 1 . . . . 16 ILE HD1 . 11129 1 141 . 1 1 16 16 ILE HD12 H 1 0.720 0.030 . 1 . . . . 16 ILE HD1 . 11129 1 142 . 1 1 16 16 ILE HD13 H 1 0.720 0.030 . 1 . . . . 16 ILE HD1 . 11129 1 143 . 1 1 16 16 ILE HG12 H 1 1.778 0.030 . 2 . . . . 16 ILE HG12 . 11129 1 144 . 1 1 16 16 ILE HG13 H 1 0.771 0.030 . 2 . . . . 16 ILE HG13 . 11129 1 145 . 1 1 16 16 ILE HG21 H 1 0.841 0.030 . 1 . . . . 16 ILE HG2 . 11129 1 146 . 1 1 16 16 ILE HG22 H 1 0.841 0.030 . 1 . . . . 16 ILE HG2 . 11129 1 147 . 1 1 16 16 ILE HG23 H 1 0.841 0.030 . 1 . . . . 16 ILE HG2 . 11129 1 148 . 1 1 16 16 ILE C C 13 178.894 0.300 . 1 . . . . 16 ILE C . 11129 1 149 . 1 1 16 16 ILE CA C 13 62.474 0.300 . 1 . . . . 16 ILE CA . 11129 1 150 . 1 1 16 16 ILE CB C 13 35.980 0.300 . 1 . . . . 16 ILE CB . 11129 1 151 . 1 1 16 16 ILE CD1 C 13 12.545 0.300 . 1 . . . . 16 ILE CD1 . 11129 1 152 . 1 1 16 16 ILE CG1 C 13 26.692 0.300 . 1 . . . . 16 ILE CG1 . 11129 1 153 . 1 1 16 16 ILE CG2 C 13 14.709 0.300 . 1 . . . . 16 ILE CG2 . 11129 1 154 . 1 1 16 16 ILE N N 15 118.851 0.300 . 1 . . . . 16 ILE N . 11129 1 155 . 1 1 17 17 SER H H 1 8.496 0.030 . 1 . . . . 17 SER H . 11129 1 156 . 1 1 17 17 SER HA H 1 4.177 0.030 . 1 . . . . 17 SER HA . 11129 1 157 . 1 1 17 17 SER HB2 H 1 4.029 0.030 . 2 . . . . 17 SER HB2 . 11129 1 158 . 1 1 17 17 SER HB3 H 1 4.080 0.030 . 2 . . . . 17 SER HB3 . 11129 1 159 . 1 1 17 17 SER C C 13 174.012 0.300 . 1 . . . . 17 SER C . 11129 1 160 . 1 1 17 17 SER CA C 13 59.532 0.300 . 1 . . . . 17 SER CA . 11129 1 161 . 1 1 17 17 SER CB C 13 60.355 0.300 . 1 . . . . 17 SER CB . 11129 1 162 . 1 1 17 17 SER N N 15 119.547 0.300 . 1 . . . . 17 SER N . 11129 1 163 . 1 1 18 18 LEU H H 1 7.596 0.030 . 1 . . . . 18 LEU H . 11129 1 164 . 1 1 18 18 LEU HA H 1 4.137 0.030 . 1 . . . . 18 LEU HA . 11129 1 165 . 1 1 18 18 LEU HB2 H 1 1.397 0.030 . 2 . . . . 18 LEU HB2 . 11129 1 166 . 1 1 18 18 LEU HB3 H 1 1.190 0.030 . 2 . . . . 18 LEU HB3 . 11129 1 167 . 1 1 18 18 LEU HD11 H 1 -0.091 0.030 . 1 . . . . 18 LEU HD1 . 11129 1 168 . 1 1 18 18 LEU HD12 H 1 -0.091 0.030 . 1 . . . . 18 LEU HD1 . 11129 1 169 . 1 1 18 18 LEU HD13 H 1 -0.091 0.030 . 1 . . . . 18 LEU HD1 . 11129 1 170 . 1 1 18 18 LEU HD21 H 1 0.610 0.030 . 1 . . . . 18 LEU HD2 . 11129 1 171 . 1 1 18 18 LEU HD22 H 1 0.610 0.030 . 1 . . . . 18 LEU HD2 . 11129 1 172 . 1 1 18 18 LEU HD23 H 1 0.610 0.030 . 1 . . . . 18 LEU HD2 . 11129 1 173 . 1 1 18 18 LEU HG H 1 1.361 0.030 . 1 . . . . 18 LEU HG . 11129 1 174 . 1 1 18 18 LEU C C 13 175.476 0.300 . 1 . . . . 18 LEU C . 11129 1 175 . 1 1 18 18 LEU CA C 13 52.873 0.300 . 1 . . . . 18 LEU CA . 11129 1 176 . 1 1 18 18 LEU CB C 13 41.832 0.300 . 1 . . . . 18 LEU CB . 11129 1 177 . 1 1 18 18 LEU CD1 C 13 23.388 0.300 . 2 . . . . 18 LEU CD1 . 11129 1 178 . 1 1 18 18 LEU CD2 C 13 19.943 0.300 . 2 . . . . 18 LEU CD2 . 11129 1 179 . 1 1 18 18 LEU CG C 13 24.308 0.300 . 1 . . . . 18 LEU CG . 11129 1 180 . 1 1 18 18 LEU N N 15 119.487 0.300 . 1 . . . . 18 LEU N . 11129 1 181 . 1 1 19 19 GLY H H 1 7.895 0.030 . 1 . . . . 19 GLY H . 11129 1 182 . 1 1 19 19 GLY HA2 H 1 4.028 0.030 . 2 . . . . 19 GLY HA2 . 11129 1 183 . 1 1 19 19 GLY HA3 H 1 3.907 0.030 . 2 . . . . 19 GLY HA3 . 11129 1 184 . 1 1 19 19 GLY C C 13 172.627 0.300 . 1 . . . . 19 GLY C . 11129 1 185 . 1 1 19 19 GLY CA C 13 43.170 0.300 . 1 . . . . 19 GLY CA . 11129 1 186 . 1 1 19 19 GLY N N 15 105.959 0.300 . 1 . . . . 19 GLY N . 11129 1 187 . 1 1 20 20 VAL H H 1 7.004 0.030 . 1 . . . . 20 VAL H . 11129 1 188 . 1 1 20 20 VAL HA H 1 4.150 0.030 . 1 . . . . 20 VAL HA . 11129 1 189 . 1 1 20 20 VAL HB H 1 2.200 0.030 . 1 . . . . 20 VAL HB . 11129 1 190 . 1 1 20 20 VAL HG11 H 1 0.532 0.030 . 1 . . . . 20 VAL HG1 . 11129 1 191 . 1 1 20 20 VAL HG12 H 1 0.532 0.030 . 1 . . . . 20 VAL HG1 . 11129 1 192 . 1 1 20 20 VAL HG13 H 1 0.532 0.030 . 1 . . . . 20 VAL HG1 . 11129 1 193 . 1 1 20 20 VAL HG21 H 1 0.521 0.030 . 1 . . . . 20 VAL HG2 . 11129 1 194 . 1 1 20 20 VAL HG22 H 1 0.521 0.030 . 1 . . . . 20 VAL HG2 . 11129 1 195 . 1 1 20 20 VAL HG23 H 1 0.521 0.030 . 1 . . . . 20 VAL HG2 . 11129 1 196 . 1 1 20 20 VAL C C 13 170.205 0.300 . 1 . . . . 20 VAL C . 11129 1 197 . 1 1 20 20 VAL CA C 13 59.008 0.300 . 1 . . . . 20 VAL CA . 11129 1 198 . 1 1 20 20 VAL CB C 13 28.943 0.300 . 1 . . . . 20 VAL CB . 11129 1 199 . 1 1 20 20 VAL CG1 C 13 19.360 0.300 . 2 . . . . 20 VAL CG1 . 11129 1 200 . 1 1 20 20 VAL CG2 C 13 17.908 0.300 . 2 . . . . 20 VAL CG2 . 11129 1 201 . 1 1 20 20 VAL N N 15 108.462 0.300 . 1 . . . . 20 VAL N . 11129 1 202 . 1 1 21 21 LEU H H 1 6.655 0.030 . 1 . . . . 21 LEU H . 11129 1 203 . 1 1 21 21 LEU HA H 1 4.418 0.030 . 1 . . . . 21 LEU HA . 11129 1 204 . 1 1 21 21 LEU HB2 H 1 1.313 0.030 . 2 . . . . 21 LEU HB2 . 11129 1 205 . 1 1 21 21 LEU HB3 H 1 0.931 0.030 . 2 . . . . 21 LEU HB3 . 11129 1 206 . 1 1 21 21 LEU HD11 H 1 0.832 0.030 . 1 . . . . 21 LEU HD1 . 11129 1 207 . 1 1 21 21 LEU HD12 H 1 0.832 0.030 . 1 . . . . 21 LEU HD1 . 11129 1 208 . 1 1 21 21 LEU HD13 H 1 0.832 0.030 . 1 . . . . 21 LEU HD1 . 11129 1 209 . 1 1 21 21 LEU HD21 H 1 0.829 0.030 . 1 . . . . 21 LEU HD2 . 11129 1 210 . 1 1 21 21 LEU HD22 H 1 0.829 0.030 . 1 . . . . 21 LEU HD2 . 11129 1 211 . 1 1 21 21 LEU HD23 H 1 0.829 0.030 . 1 . . . . 21 LEU HD2 . 11129 1 212 . 1 1 21 21 LEU HG H 1 1.592 0.030 . 1 . . . . 21 LEU HG . 11129 1 213 . 1 1 21 21 LEU C C 13 172.251 0.300 . 1 . . . . 21 LEU C . 11129 1 214 . 1 1 21 21 LEU CA C 13 50.544 0.300 . 1 . . . . 21 LEU CA . 11129 1 215 . 1 1 21 21 LEU CB C 13 44.989 0.300 . 1 . . . . 21 LEU CB . 11129 1 216 . 1 1 21 21 LEU CD1 C 13 21.862 0.300 . 2 . . . . 21 LEU CD1 . 11129 1 217 . 1 1 21 21 LEU CD2 C 13 23.905 0.300 . 2 . . . . 21 LEU CD2 . 11129 1 218 . 1 1 21 21 LEU CG C 13 24.423 0.300 . 1 . . . . 21 LEU CG . 11129 1 219 . 1 1 21 21 LEU N N 15 120.508 0.300 . 1 . . . . 21 LEU N . 11129 1 220 . 1 1 22 22 GLU H H 1 8.384 0.030 . 1 . . . . 22 GLU H . 11129 1 221 . 1 1 22 22 GLU HA H 1 4.125 0.030 . 1 . . . . 22 GLU HA . 11129 1 222 . 1 1 22 22 GLU HB2 H 1 1.847 0.030 . 2 . . . . 22 GLU HB2 . 11129 1 223 . 1 1 22 22 GLU HB3 H 1 1.797 0.030 . 2 . . . . 22 GLU HB3 . 11129 1 224 . 1 1 22 22 GLU HG2 H 1 2.150 0.030 . 1 . . . . 22 GLU HG2 . 11129 1 225 . 1 1 22 22 GLU HG3 H 1 2.150 0.030 . 1 . . . . 22 GLU HG3 . 11129 1 226 . 1 1 22 22 GLU C C 13 173.606 0.300 . 1 . . . . 22 GLU C . 11129 1 227 . 1 1 22 22 GLU CA C 13 53.635 0.300 . 1 . . . . 22 GLU CA . 11129 1 228 . 1 1 22 22 GLU CB C 13 28.175 0.300 . 1 . . . . 22 GLU CB . 11129 1 229 . 1 1 22 22 GLU CG C 13 34.047 0.300 . 1 . . . . 22 GLU CG . 11129 1 230 . 1 1 22 22 GLU N N 15 124.550 0.300 . 1 . . . . 22 GLU N . 11129 1 231 . 1 1 23 23 SER H H 1 8.517 0.030 . 1 . . . . 23 SER H . 11129 1 232 . 1 1 23 23 SER HA H 1 4.352 0.030 . 1 . . . . 23 SER HA . 11129 1 233 . 1 1 23 23 SER HB2 H 1 3.715 0.030 . 1 . . . . 23 SER HB2 . 11129 1 234 . 1 1 23 23 SER HB3 H 1 3.715 0.030 . 1 . . . . 23 SER HB3 . 11129 1 235 . 1 1 23 23 SER C C 13 171.427 0.300 . 1 . . . . 23 SER C . 11129 1 236 . 1 1 23 23 SER CA C 13 54.157 0.300 . 1 . . . . 23 SER CA . 11129 1 237 . 1 1 23 23 SER CB C 13 60.946 0.300 . 1 . . . . 23 SER CB . 11129 1 238 . 1 1 23 23 SER N N 15 117.975 0.300 . 1 . . . . 23 SER N . 11129 1 239 . 1 1 24 24 PRO HA H 1 4.386 0.030 . 1 . . . . 24 PRO HA . 11129 1 240 . 1 1 24 24 PRO HB2 H 1 1.875 0.030 . 2 . . . . 24 PRO HB2 . 11129 1 241 . 1 1 24 24 PRO HB3 H 1 2.007 0.030 . 2 . . . . 24 PRO HB3 . 11129 1 242 . 1 1 24 24 PRO HD2 H 1 3.625 0.030 . 2 . . . . 24 PRO HD2 . 11129 1 243 . 1 1 24 24 PRO HD3 H 1 3.571 0.030 . 2 . . . . 24 PRO HD3 . 11129 1 244 . 1 1 24 24 PRO HG2 H 1 1.685 0.030 . 2 . . . . 24 PRO HG2 . 11129 1 245 . 1 1 24 24 PRO HG3 H 1 1.491 0.030 . 2 . . . . 24 PRO HG3 . 11129 1 246 . 1 1 24 24 PRO CA C 13 60.379 0.300 . 1 . . . . 24 PRO CA . 11129 1 247 . 1 1 24 24 PRO CB C 13 29.642 0.300 . 1 . . . . 24 PRO CB . 11129 1 248 . 1 1 24 24 PRO CD C 13 48.301 0.300 . 1 . . . . 24 PRO CD . 11129 1 249 . 1 1 24 24 PRO CG C 13 24.678 0.300 . 1 . . . . 24 PRO CG . 11129 1 250 . 1 1 25 25 LYS HA H 1 4.004 0.030 . 1 . . . . 25 LYS HA . 11129 1 251 . 1 1 25 25 LYS HB2 H 1 1.787 0.030 . 2 . . . . 25 LYS HB2 . 11129 1 252 . 1 1 25 25 LYS HB3 H 1 1.643 0.030 . 2 . . . . 25 LYS HB3 . 11129 1 253 . 1 1 25 25 LYS HD2 H 1 1.546 0.030 . 2 . . . . 25 LYS HD2 . 11129 1 254 . 1 1 25 25 LYS HE2 H 1 2.897 0.030 . 2 . . . . 25 LYS HE2 . 11129 1 255 . 1 1 25 25 LYS HG2 H 1 1.380 0.030 . 2 . . . . 25 LYS HG2 . 11129 1 256 . 1 1 25 25 LYS HG3 H 1 1.306 0.030 . 2 . . . . 25 LYS HG3 . 11129 1 257 . 1 1 25 25 LYS C C 13 173.969 0.300 . 1 . . . . 25 LYS C . 11129 1 258 . 1 1 25 25 LYS CA C 13 54.583 0.300 . 1 . . . . 25 LYS CA . 11129 1 259 . 1 1 25 25 LYS CB C 13 29.728 0.300 . 1 . . . . 25 LYS CB . 11129 1 260 . 1 1 25 25 LYS CD C 13 26.515 0.300 . 1 . . . . 25 LYS CD . 11129 1 261 . 1 1 25 25 LYS CE C 13 39.848 0.300 . 1 . . . . 25 LYS CE . 11129 1 262 . 1 1 25 25 LYS CG C 13 22.728 0.300 . 1 . . . . 25 LYS CG . 11129 1 263 . 1 1 26 26 LYS H H 1 7.423 0.030 . 1 . . . . 26 LYS H . 11129 1 264 . 1 1 26 26 LYS HA H 1 4.322 0.030 . 1 . . . . 26 LYS HA . 11129 1 265 . 1 1 26 26 LYS HB2 H 1 1.566 0.030 . 2 . . . . 26 LYS HB2 . 11129 1 266 . 1 1 26 26 LYS HB3 H 1 1.705 0.030 . 2 . . . . 26 LYS HB3 . 11129 1 267 . 1 1 26 26 LYS HD2 H 1 1.540 0.030 . 1 . . . . 26 LYS HD2 . 11129 1 268 . 1 1 26 26 LYS HD3 H 1 1.540 0.030 . 1 . . . . 26 LYS HD3 . 11129 1 269 . 1 1 26 26 LYS HE2 H 1 2.831 0.030 . 1 . . . . 26 LYS HE2 . 11129 1 270 . 1 1 26 26 LYS HE3 H 1 2.831 0.030 . 1 . . . . 26 LYS HE3 . 11129 1 271 . 1 1 26 26 LYS HG2 H 1 1.188 0.030 . 1 . . . . 26 LYS HG2 . 11129 1 272 . 1 1 26 26 LYS HG3 H 1 1.188 0.030 . 1 . . . . 26 LYS HG3 . 11129 1 273 . 1 1 26 26 LYS C C 13 173.195 0.300 . 1 . . . . 26 LYS C . 11129 1 274 . 1 1 26 26 LYS CA C 13 52.525 0.300 . 1 . . . . 26 LYS CA . 11129 1 275 . 1 1 26 26 LYS CB C 13 31.833 0.300 . 1 . . . . 26 LYS CB . 11129 1 276 . 1 1 26 26 LYS CD C 13 26.753 0.300 . 1 . . . . 26 LYS CD . 11129 1 277 . 1 1 26 26 LYS CE C 13 39.530 0.300 . 1 . . . . 26 LYS CE . 11129 1 278 . 1 1 26 26 LYS CG C 13 21.770 0.300 . 1 . . . . 26 LYS CG . 11129 1 279 . 1 1 26 26 LYS N N 15 116.786 0.300 . 1 . . . . 26 LYS N . 11129 1 280 . 1 1 27 27 THR H H 1 7.983 0.030 . 1 . . . . 27 THR H . 11129 1 281 . 1 1 27 27 THR HA H 1 3.782 0.030 . 1 . . . . 27 THR HA . 11129 1 282 . 1 1 27 27 THR HB H 1 3.785 0.030 . 1 . . . . 27 THR HB . 11129 1 283 . 1 1 27 27 THR HG21 H 1 0.993 0.030 . 1 . . . . 27 THR HG2 . 11129 1 284 . 1 1 27 27 THR HG22 H 1 0.993 0.030 . 1 . . . . 27 THR HG2 . 11129 1 285 . 1 1 27 27 THR HG23 H 1 0.993 0.030 . 1 . . . . 27 THR HG2 . 11129 1 286 . 1 1 27 27 THR C C 13 171.820 0.300 . 1 . . . . 27 THR C . 11129 1 287 . 1 1 27 27 THR CA C 13 61.011 0.300 . 1 . . . . 27 THR CA . 11129 1 288 . 1 1 27 27 THR CB C 13 67.106 0.300 . 1 . . . . 27 THR CB . 11129 1 289 . 1 1 27 27 THR CG2 C 13 19.534 0.300 . 1 . . . . 27 THR CG2 . 11129 1 290 . 1 1 27 27 THR N N 15 116.259 0.300 . 1 . . . . 27 THR N . 11129 1 291 . 1 1 28 28 ILE H H 1 8.404 0.030 . 1 . . . . 28 ILE H . 11129 1 292 . 1 1 28 28 ILE HA H 1 3.781 0.030 . 1 . . . . 28 ILE HA . 11129 1 293 . 1 1 28 28 ILE HB H 1 1.552 0.030 . 1 . . . . 28 ILE HB . 11129 1 294 . 1 1 28 28 ILE HD11 H 1 0.157 0.030 . 1 . . . . 28 ILE HD1 . 11129 1 295 . 1 1 28 28 ILE HD12 H 1 0.157 0.030 . 1 . . . . 28 ILE HD1 . 11129 1 296 . 1 1 28 28 ILE HD13 H 1 0.157 0.030 . 1 . . . . 28 ILE HD1 . 11129 1 297 . 1 1 28 28 ILE HG12 H 1 0.472 0.030 . 2 . . . . 28 ILE HG12 . 11129 1 298 . 1 1 28 28 ILE HG13 H 1 1.066 0.030 . 2 . . . . 28 ILE HG13 . 11129 1 299 . 1 1 28 28 ILE HG21 H 1 0.452 0.030 . 1 . . . . 28 ILE HG2 . 11129 1 300 . 1 1 28 28 ILE HG22 H 1 0.452 0.030 . 1 . . . . 28 ILE HG2 . 11129 1 301 . 1 1 28 28 ILE HG23 H 1 0.452 0.030 . 1 . . . . 28 ILE HG2 . 11129 1 302 . 1 1 28 28 ILE C C 13 173.443 0.300 . 1 . . . . 28 ILE C . 11129 1 303 . 1 1 28 28 ILE CA C 13 58.303 0.300 . 1 . . . . 28 ILE CA . 11129 1 304 . 1 1 28 28 ILE CB C 13 35.428 0.300 . 1 . . . . 28 ILE CB . 11129 1 305 . 1 1 28 28 ILE CD1 C 13 10.350 0.300 . 1 . . . . 28 ILE CD1 . 11129 1 306 . 1 1 28 28 ILE CG1 C 13 24.614 0.300 . 1 . . . . 28 ILE CG1 . 11129 1 307 . 1 1 28 28 ILE CG2 C 13 15.154 0.300 . 1 . . . . 28 ILE CG2 . 11129 1 308 . 1 1 28 28 ILE N N 15 126.279 0.300 . 1 . . . . 28 ILE N . 11129 1 309 . 1 1 29 29 CYS HA H 1 4.323 0.030 . 1 . . . . 29 CYS HA . 11129 1 310 . 1 1 29 29 CYS HB2 H 1 2.786 0.030 . 1 . . . . 29 CYS HB2 . 11129 1 311 . 1 1 29 29 CYS HB3 H 1 2.786 0.030 . 1 . . . . 29 CYS HB3 . 11129 1 312 . 1 1 29 29 CYS CA C 13 57.165 0.300 . 1 . . . . 29 CYS CA . 11129 1 313 . 1 1 29 29 CYS CB C 13 25.698 0.300 . 1 . . . . 29 CYS CB . 11129 1 314 . 1 1 30 30 ASP HA H 1 4.940 0.030 . 1 . . . . 30 ASP HA . 11129 1 315 . 1 1 30 30 ASP HB2 H 1 2.824 0.030 . 2 . . . . 30 ASP HB2 . 11129 1 316 . 1 1 30 30 ASP HB3 H 1 2.429 0.030 . 2 . . . . 30 ASP HB3 . 11129 1 317 . 1 1 30 30 ASP CA C 13 48.728 0.300 . 1 . . . . 30 ASP CA . 11129 1 318 . 1 1 30 30 ASP CB C 13 39.302 0.300 . 1 . . . . 30 ASP CB . 11129 1 319 . 1 1 31 31 PRO HA H 1 4.085 0.030 . 1 . . . . 31 PRO HA . 11129 1 320 . 1 1 31 31 PRO HB2 H 1 2.131 0.030 . 2 . . . . 31 PRO HB2 . 11129 1 321 . 1 1 31 31 PRO HB3 H 1 1.724 0.030 . 2 . . . . 31 PRO HB3 . 11129 1 322 . 1 1 31 31 PRO HD2 H 1 3.488 0.030 . 2 . . . . 31 PRO HD2 . 11129 1 323 . 1 1 31 31 PRO HD3 H 1 3.914 0.030 . 2 . . . . 31 PRO HD3 . 11129 1 324 . 1 1 31 31 PRO HG2 H 1 1.920 0.030 . 2 . . . . 31 PRO HG2 . 11129 1 325 . 1 1 31 31 PRO HG3 H 1 2.059 0.030 . 2 . . . . 31 PRO HG3 . 11129 1 326 . 1 1 31 31 PRO C C 13 175.080 0.300 . 1 . . . . 31 PRO C . 11129 1 327 . 1 1 31 31 PRO CA C 13 62.987 0.300 . 1 . . . . 31 PRO CA . 11129 1 328 . 1 1 31 31 PRO CB C 13 29.568 0.300 . 1 . . . . 31 PRO CB . 11129 1 329 . 1 1 31 31 PRO CD C 13 48.401 0.300 . 1 . . . . 31 PRO CD . 11129 1 330 . 1 1 31 31 PRO CG C 13 25.087 0.300 . 1 . . . . 31 PRO CG . 11129 1 331 . 1 1 32 32 GLU H H 1 8.100 0.030 . 1 . . . . 32 GLU H . 11129 1 332 . 1 1 32 32 GLU HA H 1 3.619 0.030 . 1 . . . . 32 GLU HA . 11129 1 333 . 1 1 32 32 GLU HB2 H 1 2.044 0.030 . 2 . . . . 32 GLU HB2 . 11129 1 334 . 1 1 32 32 GLU HB3 H 1 1.985 0.030 . 2 . . . . 32 GLU HB3 . 11129 1 335 . 1 1 32 32 GLU HG2 H 1 1.709 0.030 . 2 . . . . 32 GLU HG2 . 11129 1 336 . 1 1 32 32 GLU HG3 H 1 1.966 0.030 . 2 . . . . 32 GLU HG3 . 11129 1 337 . 1 1 32 32 GLU C C 13 174.891 0.300 . 1 . . . . 32 GLU C . 11129 1 338 . 1 1 32 32 GLU CA C 13 58.314 0.300 . 1 . . . . 32 GLU CA . 11129 1 339 . 1 1 32 32 GLU CB C 13 27.105 0.300 . 1 . . . . 32 GLU CB . 11129 1 340 . 1 1 32 32 GLU CG C 13 34.172 0.300 . 1 . . . . 32 GLU CG . 11129 1 341 . 1 1 32 32 GLU N N 15 118.558 0.300 . 1 . . . . 32 GLU N . 11129 1 342 . 1 1 33 33 GLU H H 1 7.486 0.030 . 1 . . . . 33 GLU H . 11129 1 343 . 1 1 33 33 GLU HA H 1 3.666 0.030 . 1 . . . . 33 GLU HA . 11129 1 344 . 1 1 33 33 GLU HB2 H 1 1.892 0.030 . 2 . . . . 33 GLU HB2 . 11129 1 345 . 1 1 33 33 GLU HB3 H 1 1.860 0.030 . 2 . . . . 33 GLU HB3 . 11129 1 346 . 1 1 33 33 GLU HG2 H 1 2.191 0.030 . 2 . . . . 33 GLU HG2 . 11129 1 347 . 1 1 33 33 GLU HG3 H 1 2.140 0.030 . 2 . . . . 33 GLU HG3 . 11129 1 348 . 1 1 33 33 GLU C C 13 176.698 0.300 . 1 . . . . 33 GLU C . 11129 1 349 . 1 1 33 33 GLU CA C 13 56.569 0.300 . 1 . . . . 33 GLU CA . 11129 1 350 . 1 1 33 33 GLU CB C 13 26.934 0.300 . 1 . . . . 33 GLU CB . 11129 1 351 . 1 1 33 33 GLU CG C 13 33.579 0.300 . 1 . . . . 33 GLU CG . 11129 1 352 . 1 1 33 33 GLU N N 15 119.099 0.300 . 1 . . . . 33 GLU N . 11129 1 353 . 1 1 34 34 PHE H H 1 8.114 0.030 . 1 . . . . 34 PHE H . 11129 1 354 . 1 1 34 34 PHE HA H 1 4.219 0.030 . 1 . . . . 34 PHE HA . 11129 1 355 . 1 1 34 34 PHE HB2 H 1 3.226 0.030 . 2 . . . . 34 PHE HB2 . 11129 1 356 . 1 1 34 34 PHE HB3 H 1 2.803 0.030 . 2 . . . . 34 PHE HB3 . 11129 1 357 . 1 1 34 34 PHE HD1 H 1 7.052 0.030 . 1 . . . . 34 PHE HD1 . 11129 1 358 . 1 1 34 34 PHE HD2 H 1 7.052 0.030 . 1 . . . . 34 PHE HD2 . 11129 1 359 . 1 1 34 34 PHE HE1 H 1 7.153 0.030 . 1 . . . . 34 PHE HE1 . 11129 1 360 . 1 1 34 34 PHE HE2 H 1 7.153 0.030 . 1 . . . . 34 PHE HE2 . 11129 1 361 . 1 1 34 34 PHE HZ H 1 7.228 0.030 . 1 . . . . 34 PHE HZ . 11129 1 362 . 1 1 34 34 PHE C C 13 176.600 0.300 . 1 . . . . 34 PHE C . 11129 1 363 . 1 1 34 34 PHE CA C 13 58.450 0.300 . 1 . . . . 34 PHE CA . 11129 1 364 . 1 1 34 34 PHE CB C 13 37.525 0.300 . 1 . . . . 34 PHE CB . 11129 1 365 . 1 1 34 34 PHE CD1 C 13 129.019 0.300 . 1 . . . . 34 PHE CD1 . 11129 1 366 . 1 1 34 34 PHE CD2 C 13 129.019 0.300 . 1 . . . . 34 PHE CD2 . 11129 1 367 . 1 1 34 34 PHE CE1 C 13 129.031 0.300 . 1 . . . . 34 PHE CE1 . 11129 1 368 . 1 1 34 34 PHE CE2 C 13 129.031 0.300 . 1 . . . . 34 PHE CE2 . 11129 1 369 . 1 1 34 34 PHE CZ C 13 127.566 0.300 . 1 . . . . 34 PHE CZ . 11129 1 370 . 1 1 34 34 PHE N N 15 118.816 0.300 . 1 . . . . 34 PHE N . 11129 1 371 . 1 1 35 35 LEU H H 1 8.357 0.030 . 1 . . . . 35 LEU H . 11129 1 372 . 1 1 35 35 LEU HA H 1 3.566 0.030 . 1 . . . . 35 LEU HA . 11129 1 373 . 1 1 35 35 LEU HB2 H 1 1.897 0.030 . 2 . . . . 35 LEU HB2 . 11129 1 374 . 1 1 35 35 LEU HB3 H 1 1.290 0.030 . 2 . . . . 35 LEU HB3 . 11129 1 375 . 1 1 35 35 LEU HD11 H 1 0.900 0.030 . 1 . . . . 35 LEU HD1 . 11129 1 376 . 1 1 35 35 LEU HD12 H 1 0.900 0.030 . 1 . . . . 35 LEU HD1 . 11129 1 377 . 1 1 35 35 LEU HD13 H 1 0.900 0.030 . 1 . . . . 35 LEU HD1 . 11129 1 378 . 1 1 35 35 LEU HD21 H 1 0.718 0.030 . 1 . . . . 35 LEU HD2 . 11129 1 379 . 1 1 35 35 LEU HD22 H 1 0.718 0.030 . 1 . . . . 35 LEU HD2 . 11129 1 380 . 1 1 35 35 LEU HD23 H 1 0.718 0.030 . 1 . . . . 35 LEU HD2 . 11129 1 381 . 1 1 35 35 LEU HG H 1 1.825 0.030 . 1 . . . . 35 LEU HG . 11129 1 382 . 1 1 35 35 LEU C C 13 175.411 0.300 . 1 . . . . 35 LEU C . 11129 1 383 . 1 1 35 35 LEU CA C 13 55.546 0.300 . 1 . . . . 35 LEU CA . 11129 1 384 . 1 1 35 35 LEU CB C 13 40.256 0.300 . 1 . . . . 35 LEU CB . 11129 1 385 . 1 1 35 35 LEU CD1 C 13 23.321 0.300 . 2 . . . . 35 LEU CD1 . 11129 1 386 . 1 1 35 35 LEU CD2 C 13 21.250 0.300 . 2 . . . . 35 LEU CD2 . 11129 1 387 . 1 1 35 35 LEU CG C 13 24.348 0.300 . 1 . . . . 35 LEU CG . 11129 1 388 . 1 1 35 35 LEU N N 15 121.895 0.300 . 1 . . . . 35 LEU N . 11129 1 389 . 1 1 36 36 LYS H H 1 8.100 0.030 . 1 . . . . 36 LYS H . 11129 1 390 . 1 1 36 36 LYS HA H 1 3.178 0.030 . 1 . . . . 36 LYS HA . 11129 1 391 . 1 1 36 36 LYS HB2 H 1 1.275 0.030 . 2 . . . . 36 LYS HB2 . 11129 1 392 . 1 1 36 36 LYS HB3 H 1 1.350 0.030 . 2 . . . . 36 LYS HB3 . 11129 1 393 . 1 1 36 36 LYS HD2 H 1 1.248 0.030 . 2 . . . . 36 LYS HD2 . 11129 1 394 . 1 1 36 36 LYS HD3 H 1 1.205 0.030 . 2 . . . . 36 LYS HD3 . 11129 1 395 . 1 1 36 36 LYS HE2 H 1 2.451 0.030 . 2 . . . . 36 LYS HE2 . 11129 1 396 . 1 1 36 36 LYS HE3 H 1 2.522 0.030 . 2 . . . . 36 LYS HE3 . 11129 1 397 . 1 1 36 36 LYS HG2 H 1 0.615 0.030 . 2 . . . . 36 LYS HG2 . 11129 1 398 . 1 1 36 36 LYS HG3 H 1 0.403 0.030 . 2 . . . . 36 LYS HG3 . 11129 1 399 . 1 1 36 36 LYS C C 13 176.837 0.300 . 1 . . . . 36 LYS C . 11129 1 400 . 1 1 36 36 LYS CA C 13 58.531 0.300 . 1 . . . . 36 LYS CA . 11129 1 401 . 1 1 36 36 LYS CB C 13 30.043 0.300 . 1 . . . . 36 LYS CB . 11129 1 402 . 1 1 36 36 LYS CD C 13 27.368 0.300 . 1 . . . . 36 LYS CD . 11129 1 403 . 1 1 36 36 LYS CE C 13 39.366 0.300 . 1 . . . . 36 LYS CE . 11129 1 404 . 1 1 36 36 LYS CG C 13 23.038 0.300 . 1 . . . . 36 LYS CG . 11129 1 405 . 1 1 36 36 LYS N N 15 118.893 0.300 . 1 . . . . 36 LYS N . 11129 1 406 . 1 1 37 37 SER H H 1 7.686 0.030 . 1 . . . . 37 SER H . 11129 1 407 . 1 1 37 37 SER HA H 1 4.014 0.030 . 1 . . . . 37 SER HA . 11129 1 408 . 1 1 37 37 SER HB2 H 1 3.744 0.030 . 1 . . . . 37 SER HB2 . 11129 1 409 . 1 1 37 37 SER HB3 H 1 3.744 0.030 . 1 . . . . 37 SER HB3 . 11129 1 410 . 1 1 37 37 SER C C 13 175.488 0.300 . 1 . . . . 37 SER C . 11129 1 411 . 1 1 37 37 SER CA C 13 58.455 0.300 . 1 . . . . 37 SER CA . 11129 1 412 . 1 1 37 37 SER CB C 13 60.500 0.300 . 1 . . . . 37 SER CB . 11129 1 413 . 1 1 37 37 SER N N 15 110.328 0.300 . 1 . . . . 37 SER N . 11129 1 414 . 1 1 38 38 SER H H 1 8.040 0.030 . 1 . . . . 38 SER H . 11129 1 415 . 1 1 38 38 SER HA H 1 3.992 0.030 . 1 . . . . 38 SER HA . 11129 1 416 . 1 1 38 38 SER HB2 H 1 3.327 0.030 . 1 . . . . 38 SER HB2 . 11129 1 417 . 1 1 38 38 SER HB3 H 1 3.327 0.030 . 1 . . . . 38 SER HB3 . 11129 1 418 . 1 1 38 38 SER C C 13 173.353 0.300 . 1 . . . . 38 SER C . 11129 1 419 . 1 1 38 38 SER CA C 13 59.254 0.300 . 1 . . . . 38 SER CA . 11129 1 420 . 1 1 38 38 SER CB C 13 60.723 0.300 . 1 . . . . 38 SER CB . 11129 1 421 . 1 1 38 38 SER N N 15 116.321 0.300 . 1 . . . . 38 SER N . 11129 1 422 . 1 1 39 39 LEU H H 1 7.857 0.030 . 1 . . . . 39 LEU H . 11129 1 423 . 1 1 39 39 LEU HA H 1 4.455 0.030 . 1 . . . . 39 LEU HA . 11129 1 424 . 1 1 39 39 LEU HB2 H 1 1.726 0.030 . 2 . . . . 39 LEU HB2 . 11129 1 425 . 1 1 39 39 LEU HB3 H 1 1.315 0.030 . 2 . . . . 39 LEU HB3 . 11129 1 426 . 1 1 39 39 LEU HD11 H 1 0.584 0.030 . 1 . . . . 39 LEU HD1 . 11129 1 427 . 1 1 39 39 LEU HD12 H 1 0.584 0.030 . 1 . . . . 39 LEU HD1 . 11129 1 428 . 1 1 39 39 LEU HD13 H 1 0.584 0.030 . 1 . . . . 39 LEU HD1 . 11129 1 429 . 1 1 39 39 LEU HD21 H 1 0.449 0.030 . 1 . . . . 39 LEU HD2 . 11129 1 430 . 1 1 39 39 LEU HD22 H 1 0.449 0.030 . 1 . . . . 39 LEU HD2 . 11129 1 431 . 1 1 39 39 LEU HD23 H 1 0.449 0.030 . 1 . . . . 39 LEU HD2 . 11129 1 432 . 1 1 39 39 LEU HG H 1 1.838 0.030 . 1 . . . . 39 LEU HG . 11129 1 433 . 1 1 39 39 LEU C C 13 175.369 0.300 . 1 . . . . 39 LEU C . 11129 1 434 . 1 1 39 39 LEU CA C 13 52.029 0.300 . 1 . . . . 39 LEU CA . 11129 1 435 . 1 1 39 39 LEU CB C 13 40.694 0.300 . 1 . . . . 39 LEU CB . 11129 1 436 . 1 1 39 39 LEU CD1 C 13 23.726 0.300 . 2 . . . . 39 LEU CD1 . 11129 1 437 . 1 1 39 39 LEU CD2 C 13 19.487 0.300 . 2 . . . . 39 LEU CD2 . 11129 1 438 . 1 1 39 39 LEU CG C 13 24.152 0.300 . 1 . . . . 39 LEU CG . 11129 1 439 . 1 1 39 39 LEU N N 15 116.023 0.300 . 1 . . . . 39 LEU N . 11129 1 440 . 1 1 40 40 LYS H H 1 6.677 0.030 . 1 . . . . 40 LYS H . 11129 1 441 . 1 1 40 40 LYS HA H 1 3.492 0.030 . 1 . . . . 40 LYS HA . 11129 1 442 . 1 1 40 40 LYS HB2 H 1 2.065 0.030 . 2 . . . . 40 LYS HB2 . 11129 1 443 . 1 1 40 40 LYS HB3 H 1 1.621 0.030 . 2 . . . . 40 LYS HB3 . 11129 1 444 . 1 1 40 40 LYS HD2 H 1 1.377 0.030 . 2 . . . . 40 LYS HD2 . 11129 1 445 . 1 1 40 40 LYS HD3 H 1 1.454 0.030 . 2 . . . . 40 LYS HD3 . 11129 1 446 . 1 1 40 40 LYS HE2 H 1 2.416 0.030 . 2 . . . . 40 LYS HE2 . 11129 1 447 . 1 1 40 40 LYS HE3 H 1 2.587 0.030 . 2 . . . . 40 LYS HE3 . 11129 1 448 . 1 1 40 40 LYS HG2 H 1 1.290 0.030 . 2 . . . . 40 LYS HG2 . 11129 1 449 . 1 1 40 40 LYS HG3 H 1 1.151 0.030 . 2 . . . . 40 LYS HG3 . 11129 1 450 . 1 1 40 40 LYS C C 13 171.201 0.300 . 1 . . . . 40 LYS C . 11129 1 451 . 1 1 40 40 LYS CA C 13 58.973 0.300 . 1 . . . . 40 LYS CA . 11129 1 452 . 1 1 40 40 LYS CB C 13 31.243 0.300 . 1 . . . . 40 LYS CB . 11129 1 453 . 1 1 40 40 LYS CD C 13 27.427 0.300 . 1 . . . . 40 LYS CD . 11129 1 454 . 1 1 40 40 LYS CE C 13 39.529 0.300 . 1 . . . . 40 LYS CE . 11129 1 455 . 1 1 40 40 LYS CG C 13 22.534 0.300 . 1 . . . . 40 LYS CG . 11129 1 456 . 1 1 40 40 LYS N N 15 120.836 0.300 . 1 . . . . 40 LYS N . 11129 1 457 . 1 1 41 41 ASN H H 1 7.951 0.030 . 1 . . . . 41 ASN H . 11129 1 458 . 1 1 41 41 ASN HA H 1 4.590 0.030 . 1 . . . . 41 ASN HA . 11129 1 459 . 1 1 41 41 ASN HB2 H 1 3.668 0.030 . 2 . . . . 41 ASN HB2 . 11129 1 460 . 1 1 41 41 ASN HB3 H 1 2.833 0.030 . 2 . . . . 41 ASN HB3 . 11129 1 461 . 1 1 41 41 ASN HD21 H 1 7.197 0.030 . 2 . . . . 41 ASN HD21 . 11129 1 462 . 1 1 41 41 ASN HD22 H 1 7.869 0.030 . 2 . . . . 41 ASN HD22 . 11129 1 463 . 1 1 41 41 ASN C C 13 174.886 0.300 . 1 . . . . 41 ASN C . 11129 1 464 . 1 1 41 41 ASN CA C 13 49.705 0.300 . 1 . . . . 41 ASN CA . 11129 1 465 . 1 1 41 41 ASN CB C 13 36.540 0.300 . 1 . . . . 41 ASN CB . 11129 1 466 . 1 1 41 41 ASN N N 15 107.793 0.300 . 1 . . . . 41 ASN N . 11129 1 467 . 1 1 41 41 ASN ND2 N 15 111.376 0.300 . 1 . . . . 41 ASN ND2 . 11129 1 468 . 1 1 42 42 GLY H H 1 7.715 0.030 . 1 . . . . 42 GLY H . 11129 1 469 . 1 1 42 42 GLY HA2 H 1 4.143 0.030 . 2 . . . . 42 GLY HA2 . 11129 1 470 . 1 1 42 42 GLY HA3 H 1 3.428 0.030 . 2 . . . . 42 GLY HA3 . 11129 1 471 . 1 1 42 42 GLY C C 13 171.499 0.300 . 1 . . . . 42 GLY C . 11129 1 472 . 1 1 42 42 GLY CA C 13 45.644 0.300 . 1 . . . . 42 GLY CA . 11129 1 473 . 1 1 42 42 GLY N N 15 103.286 0.300 . 1 . . . . 42 GLY N . 11129 1 474 . 1 1 43 43 VAL H H 1 7.795 0.030 . 1 . . . . 43 VAL H . 11129 1 475 . 1 1 43 43 VAL HA H 1 3.312 0.030 . 1 . . . . 43 VAL HA . 11129 1 476 . 1 1 43 43 VAL HB H 1 2.182 0.030 . 1 . . . . 43 VAL HB . 11129 1 477 . 1 1 43 43 VAL HG11 H 1 1.026 0.030 . 1 . . . . 43 VAL HG1 . 11129 1 478 . 1 1 43 43 VAL HG12 H 1 1.026 0.030 . 1 . . . . 43 VAL HG1 . 11129 1 479 . 1 1 43 43 VAL HG13 H 1 1.026 0.030 . 1 . . . . 43 VAL HG1 . 11129 1 480 . 1 1 43 43 VAL HG21 H 1 1.038 0.030 . 1 . . . . 43 VAL HG2 . 11129 1 481 . 1 1 43 43 VAL HG22 H 1 1.038 0.030 . 1 . . . . 43 VAL HG2 . 11129 1 482 . 1 1 43 43 VAL HG23 H 1 1.038 0.030 . 1 . . . . 43 VAL HG2 . 11129 1 483 . 1 1 43 43 VAL C C 13 175.106 0.300 . 1 . . . . 43 VAL C . 11129 1 484 . 1 1 43 43 VAL CA C 13 65.534 0.300 . 1 . . . . 43 VAL CA . 11129 1 485 . 1 1 43 43 VAL CB C 13 29.345 0.300 . 1 . . . . 43 VAL CB . 11129 1 486 . 1 1 43 43 VAL CG1 C 13 21.218 0.300 . 2 . . . . 43 VAL CG1 . 11129 1 487 . 1 1 43 43 VAL CG2 C 13 19.119 0.300 . 2 . . . . 43 VAL CG2 . 11129 1 488 . 1 1 43 43 VAL N N 15 121.525 0.300 . 1 . . . . 43 VAL N . 11129 1 489 . 1 1 44 44 VAL H H 1 8.603 0.030 . 1 . . . . 44 VAL H . 11129 1 490 . 1 1 44 44 VAL HA H 1 3.232 0.030 . 1 . . . . 44 VAL HA . 11129 1 491 . 1 1 44 44 VAL HB H 1 1.771 0.030 . 1 . . . . 44 VAL HB . 11129 1 492 . 1 1 44 44 VAL HG11 H 1 0.475 0.030 . 1 . . . . 44 VAL HG1 . 11129 1 493 . 1 1 44 44 VAL HG12 H 1 0.475 0.030 . 1 . . . . 44 VAL HG1 . 11129 1 494 . 1 1 44 44 VAL HG13 H 1 0.475 0.030 . 1 . . . . 44 VAL HG1 . 11129 1 495 . 1 1 44 44 VAL HG21 H 1 1.062 0.030 . 1 . . . . 44 VAL HG2 . 11129 1 496 . 1 1 44 44 VAL HG22 H 1 1.062 0.030 . 1 . . . . 44 VAL HG2 . 11129 1 497 . 1 1 44 44 VAL HG23 H 1 1.062 0.030 . 1 . . . . 44 VAL HG2 . 11129 1 498 . 1 1 44 44 VAL C C 13 175.221 0.300 . 1 . . . . 44 VAL C . 11129 1 499 . 1 1 44 44 VAL CA C 13 64.470 0.300 . 1 . . . . 44 VAL CA . 11129 1 500 . 1 1 44 44 VAL CB C 13 28.922 0.300 . 1 . . . . 44 VAL CB . 11129 1 501 . 1 1 44 44 VAL CG1 C 13 19.062 0.300 . 2 . . . . 44 VAL CG1 . 11129 1 502 . 1 1 44 44 VAL CG2 C 13 20.896 0.300 . 2 . . . . 44 VAL CG2 . 11129 1 503 . 1 1 44 44 VAL N N 15 118.141 0.300 . 1 . . . . 44 VAL N . 11129 1 504 . 1 1 45 45 LEU H H 1 7.978 0.030 . 1 . . . . 45 LEU H . 11129 1 505 . 1 1 45 45 LEU HA H 1 3.452 0.030 . 1 . . . . 45 LEU HA . 11129 1 506 . 1 1 45 45 LEU HB2 H 1 1.189 0.030 . 2 . . . . 45 LEU HB2 . 11129 1 507 . 1 1 45 45 LEU HB3 H 1 0.271 0.030 . 2 . . . . 45 LEU HB3 . 11129 1 508 . 1 1 45 45 LEU HD11 H 1 0.454 0.030 . 1 . . . . 45 LEU HD1 . 11129 1 509 . 1 1 45 45 LEU HD12 H 1 0.454 0.030 . 1 . . . . 45 LEU HD1 . 11129 1 510 . 1 1 45 45 LEU HD13 H 1 0.454 0.030 . 1 . . . . 45 LEU HD1 . 11129 1 511 . 1 1 45 45 LEU HD21 H 1 0.043 0.030 . 1 . . . . 45 LEU HD2 . 11129 1 512 . 1 1 45 45 LEU HD22 H 1 0.043 0.030 . 1 . . . . 45 LEU HD2 . 11129 1 513 . 1 1 45 45 LEU HD23 H 1 0.043 0.030 . 1 . . . . 45 LEU HD2 . 11129 1 514 . 1 1 45 45 LEU HG H 1 1.524 0.030 . 1 . . . . 45 LEU HG . 11129 1 515 . 1 1 45 45 LEU C C 13 176.094 0.300 . 1 . . . . 45 LEU C . 11129 1 516 . 1 1 45 45 LEU CA C 13 55.062 0.300 . 1 . . . . 45 LEU CA . 11129 1 517 . 1 1 45 45 LEU CB C 13 36.371 0.300 . 1 . . . . 45 LEU CB . 11129 1 518 . 1 1 45 45 LEU CD1 C 13 23.949 0.300 . 2 . . . . 45 LEU CD1 . 11129 1 519 . 1 1 45 45 LEU CD2 C 13 19.916 0.300 . 2 . . . . 45 LEU CD2 . 11129 1 520 . 1 1 45 45 LEU CG C 13 23.324 0.300 . 1 . . . . 45 LEU CG . 11129 1 521 . 1 1 45 45 LEU N N 15 116.147 0.300 . 1 . . . . 45 LEU N . 11129 1 522 . 1 1 46 46 CYS H H 1 7.400 0.030 . 1 . . . . 46 CYS H . 11129 1 523 . 1 1 46 46 CYS HA H 1 3.815 0.030 . 1 . . . . 46 CYS HA . 11129 1 524 . 1 1 46 46 CYS HB2 H 1 1.864 0.030 . 2 . . . . 46 CYS HB2 . 11129 1 525 . 1 1 46 46 CYS HB3 H 1 0.620 0.030 . 2 . . . . 46 CYS HB3 . 11129 1 526 . 1 1 46 46 CYS C C 13 174.121 0.300 . 1 . . . . 46 CYS C . 11129 1 527 . 1 1 46 46 CYS CA C 13 63.365 0.300 . 1 . . . . 46 CYS CA . 11129 1 528 . 1 1 46 46 CYS CB C 13 22.933 0.300 . 1 . . . . 46 CYS CB . 11129 1 529 . 1 1 46 46 CYS N N 15 118.110 0.300 . 1 . . . . 46 CYS N . 11129 1 530 . 1 1 47 47 LYS H H 1 7.971 0.030 . 1 . . . . 47 LYS H . 11129 1 531 . 1 1 47 47 LYS HA H 1 3.802 0.030 . 1 . . . . 47 LYS HA . 11129 1 532 . 1 1 47 47 LYS HB2 H 1 1.863 0.030 . 2 . . . . 47 LYS HB2 . 11129 1 533 . 1 1 47 47 LYS HB3 H 1 1.597 0.030 . 2 . . . . 47 LYS HB3 . 11129 1 534 . 1 1 47 47 LYS HD2 H 1 1.607 0.030 . 1 . . . . 47 LYS HD2 . 11129 1 535 . 1 1 47 47 LYS HD3 H 1 1.607 0.030 . 1 . . . . 47 LYS HD3 . 11129 1 536 . 1 1 47 47 LYS HE2 H 1 2.781 0.030 . 2 . . . . 47 LYS HE2 . 11129 1 537 . 1 1 47 47 LYS HE3 H 1 2.880 0.030 . 2 . . . . 47 LYS HE3 . 11129 1 538 . 1 1 47 47 LYS HG2 H 1 1.400 0.030 . 2 . . . . 47 LYS HG2 . 11129 1 539 . 1 1 47 47 LYS HG3 H 1 1.685 0.030 . 2 . . . . 47 LYS HG3 . 11129 1 540 . 1 1 47 47 LYS C C 13 177.697 0.300 . 1 . . . . 47 LYS C . 11129 1 541 . 1 1 47 47 LYS CA C 13 57.682 0.300 . 1 . . . . 47 LYS CA . 11129 1 542 . 1 1 47 47 LYS CB C 13 30.080 0.300 . 1 . . . . 47 LYS CB . 11129 1 543 . 1 1 47 47 LYS CD C 13 28.072 0.300 . 1 . . . . 47 LYS CD . 11129 1 544 . 1 1 47 47 LYS CE C 13 39.682 0.300 . 1 . . . . 47 LYS CE . 11129 1 545 . 1 1 47 47 LYS CG C 13 24.034 0.300 . 1 . . . . 47 LYS CG . 11129 1 546 . 1 1 47 47 LYS N N 15 117.759 0.300 . 1 . . . . 47 LYS N . 11129 1 547 . 1 1 48 48 LEU H H 1 8.753 0.030 . 1 . . . . 48 LEU H . 11129 1 548 . 1 1 48 48 LEU HA H 1 3.653 0.030 . 1 . . . . 48 LEU HA . 11129 1 549 . 1 1 48 48 LEU HB2 H 1 2.221 0.030 . 2 . . . . 48 LEU HB2 . 11129 1 550 . 1 1 48 48 LEU HB3 H 1 1.041 0.030 . 2 . . . . 48 LEU HB3 . 11129 1 551 . 1 1 48 48 LEU HD11 H 1 0.118 0.030 . 1 . . . . 48 LEU HD1 . 11129 1 552 . 1 1 48 48 LEU HD12 H 1 0.118 0.030 . 1 . . . . 48 LEU HD1 . 11129 1 553 . 1 1 48 48 LEU HD13 H 1 0.118 0.030 . 1 . . . . 48 LEU HD1 . 11129 1 554 . 1 1 48 48 LEU HD21 H 1 0.616 0.030 . 1 . . . . 48 LEU HD2 . 11129 1 555 . 1 1 48 48 LEU HD22 H 1 0.616 0.030 . 1 . . . . 48 LEU HD2 . 11129 1 556 . 1 1 48 48 LEU HD23 H 1 0.616 0.030 . 1 . . . . 48 LEU HD2 . 11129 1 557 . 1 1 48 48 LEU HG H 1 1.138 0.030 . 1 . . . . 48 LEU HG . 11129 1 558 . 1 1 48 48 LEU C C 13 175.584 0.300 . 1 . . . . 48 LEU C . 11129 1 559 . 1 1 48 48 LEU CA C 13 55.797 0.300 . 1 . . . . 48 LEU CA . 11129 1 560 . 1 1 48 48 LEU CB C 13 39.616 0.300 . 1 . . . . 48 LEU CB . 11129 1 561 . 1 1 48 48 LEU CD1 C 13 20.848 0.300 . 2 . . . . 48 LEU CD1 . 11129 1 562 . 1 1 48 48 LEU CD2 C 13 23.127 0.300 . 2 . . . . 48 LEU CD2 . 11129 1 563 . 1 1 48 48 LEU CG C 13 24.871 0.300 . 1 . . . . 48 LEU CG . 11129 1 564 . 1 1 48 48 LEU N N 15 119.980 0.300 . 1 . . . . 48 LEU N . 11129 1 565 . 1 1 49 49 ILE H H 1 8.197 0.030 . 1 . . . . 49 ILE H . 11129 1 566 . 1 1 49 49 ILE HA H 1 4.059 0.030 . 1 . . . . 49 ILE HA . 11129 1 567 . 1 1 49 49 ILE HB H 1 1.865 0.030 . 1 . . . . 49 ILE HB . 11129 1 568 . 1 1 49 49 ILE HD11 H 1 0.705 0.030 . 1 . . . . 49 ILE HD1 . 11129 1 569 . 1 1 49 49 ILE HD12 H 1 0.705 0.030 . 1 . . . . 49 ILE HD1 . 11129 1 570 . 1 1 49 49 ILE HD13 H 1 0.705 0.030 . 1 . . . . 49 ILE HD1 . 11129 1 571 . 1 1 49 49 ILE HG12 H 1 1.506 0.030 . 2 . . . . 49 ILE HG12 . 11129 1 572 . 1 1 49 49 ILE HG13 H 1 1.201 0.030 . 2 . . . . 49 ILE HG13 . 11129 1 573 . 1 1 49 49 ILE HG21 H 1 1.131 0.030 . 1 . . . . 49 ILE HG2 . 11129 1 574 . 1 1 49 49 ILE HG22 H 1 1.131 0.030 . 1 . . . . 49 ILE HG2 . 11129 1 575 . 1 1 49 49 ILE HG23 H 1 1.131 0.030 . 1 . . . . 49 ILE HG2 . 11129 1 576 . 1 1 49 49 ILE C C 13 173.966 0.300 . 1 . . . . 49 ILE C . 11129 1 577 . 1 1 49 49 ILE CA C 13 59.250 0.300 . 1 . . . . 49 ILE CA . 11129 1 578 . 1 1 49 49 ILE CB C 13 36.397 0.300 . 1 . . . . 49 ILE CB . 11129 1 579 . 1 1 49 49 ILE CD1 C 13 11.477 0.300 . 1 . . . . 49 ILE CD1 . 11129 1 580 . 1 1 49 49 ILE CG1 C 13 27.109 0.300 . 1 . . . . 49 ILE CG1 . 11129 1 581 . 1 1 49 49 ILE CG2 C 13 17.943 0.300 . 1 . . . . 49 ILE CG2 . 11129 1 582 . 1 1 49 49 ILE N N 15 118.330 0.300 . 1 . . . . 49 ILE N . 11129 1 583 . 1 1 50 50 ASN H H 1 7.281 0.030 . 1 . . . . 50 ASN H . 11129 1 584 . 1 1 50 50 ASN HA H 1 4.771 0.030 . 1 . . . . 50 ASN HA . 11129 1 585 . 1 1 50 50 ASN HB2 H 1 2.675 0.030 . 2 . . . . 50 ASN HB2 . 11129 1 586 . 1 1 50 50 ASN HB3 H 1 2.619 0.030 . 2 . . . . 50 ASN HB3 . 11129 1 587 . 1 1 50 50 ASN HD21 H 1 7.022 0.030 . 2 . . . . 50 ASN HD21 . 11129 1 588 . 1 1 50 50 ASN HD22 H 1 7.546 0.030 . 2 . . . . 50 ASN HD22 . 11129 1 589 . 1 1 50 50 ASN C C 13 175.067 0.300 . 1 . . . . 50 ASN C . 11129 1 590 . 1 1 50 50 ASN CA C 13 52.252 0.300 . 1 . . . . 50 ASN CA . 11129 1 591 . 1 1 50 50 ASN CB C 13 36.397 0.300 . 1 . . . . 50 ASN CB . 11129 1 592 . 1 1 50 50 ASN N N 15 119.668 0.300 . 1 . . . . 50 ASN N . 11129 1 593 . 1 1 50 50 ASN ND2 N 15 109.364 0.300 . 1 . . . . 50 ASN ND2 . 11129 1 594 . 1 1 51 51 ARG H H 1 7.678 0.030 . 1 . . . . 51 ARG H . 11129 1 595 . 1 1 51 51 ARG HA H 1 4.118 0.030 . 1 . . . . 51 ARG HA . 11129 1 596 . 1 1 51 51 ARG HB2 H 1 2.021 0.030 . 2 . . . . 51 ARG HB2 . 11129 1 597 . 1 1 51 51 ARG HB3 H 1 1.761 0.030 . 2 . . . . 51 ARG HB3 . 11129 1 598 . 1 1 51 51 ARG HD2 H 1 3.080 0.030 . 2 . . . . 51 ARG HD2 . 11129 1 599 . 1 1 51 51 ARG HD3 H 1 3.267 0.030 . 2 . . . . 51 ARG HD3 . 11129 1 600 . 1 1 51 51 ARG HG2 H 1 1.566 0.030 . 2 . . . . 51 ARG HG2 . 11129 1 601 . 1 1 51 51 ARG HG3 H 1 1.424 0.030 . 2 . . . . 51 ARG HG3 . 11129 1 602 . 1 1 51 51 ARG C C 13 175.670 0.300 . 1 . . . . 51 ARG C . 11129 1 603 . 1 1 51 51 ARG CA C 13 54.539 0.300 . 1 . . . . 51 ARG CA . 11129 1 604 . 1 1 51 51 ARG CB C 13 26.917 0.300 . 1 . . . . 51 ARG CB . 11129 1 605 . 1 1 51 51 ARG CD C 13 39.853 0.300 . 1 . . . . 51 ARG CD . 11129 1 606 . 1 1 51 51 ARG CG C 13 25.262 0.300 . 1 . . . . 51 ARG CG . 11129 1 607 . 1 1 51 51 ARG N N 15 119.930 0.300 . 1 . . . . 51 ARG N . 11129 1 608 . 1 1 52 52 LEU H H 1 7.737 0.030 . 1 . . . . 52 LEU H . 11129 1 609 . 1 1 52 52 LEU HA H 1 4.163 0.030 . 1 . . . . 52 LEU HA . 11129 1 610 . 1 1 52 52 LEU HB2 H 1 1.727 0.030 . 2 . . . . 52 LEU HB2 . 11129 1 611 . 1 1 52 52 LEU HB3 H 1 1.493 0.030 . 2 . . . . 52 LEU HB3 . 11129 1 612 . 1 1 52 52 LEU HD11 H 1 0.856 0.030 . 1 . . . . 52 LEU HD1 . 11129 1 613 . 1 1 52 52 LEU HD12 H 1 0.856 0.030 . 1 . . . . 52 LEU HD1 . 11129 1 614 . 1 1 52 52 LEU HD13 H 1 0.856 0.030 . 1 . . . . 52 LEU HD1 . 11129 1 615 . 1 1 52 52 LEU HD21 H 1 0.914 0.030 . 1 . . . . 52 LEU HD2 . 11129 1 616 . 1 1 52 52 LEU HD22 H 1 0.914 0.030 . 1 . . . . 52 LEU HD2 . 11129 1 617 . 1 1 52 52 LEU HD23 H 1 0.914 0.030 . 1 . . . . 52 LEU HD2 . 11129 1 618 . 1 1 52 52 LEU HG H 1 1.842 0.030 . 1 . . . . 52 LEU HG . 11129 1 619 . 1 1 52 52 LEU C C 13 175.495 0.300 . 1 . . . . 52 LEU C . 11129 1 620 . 1 1 52 52 LEU CA C 13 54.321 0.300 . 1 . . . . 52 LEU CA . 11129 1 621 . 1 1 52 52 LEU CB C 13 40.708 0.300 . 1 . . . . 52 LEU CB . 11129 1 622 . 1 1 52 52 LEU CD1 C 13 23.772 0.300 . 2 . . . . 52 LEU CD1 . 11129 1 623 . 1 1 52 52 LEU CD2 C 13 19.371 0.300 . 2 . . . . 52 LEU CD2 . 11129 1 624 . 1 1 52 52 LEU CG C 13 23.941 0.300 . 1 . . . . 52 LEU CG . 11129 1 625 . 1 1 52 52 LEU N N 15 117.204 0.300 . 1 . . . . 52 LEU N . 11129 1 626 . 1 1 53 53 MET H H 1 8.479 0.030 . 1 . . . . 53 MET H . 11129 1 627 . 1 1 53 53 MET HA H 1 4.711 0.030 . 1 . . . . 53 MET HA . 11129 1 628 . 1 1 53 53 MET HB2 H 1 1.952 0.030 . 2 . . . . 53 MET HB2 . 11129 1 629 . 1 1 53 53 MET HB3 H 1 1.833 0.030 . 2 . . . . 53 MET HB3 . 11129 1 630 . 1 1 53 53 MET HE1 H 1 1.893 0.030 . 1 . . . . 53 MET HE . 11129 1 631 . 1 1 53 53 MET HE2 H 1 1.893 0.030 . 1 . . . . 53 MET HE . 11129 1 632 . 1 1 53 53 MET HE3 H 1 1.893 0.030 . 1 . . . . 53 MET HE . 11129 1 633 . 1 1 53 53 MET HG2 H 1 2.212 0.030 . 2 . . . . 53 MET HG2 . 11129 1 634 . 1 1 53 53 MET HG3 H 1 2.351 0.030 . 2 . . . . 53 MET HG3 . 11129 1 635 . 1 1 53 53 MET C C 13 169.047 0.300 . 1 . . . . 53 MET C . 11129 1 636 . 1 1 53 53 MET CA C 13 50.466 0.300 . 1 . . . . 53 MET CA . 11129 1 637 . 1 1 53 53 MET CB C 13 31.205 0.300 . 1 . . . . 53 MET CB . 11129 1 638 . 1 1 53 53 MET CE C 13 14.424 0.300 . 1 . . . . 53 MET CE . 11129 1 639 . 1 1 53 53 MET CG C 13 29.232 0.300 . 1 . . . . 53 MET CG . 11129 1 640 . 1 1 53 53 MET N N 15 118.126 0.300 . 1 . . . . 53 MET N . 11129 1 641 . 1 1 54 54 PRO HA H 1 4.633 0.030 . 1 . . . . 54 PRO HA . 11129 1 642 . 1 1 54 54 PRO HB2 H 1 2.208 0.030 . 2 . . . . 54 PRO HB2 . 11129 1 643 . 1 1 54 54 PRO HB3 H 1 1.760 0.030 . 2 . . . . 54 PRO HB3 . 11129 1 644 . 1 1 54 54 PRO HD2 H 1 3.517 0.030 . 2 . . . . 54 PRO HD2 . 11129 1 645 . 1 1 54 54 PRO HD3 H 1 3.303 0.030 . 2 . . . . 54 PRO HD3 . 11129 1 646 . 1 1 54 54 PRO HG2 H 1 1.933 0.030 . 2 . . . . 54 PRO HG2 . 11129 1 647 . 1 1 54 54 PRO HG3 H 1 2.009 0.030 . 2 . . . . 54 PRO HG3 . 11129 1 648 . 1 1 54 54 PRO C C 13 175.805 0.300 . 1 . . . . 54 PRO C . 11129 1 649 . 1 1 54 54 PRO CA C 13 62.139 0.300 . 1 . . . . 54 PRO CA . 11129 1 650 . 1 1 54 54 PRO CB C 13 29.303 0.300 . 1 . . . . 54 PRO CB . 11129 1 651 . 1 1 54 54 PRO CD C 13 47.642 0.300 . 1 . . . . 54 PRO CD . 11129 1 652 . 1 1 54 54 PRO CG C 13 25.036 0.300 . 1 . . . . 54 PRO CG . 11129 1 653 . 1 1 55 55 GLY H H 1 8.523 0.030 . 1 . . . . 55 GLY H . 11129 1 654 . 1 1 55 55 GLY HA2 H 1 4.078 0.030 . 2 . . . . 55 GLY HA2 . 11129 1 655 . 1 1 55 55 GLY HA3 H 1 3.577 0.030 . 2 . . . . 55 GLY HA3 . 11129 1 656 . 1 1 55 55 GLY C C 13 172.342 0.300 . 1 . . . . 55 GLY C . 11129 1 657 . 1 1 55 55 GLY CA C 13 42.690 0.300 . 1 . . . . 55 GLY CA . 11129 1 658 . 1 1 55 55 GLY N N 15 112.099 0.300 . 1 . . . . 55 GLY N . 11129 1 659 . 1 1 56 56 SER H H 1 8.069 0.030 . 1 . . . . 56 SER H . 11129 1 660 . 1 1 56 56 SER HA H 1 4.012 0.030 . 1 . . . . 56 SER HA . 11129 1 661 . 1 1 56 56 SER HB2 H 1 3.667 0.030 . 2 . . . . 56 SER HB2 . 11129 1 662 . 1 1 56 56 SER HB3 H 1 3.822 0.030 . 2 . . . . 56 SER HB3 . 11129 1 663 . 1 1 56 56 SER C C 13 172.649 0.300 . 1 . . . . 56 SER C . 11129 1 664 . 1 1 56 56 SER CA C 13 60.175 0.300 . 1 . . . . 56 SER CA . 11129 1 665 . 1 1 56 56 SER CB C 13 61.407 0.300 . 1 . . . . 56 SER CB . 11129 1 666 . 1 1 56 56 SER N N 15 117.276 0.300 . 1 . . . . 56 SER N . 11129 1 667 . 1 1 57 57 VAL H H 1 8.811 0.030 . 1 . . . . 57 VAL H . 11129 1 668 . 1 1 57 57 VAL HA H 1 4.143 0.030 . 1 . . . . 57 VAL HA . 11129 1 669 . 1 1 57 57 VAL HB H 1 1.805 0.030 . 1 . . . . 57 VAL HB . 11129 1 670 . 1 1 57 57 VAL HG11 H 1 0.822 0.030 . 1 . . . . 57 VAL HG1 . 11129 1 671 . 1 1 57 57 VAL HG12 H 1 0.822 0.030 . 1 . . . . 57 VAL HG1 . 11129 1 672 . 1 1 57 57 VAL HG13 H 1 0.822 0.030 . 1 . . . . 57 VAL HG1 . 11129 1 673 . 1 1 57 57 VAL HG21 H 1 0.648 0.030 . 1 . . . . 57 VAL HG2 . 11129 1 674 . 1 1 57 57 VAL HG22 H 1 0.648 0.030 . 1 . . . . 57 VAL HG2 . 11129 1 675 . 1 1 57 57 VAL HG23 H 1 0.648 0.030 . 1 . . . . 57 VAL HG2 . 11129 1 676 . 1 1 57 57 VAL C C 13 173.447 0.300 . 1 . . . . 57 VAL C . 11129 1 677 . 1 1 57 57 VAL CA C 13 59.143 0.300 . 1 . . . . 57 VAL CA . 11129 1 678 . 1 1 57 57 VAL CB C 13 30.808 0.300 . 1 . . . . 57 VAL CB . 11129 1 679 . 1 1 57 57 VAL CG1 C 13 20.744 0.300 . 2 . . . . 57 VAL CG1 . 11129 1 680 . 1 1 57 57 VAL CG2 C 13 19.248 0.300 . 2 . . . . 57 VAL CG2 . 11129 1 681 . 1 1 57 57 VAL N N 15 121.455 0.300 . 1 . . . . 57 VAL N . 11129 1 682 . 1 1 58 58 GLU H H 1 8.776 0.030 . 1 . . . . 58 GLU H . 11129 1 683 . 1 1 58 58 GLU HA H 1 3.950 0.030 . 1 . . . . 58 GLU HA . 11129 1 684 . 1 1 58 58 GLU HB2 H 1 1.920 0.030 . 1 . . . . 58 GLU HB2 . 11129 1 685 . 1 1 58 58 GLU HB3 H 1 1.920 0.030 . 1 . . . . 58 GLU HB3 . 11129 1 686 . 1 1 58 58 GLU HG2 H 1 2.210 0.030 . 2 . . . . 58 GLU HG2 . 11129 1 687 . 1 1 58 58 GLU HG3 H 1 2.084 0.030 . 2 . . . . 58 GLU HG3 . 11129 1 688 . 1 1 58 58 GLU C C 13 174.018 0.300 . 1 . . . . 58 GLU C . 11129 1 689 . 1 1 58 58 GLU CA C 13 56.656 0.300 . 1 . . . . 58 GLU CA . 11129 1 690 . 1 1 58 58 GLU CB C 13 28.144 0.300 . 1 . . . . 58 GLU CB . 11129 1 691 . 1 1 58 58 GLU CG C 13 34.042 0.300 . 1 . . . . 58 GLU CG . 11129 1 692 . 1 1 58 58 GLU N N 15 127.213 0.300 . 1 . . . . 58 GLU N . 11129 1 693 . 1 1 59 59 LYS H H 1 7.879 0.030 . 1 . . . . 59 LYS H . 11129 1 694 . 1 1 59 59 LYS HA H 1 4.403 0.030 . 1 . . . . 59 LYS HA . 11129 1 695 . 1 1 59 59 LYS HB2 H 1 1.675 0.030 . 2 . . . . 59 LYS HB2 . 11129 1 696 . 1 1 59 59 LYS HB3 H 1 1.601 0.030 . 2 . . . . 59 LYS HB3 . 11129 1 697 . 1 1 59 59 LYS HD2 H 1 1.524 0.030 . 1 . . . . 59 LYS HD2 . 11129 1 698 . 1 1 59 59 LYS HD3 H 1 1.524 0.030 . 1 . . . . 59 LYS HD3 . 11129 1 699 . 1 1 59 59 LYS HE2 H 1 2.831 0.030 . 1 . . . . 59 LYS HE2 . 11129 1 700 . 1 1 59 59 LYS HE3 H 1 2.831 0.030 . 1 . . . . 59 LYS HE3 . 11129 1 701 . 1 1 59 59 LYS HG2 H 1 1.223 0.030 . 2 . . . . 59 LYS HG2 . 11129 1 702 . 1 1 59 59 LYS HG3 H 1 1.183 0.030 . 2 . . . . 59 LYS HG3 . 11129 1 703 . 1 1 59 59 LYS C C 13 171.292 0.300 . 1 . . . . 59 LYS C . 11129 1 704 . 1 1 59 59 LYS CA C 13 53.098 0.300 . 1 . . . . 59 LYS CA . 11129 1 705 . 1 1 59 59 LYS CB C 13 31.897 0.300 . 1 . . . . 59 LYS CB . 11129 1 706 . 1 1 59 59 LYS CD C 13 26.918 0.300 . 1 . . . . 59 LYS CD . 11129 1 707 . 1 1 59 59 LYS CE C 13 39.778 0.300 . 1 . . . . 59 LYS CE . 11129 1 708 . 1 1 59 59 LYS CG C 13 21.964 0.300 . 1 . . . . 59 LYS CG . 11129 1 709 . 1 1 59 59 LYS N N 15 116.546 0.300 . 1 . . . . 59 LYS N . 11129 1 710 . 1 1 60 60 PHE H H 1 7.641 0.030 . 1 . . . . 60 PHE H . 11129 1 711 . 1 1 60 60 PHE HA H 1 4.980 0.030 . 1 . . . . 60 PHE HA . 11129 1 712 . 1 1 60 60 PHE HB2 H 1 3.199 0.030 . 2 . . . . 60 PHE HB2 . 11129 1 713 . 1 1 60 60 PHE HB3 H 1 3.006 0.030 . 2 . . . . 60 PHE HB3 . 11129 1 714 . 1 1 60 60 PHE HD1 H 1 6.751 0.030 . 1 . . . . 60 PHE HD1 . 11129 1 715 . 1 1 60 60 PHE HD2 H 1 6.751 0.030 . 1 . . . . 60 PHE HD2 . 11129 1 716 . 1 1 60 60 PHE HE1 H 1 7.079 0.030 . 1 . . . . 60 PHE HE1 . 11129 1 717 . 1 1 60 60 PHE HE2 H 1 7.079 0.030 . 1 . . . . 60 PHE HE2 . 11129 1 718 . 1 1 60 60 PHE HZ H 1 7.034 0.030 . 1 . . . . 60 PHE HZ . 11129 1 719 . 1 1 60 60 PHE C C 13 170.584 0.300 . 1 . . . . 60 PHE C . 11129 1 720 . 1 1 60 60 PHE CA C 13 53.553 0.300 . 1 . . . . 60 PHE CA . 11129 1 721 . 1 1 60 60 PHE CB C 13 36.261 0.300 . 1 . . . . 60 PHE CB . 11129 1 722 . 1 1 60 60 PHE CD1 C 13 130.352 0.300 . 1 . . . . 60 PHE CD1 . 11129 1 723 . 1 1 60 60 PHE CD2 C 13 130.352 0.300 . 1 . . . . 60 PHE CD2 . 11129 1 724 . 1 1 60 60 PHE CE1 C 13 128.710 0.300 . 1 . . . . 60 PHE CE1 . 11129 1 725 . 1 1 60 60 PHE CE2 C 13 128.710 0.300 . 1 . . . . 60 PHE CE2 . 11129 1 726 . 1 1 60 60 PHE CZ C 13 127.206 0.300 . 1 . . . . 60 PHE CZ . 11129 1 727 . 1 1 60 60 PHE N N 15 119.007 0.300 . 1 . . . . 60 PHE N . 11129 1 728 . 1 1 61 61 CYS H H 1 8.699 0.030 . 1 . . . . 61 CYS H . 11129 1 729 . 1 1 61 61 CYS HA H 1 4.337 0.030 . 1 . . . . 61 CYS HA . 11129 1 730 . 1 1 61 61 CYS HB2 H 1 2.939 0.030 . 2 . . . . 61 CYS HB2 . 11129 1 731 . 1 1 61 61 CYS HB3 H 1 2.693 0.030 . 2 . . . . 61 CYS HB3 . 11129 1 732 . 1 1 61 61 CYS C C 13 172.554 0.300 . 1 . . . . 61 CYS C . 11129 1 733 . 1 1 61 61 CYS CA C 13 56.558 0.300 . 1 . . . . 61 CYS CA . 11129 1 734 . 1 1 61 61 CYS CB C 13 24.267 0.300 . 1 . . . . 61 CYS CB . 11129 1 735 . 1 1 61 61 CYS N N 15 120.266 0.300 . 1 . . . . 61 CYS N . 11129 1 736 . 1 1 62 62 LEU H H 1 8.264 0.030 . 1 . . . . 62 LEU H . 11129 1 737 . 1 1 62 62 LEU HA H 1 3.935 0.030 . 1 . . . . 62 LEU HA . 11129 1 738 . 1 1 62 62 LEU HB2 H 1 1.412 0.030 . 1 . . . . 62 LEU HB2 . 11129 1 739 . 1 1 62 62 LEU HB3 H 1 1.412 0.030 . 1 . . . . 62 LEU HB3 . 11129 1 740 . 1 1 62 62 LEU HD11 H 1 0.677 0.030 . 1 . . . . 62 LEU HD1 . 11129 1 741 . 1 1 62 62 LEU HD12 H 1 0.677 0.030 . 1 . . . . 62 LEU HD1 . 11129 1 742 . 1 1 62 62 LEU HD13 H 1 0.677 0.030 . 1 . . . . 62 LEU HD1 . 11129 1 743 . 1 1 62 62 LEU HD21 H 1 0.545 0.030 . 1 . . . . 62 LEU HD2 . 11129 1 744 . 1 1 62 62 LEU HD22 H 1 0.545 0.030 . 1 . . . . 62 LEU HD2 . 11129 1 745 . 1 1 62 62 LEU HD23 H 1 0.545 0.030 . 1 . . . . 62 LEU HD2 . 11129 1 746 . 1 1 62 62 LEU HG H 1 1.285 0.030 . 1 . . . . 62 LEU HG . 11129 1 747 . 1 1 62 62 LEU C C 13 173.461 0.300 . 1 . . . . 62 LEU C . 11129 1 748 . 1 1 62 62 LEU CA C 13 54.833 0.300 . 1 . . . . 62 LEU CA . 11129 1 749 . 1 1 62 62 LEU CB C 13 40.012 0.300 . 1 . . . . 62 LEU CB . 11129 1 750 . 1 1 62 62 LEU CD1 C 13 22.293 0.300 . 2 . . . . 62 LEU CD1 . 11129 1 751 . 1 1 62 62 LEU CD2 C 13 21.736 0.300 . 2 . . . . 62 LEU CD2 . 11129 1 752 . 1 1 62 62 LEU CG C 13 25.153 0.300 . 1 . . . . 62 LEU CG . 11129 1 753 . 1 1 62 62 LEU N N 15 128.980 0.300 . 1 . . . . 62 LEU N . 11129 1 754 . 1 1 63 63 ASP H H 1 7.691 0.030 . 1 . . . . 63 ASP H . 11129 1 755 . 1 1 63 63 ASP HA H 1 4.897 0.030 . 1 . . . . 63 ASP HA . 11129 1 756 . 1 1 63 63 ASP HB2 H 1 2.207 0.030 . 2 . . . . 63 ASP HB2 . 11129 1 757 . 1 1 63 63 ASP HB3 H 1 2.540 0.030 . 2 . . . . 63 ASP HB3 . 11129 1 758 . 1 1 63 63 ASP C C 13 170.091 0.300 . 1 . . . . 63 ASP C . 11129 1 759 . 1 1 63 63 ASP CA C 13 48.795 0.300 . 1 . . . . 63 ASP CA . 11129 1 760 . 1 1 63 63 ASP CB C 13 38.586 0.300 . 1 . . . . 63 ASP CB . 11129 1 761 . 1 1 63 63 ASP N N 15 114.749 0.300 . 1 . . . . 63 ASP N . 11129 1 762 . 1 1 64 64 PRO HA H 1 4.443 0.030 . 1 . . . . 64 PRO HA . 11129 1 763 . 1 1 64 64 PRO HB2 H 1 2.251 0.030 . 2 . . . . 64 PRO HB2 . 11129 1 764 . 1 1 64 64 PRO HB3 H 1 1.990 0.030 . 2 . . . . 64 PRO HB3 . 11129 1 765 . 1 1 64 64 PRO HD2 H 1 3.418 0.030 . 2 . . . . 64 PRO HD2 . 11129 1 766 . 1 1 64 64 PRO HD3 H 1 3.492 0.030 . 2 . . . . 64 PRO HD3 . 11129 1 767 . 1 1 64 64 PRO HG2 H 1 1.822 0.030 . 2 . . . . 64 PRO HG2 . 11129 1 768 . 1 1 64 64 PRO HG3 H 1 2.308 0.030 . 2 . . . . 64 PRO HG3 . 11129 1 769 . 1 1 64 64 PRO C C 13 175.097 0.300 . 1 . . . . 64 PRO C . 11129 1 770 . 1 1 64 64 PRO CA C 13 61.639 0.300 . 1 . . . . 64 PRO CA . 11129 1 771 . 1 1 64 64 PRO CB C 13 31.439 0.300 . 1 . . . . 64 PRO CB . 11129 1 772 . 1 1 64 64 PRO CD C 13 47.635 0.300 . 1 . . . . 64 PRO CD . 11129 1 773 . 1 1 64 64 PRO CG C 13 26.562 0.300 . 1 . . . . 64 PRO CG . 11129 1 774 . 1 1 65 65 GLN H H 1 9.688 0.030 . 1 . . . . 65 GLN H . 11129 1 775 . 1 1 65 65 GLN HA H 1 4.369 0.030 . 1 . . . . 65 GLN HA . 11129 1 776 . 1 1 65 65 GLN HB2 H 1 2.297 0.030 . 2 . . . . 65 GLN HB2 . 11129 1 777 . 1 1 65 65 GLN HB3 H 1 1.834 0.030 . 2 . . . . 65 GLN HB3 . 11129 1 778 . 1 1 65 65 GLN HE21 H 1 6.567 0.030 . 2 . . . . 65 GLN HE21 . 11129 1 779 . 1 1 65 65 GLN HE22 H 1 7.088 0.030 . 2 . . . . 65 GLN HE22 . 11129 1 780 . 1 1 65 65 GLN HG2 H 1 2.344 0.030 . 1 . . . . 65 GLN HG2 . 11129 1 781 . 1 1 65 65 GLN HG3 H 1 2.344 0.030 . 1 . . . . 65 GLN HG3 . 11129 1 782 . 1 1 65 65 GLN C C 13 173.544 0.300 . 1 . . . . 65 GLN C . 11129 1 783 . 1 1 65 65 GLN CA C 13 53.093 0.300 . 1 . . . . 65 GLN CA . 11129 1 784 . 1 1 65 65 GLN CB C 13 29.181 0.300 . 1 . . . . 65 GLN CB . 11129 1 785 . 1 1 65 65 GLN CG C 13 31.034 0.300 . 1 . . . . 65 GLN CG . 11129 1 786 . 1 1 65 65 GLN N N 15 122.773 0.300 . 1 . . . . 65 GLN N . 11129 1 787 . 1 1 65 65 GLN NE2 N 15 114.328 0.300 . 1 . . . . 65 GLN NE2 . 11129 1 788 . 1 1 66 66 THR H H 1 7.595 0.030 . 1 . . . . 66 THR H . 11129 1 789 . 1 1 66 66 THR HA H 1 4.657 0.030 . 1 . . . . 66 THR HA . 11129 1 790 . 1 1 66 66 THR HB H 1 4.482 0.030 . 1 . . . . 66 THR HB . 11129 1 791 . 1 1 66 66 THR HG21 H 1 1.127 0.030 . 1 . . . . 66 THR HG2 . 11129 1 792 . 1 1 66 66 THR HG22 H 1 1.127 0.030 . 1 . . . . 66 THR HG2 . 11129 1 793 . 1 1 66 66 THR HG23 H 1 1.127 0.030 . 1 . . . . 66 THR HG2 . 11129 1 794 . 1 1 66 66 THR C C 13 172.625 0.300 . 1 . . . . 66 THR C . 11129 1 795 . 1 1 66 66 THR CA C 13 56.582 0.300 . 1 . . . . 66 THR CA . 11129 1 796 . 1 1 66 66 THR CB C 13 70.746 0.300 . 1 . . . . 66 THR CB . 11129 1 797 . 1 1 66 66 THR CG2 C 13 19.341 0.300 . 1 . . . . 66 THR CG2 . 11129 1 798 . 1 1 66 66 THR N N 15 107.997 0.300 . 1 . . . . 66 THR N . 11129 1 799 . 1 1 67 67 GLU H H 1 8.888 0.030 . 1 . . . . 67 GLU H . 11129 1 800 . 1 1 67 67 GLU HA H 1 3.638 0.030 . 1 . . . . 67 GLU HA . 11129 1 801 . 1 1 67 67 GLU HB2 H 1 2.050 0.030 . 2 . . . . 67 GLU HB2 . 11129 1 802 . 1 1 67 67 GLU HB3 H 1 1.778 0.030 . 2 . . . . 67 GLU HB3 . 11129 1 803 . 1 1 67 67 GLU HG2 H 1 1.727 0.030 . 2 . . . . 67 GLU HG2 . 11129 1 804 . 1 1 67 67 GLU HG3 H 1 1.606 0.030 . 2 . . . . 67 GLU HG3 . 11129 1 805 . 1 1 67 67 GLU C C 13 175.216 0.300 . 1 . . . . 67 GLU C . 11129 1 806 . 1 1 67 67 GLU CA C 13 57.742 0.300 . 1 . . . . 67 GLU CA . 11129 1 807 . 1 1 67 67 GLU CB C 13 27.465 0.300 . 1 . . . . 67 GLU CB . 11129 1 808 . 1 1 67 67 GLU CG C 13 33.439 0.300 . 1 . . . . 67 GLU CG . 11129 1 809 . 1 1 67 67 GLU N N 15 123.135 0.300 . 1 . . . . 67 GLU N . 11129 1 810 . 1 1 68 68 ALA H H 1 8.117 0.030 . 1 . . . . 68 ALA H . 11129 1 811 . 1 1 68 68 ALA HA H 1 3.806 0.030 . 1 . . . . 68 ALA HA . 11129 1 812 . 1 1 68 68 ALA HB1 H 1 1.231 0.030 . 1 . . . . 68 ALA HB . 11129 1 813 . 1 1 68 68 ALA HB2 H 1 1.231 0.030 . 1 . . . . 68 ALA HB . 11129 1 814 . 1 1 68 68 ALA HB3 H 1 1.231 0.030 . 1 . . . . 68 ALA HB . 11129 1 815 . 1 1 68 68 ALA C C 13 177.341 0.300 . 1 . . . . 68 ALA C . 11129 1 816 . 1 1 68 68 ALA CA C 13 52.913 0.300 . 1 . . . . 68 ALA CA . 11129 1 817 . 1 1 68 68 ALA CB C 13 15.663 0.300 . 1 . . . . 68 ALA CB . 11129 1 818 . 1 1 68 68 ALA N N 15 118.906 0.300 . 1 . . . . 68 ALA N . 11129 1 819 . 1 1 69 69 ASP H H 1 7.629 0.030 . 1 . . . . 69 ASP H . 11129 1 820 . 1 1 69 69 ASP HA H 1 4.348 0.030 . 1 . . . . 69 ASP HA . 11129 1 821 . 1 1 69 69 ASP HB2 H 1 2.822 0.030 . 2 . . . . 69 ASP HB2 . 11129 1 822 . 1 1 69 69 ASP HB3 H 1 2.709 0.030 . 2 . . . . 69 ASP HB3 . 11129 1 823 . 1 1 69 69 ASP C C 13 175.839 0.300 . 1 . . . . 69 ASP C . 11129 1 824 . 1 1 69 69 ASP CA C 13 55.328 0.300 . 1 . . . . 69 ASP CA . 11129 1 825 . 1 1 69 69 ASP CB C 13 40.578 0.300 . 1 . . . . 69 ASP CB . 11129 1 826 . 1 1 69 69 ASP N N 15 116.634 0.300 . 1 . . . . 69 ASP N . 11129 1 827 . 1 1 70 70 CYS H H 1 7.324 0.030 . 1 . . . . 70 CYS H . 11129 1 828 . 1 1 70 70 CYS HA H 1 4.216 0.030 . 1 . . . . 70 CYS HA . 11129 1 829 . 1 1 70 70 CYS HB2 H 1 3.201 0.030 . 2 . . . . 70 CYS HB2 . 11129 1 830 . 1 1 70 70 CYS HB3 H 1 2.716 0.030 . 2 . . . . 70 CYS HB3 . 11129 1 831 . 1 1 70 70 CYS C C 13 174.647 0.300 . 1 . . . . 70 CYS C . 11129 1 832 . 1 1 70 70 CYS CA C 13 60.025 0.300 . 1 . . . . 70 CYS CA . 11129 1 833 . 1 1 70 70 CYS CB C 13 25.911 0.300 . 1 . . . . 70 CYS CB . 11129 1 834 . 1 1 70 70 CYS N N 15 117.238 0.300 . 1 . . . . 70 CYS N . 11129 1 835 . 1 1 71 71 ILE H H 1 8.379 0.030 . 1 . . . . 71 ILE H . 11129 1 836 . 1 1 71 71 ILE HA H 1 3.449 0.030 . 1 . . . . 71 ILE HA . 11129 1 837 . 1 1 71 71 ILE HB H 1 1.827 0.030 . 1 . . . . 71 ILE HB . 11129 1 838 . 1 1 71 71 ILE HD11 H 1 0.387 0.030 . 1 . . . . 71 ILE HD1 . 11129 1 839 . 1 1 71 71 ILE HD12 H 1 0.387 0.030 . 1 . . . . 71 ILE HD1 . 11129 1 840 . 1 1 71 71 ILE HD13 H 1 0.387 0.030 . 1 . . . . 71 ILE HD1 . 11129 1 841 . 1 1 71 71 ILE HG12 H 1 1.090 0.030 . 2 . . . . 71 ILE HG12 . 11129 1 842 . 1 1 71 71 ILE HG13 H 1 1.049 0.030 . 2 . . . . 71 ILE HG13 . 11129 1 843 . 1 1 71 71 ILE HG21 H 1 0.715 0.030 . 1 . . . . 71 ILE HG2 . 11129 1 844 . 1 1 71 71 ILE HG22 H 1 0.715 0.030 . 1 . . . . 71 ILE HG2 . 11129 1 845 . 1 1 71 71 ILE HG23 H 1 0.715 0.030 . 1 . . . . 71 ILE HG2 . 11129 1 846 . 1 1 71 71 ILE C C 13 175.897 0.300 . 1 . . . . 71 ILE C . 11129 1 847 . 1 1 71 71 ILE CA C 13 60.843 0.300 . 1 . . . . 71 ILE CA . 11129 1 848 . 1 1 71 71 ILE CB C 13 33.494 0.300 . 1 . . . . 71 ILE CB . 11129 1 849 . 1 1 71 71 ILE CD1 C 13 7.759 0.300 . 1 . . . . 71 ILE CD1 . 11129 1 850 . 1 1 71 71 ILE CG1 C 13 25.430 0.300 . 1 . . . . 71 ILE CG1 . 11129 1 851 . 1 1 71 71 ILE CG2 C 13 15.069 0.300 . 1 . . . . 71 ILE CG2 . 11129 1 852 . 1 1 71 71 ILE N N 15 119.362 0.300 . 1 . . . . 71 ILE N . 11129 1 853 . 1 1 72 72 ASN H H 1 8.500 0.030 . 1 . . . . 72 ASN H . 11129 1 854 . 1 1 72 72 ASN HA H 1 4.418 0.030 . 1 . . . . 72 ASN HA . 11129 1 855 . 1 1 72 72 ASN HB2 H 1 2.929 0.030 . 1 . . . . 72 ASN HB2 . 11129 1 856 . 1 1 72 72 ASN HB3 H 1 2.929 0.030 . 1 . . . . 72 ASN HB3 . 11129 1 857 . 1 1 72 72 ASN HD21 H 1 6.766 0.030 . 2 . . . . 72 ASN HD21 . 11129 1 858 . 1 1 72 72 ASN HD22 H 1 7.659 0.030 . 2 . . . . 72 ASN HD22 . 11129 1 859 . 1 1 72 72 ASN C C 13 175.382 0.300 . 1 . . . . 72 ASN C . 11129 1 860 . 1 1 72 72 ASN CA C 13 54.093 0.300 . 1 . . . . 72 ASN CA . 11129 1 861 . 1 1 72 72 ASN CB C 13 35.053 0.300 . 1 . . . . 72 ASN CB . 11129 1 862 . 1 1 72 72 ASN N N 15 119.131 0.300 . 1 . . . . 72 ASN N . 11129 1 863 . 1 1 72 72 ASN ND2 N 15 112.391 0.300 . 1 . . . . 72 ASN ND2 . 11129 1 864 . 1 1 73 73 ASN H H 1 7.636 0.030 . 1 . . . . 73 ASN H . 11129 1 865 . 1 1 73 73 ASN HA H 1 4.369 0.030 . 1 . . . . 73 ASN HA . 11129 1 866 . 1 1 73 73 ASN HB2 H 1 3.662 0.030 . 2 . . . . 73 ASN HB2 . 11129 1 867 . 1 1 73 73 ASN HB3 H 1 2.709 0.030 . 2 . . . . 73 ASN HB3 . 11129 1 868 . 1 1 73 73 ASN HD21 H 1 7.041 0.030 . 2 . . . . 73 ASN HD21 . 11129 1 869 . 1 1 73 73 ASN HD22 H 1 8.250 0.030 . 2 . . . . 73 ASN HD22 . 11129 1 870 . 1 1 73 73 ASN C C 13 174.947 0.300 . 1 . . . . 73 ASN C . 11129 1 871 . 1 1 73 73 ASN CA C 13 53.124 0.300 . 1 . . . . 73 ASN CA . 11129 1 872 . 1 1 73 73 ASN CB C 13 35.924 0.300 . 1 . . . . 73 ASN CB . 11129 1 873 . 1 1 73 73 ASN N N 15 118.040 0.300 . 1 . . . . 73 ASN N . 11129 1 874 . 1 1 73 73 ASN ND2 N 15 106.013 0.300 . 1 . . . . 73 ASN ND2 . 11129 1 875 . 1 1 74 74 ILE H H 1 8.426 0.030 . 1 . . . . 74 ILE H . 11129 1 876 . 1 1 74 74 ILE HA H 1 3.465 0.030 . 1 . . . . 74 ILE HA . 11129 1 877 . 1 1 74 74 ILE HB H 1 1.888 0.030 . 1 . . . . 74 ILE HB . 11129 1 878 . 1 1 74 74 ILE HD11 H 1 1.110 0.030 . 1 . . . . 74 ILE HD1 . 11129 1 879 . 1 1 74 74 ILE HD12 H 1 1.110 0.030 . 1 . . . . 74 ILE HD1 . 11129 1 880 . 1 1 74 74 ILE HD13 H 1 1.110 0.030 . 1 . . . . 74 ILE HD1 . 11129 1 881 . 1 1 74 74 ILE HG12 H 1 2.095 0.030 . 2 . . . . 74 ILE HG12 . 11129 1 882 . 1 1 74 74 ILE HG13 H 1 0.750 0.030 . 2 . . . . 74 ILE HG13 . 11129 1 883 . 1 1 74 74 ILE HG21 H 1 1.124 0.030 . 1 . . . . 74 ILE HG2 . 11129 1 884 . 1 1 74 74 ILE HG22 H 1 1.124 0.030 . 1 . . . . 74 ILE HG2 . 11129 1 885 . 1 1 74 74 ILE HG23 H 1 1.124 0.030 . 1 . . . . 74 ILE HG2 . 11129 1 886 . 1 1 74 74 ILE C C 13 175.552 0.300 . 1 . . . . 74 ILE C . 11129 1 887 . 1 1 74 74 ILE CA C 13 64.453 0.300 . 1 . . . . 74 ILE CA . 11129 1 888 . 1 1 74 74 ILE CB C 13 36.526 0.300 . 1 . . . . 74 ILE CB . 11129 1 889 . 1 1 74 74 ILE CD1 C 13 11.535 0.300 . 1 . . . . 74 ILE CD1 . 11129 1 890 . 1 1 74 74 ILE CG1 C 13 27.821 0.300 . 1 . . . . 74 ILE CG1 . 11129 1 891 . 1 1 74 74 ILE CG2 C 13 16.550 0.300 . 1 . . . . 74 ILE CG2 . 11129 1 892 . 1 1 74 74 ILE N N 15 119.881 0.300 . 1 . . . . 74 ILE N . 11129 1 893 . 1 1 75 75 ASN H H 1 9.074 0.030 . 1 . . . . 75 ASN H . 11129 1 894 . 1 1 75 75 ASN HA H 1 4.482 0.030 . 1 . . . . 75 ASN HA . 11129 1 895 . 1 1 75 75 ASN HB2 H 1 2.912 0.030 . 2 . . . . 75 ASN HB2 . 11129 1 896 . 1 1 75 75 ASN HB3 H 1 2.617 0.030 . 2 . . . . 75 ASN HB3 . 11129 1 897 . 1 1 75 75 ASN HD21 H 1 7.417 0.030 . 2 . . . . 75 ASN HD21 . 11129 1 898 . 1 1 75 75 ASN HD22 H 1 6.833 0.030 . 2 . . . . 75 ASN HD22 . 11129 1 899 . 1 1 75 75 ASN C C 13 176.139 0.300 . 1 . . . . 75 ASN C . 11129 1 900 . 1 1 75 75 ASN CA C 13 53.952 0.300 . 1 . . . . 75 ASN CA . 11129 1 901 . 1 1 75 75 ASN CB C 13 35.903 0.300 . 1 . . . . 75 ASN CB . 11129 1 902 . 1 1 75 75 ASN N N 15 118.269 0.300 . 1 . . . . 75 ASN N . 11129 1 903 . 1 1 75 75 ASN ND2 N 15 111.354 0.300 . 1 . . . . 75 ASN ND2 . 11129 1 904 . 1 1 76 76 ASP H H 1 8.312 0.030 . 1 . . . . 76 ASP H . 11129 1 905 . 1 1 76 76 ASP HA H 1 4.520 0.030 . 1 . . . . 76 ASP HA . 11129 1 906 . 1 1 76 76 ASP HB2 H 1 2.902 0.030 . 2 . . . . 76 ASP HB2 . 11129 1 907 . 1 1 76 76 ASP HB3 H 1 2.528 0.030 . 2 . . . . 76 ASP HB3 . 11129 1 908 . 1 1 76 76 ASP C C 13 177.082 0.300 . 1 . . . . 76 ASP C . 11129 1 909 . 1 1 76 76 ASP CA C 13 56.002 0.300 . 1 . . . . 76 ASP CA . 11129 1 910 . 1 1 76 76 ASP CB C 13 37.679 0.300 . 1 . . . . 76 ASP CB . 11129 1 911 . 1 1 76 76 ASP N N 15 122.983 0.300 . 1 . . . . 76 ASP N . 11129 1 912 . 1 1 77 77 PHE H H 1 7.934 0.030 . 1 . . . . 77 PHE H . 11129 1 913 . 1 1 77 77 PHE HA H 1 3.989 0.030 . 1 . . . . 77 PHE HA . 11129 1 914 . 1 1 77 77 PHE HB2 H 1 3.358 0.030 . 2 . . . . 77 PHE HB2 . 11129 1 915 . 1 1 77 77 PHE HB3 H 1 2.956 0.030 . 2 . . . . 77 PHE HB3 . 11129 1 916 . 1 1 77 77 PHE HD1 H 1 7.076 0.030 . 3 . . . . 77 PHE HD1 . 11129 1 917 . 1 1 77 77 PHE HD2 H 1 6.948 0.030 . 3 . . . . 77 PHE HD2 . 11129 1 918 . 1 1 77 77 PHE HE1 H 1 6.865 0.030 . 3 . . . . 77 PHE HE1 . 11129 1 919 . 1 1 77 77 PHE HZ H 1 6.837 0.030 . 1 . . . . 77 PHE HZ . 11129 1 920 . 1 1 77 77 PHE C C 13 174.421 0.300 . 1 . . . . 77 PHE C . 11129 1 921 . 1 1 77 77 PHE CA C 13 59.097 0.300 . 1 . . . . 77 PHE CA . 11129 1 922 . 1 1 77 77 PHE CB C 13 35.837 0.300 . 1 . . . . 77 PHE CB . 11129 1 923 . 1 1 77 77 PHE CZ C 13 127.080 0.300 . 1 . . . . 77 PHE CZ . 11129 1 924 . 1 1 77 77 PHE N N 15 121.781 0.300 . 1 . . . . 77 PHE N . 11129 1 925 . 1 1 78 78 LEU H H 1 8.496 0.030 . 1 . . . . 78 LEU H . 11129 1 926 . 1 1 78 78 LEU HA H 1 3.343 0.030 . 1 . . . . 78 LEU HA . 11129 1 927 . 1 1 78 78 LEU HB2 H 1 1.961 0.030 . 2 . . . . 78 LEU HB2 . 11129 1 928 . 1 1 78 78 LEU HB3 H 1 1.082 0.030 . 2 . . . . 78 LEU HB3 . 11129 1 929 . 1 1 78 78 LEU HD11 H 1 0.629 0.030 . 1 . . . . 78 LEU HD1 . 11129 1 930 . 1 1 78 78 LEU HD12 H 1 0.629 0.030 . 1 . . . . 78 LEU HD1 . 11129 1 931 . 1 1 78 78 LEU HD13 H 1 0.629 0.030 . 1 . . . . 78 LEU HD1 . 11129 1 932 . 1 1 78 78 LEU HD21 H 1 -0.048 0.030 . 1 . . . . 78 LEU HD2 . 11129 1 933 . 1 1 78 78 LEU HD22 H 1 -0.048 0.030 . 1 . . . . 78 LEU HD2 . 11129 1 934 . 1 1 78 78 LEU HD23 H 1 -0.048 0.030 . 1 . . . . 78 LEU HD2 . 11129 1 935 . 1 1 78 78 LEU HG H 1 1.727 0.030 . 1 . . . . 78 LEU HG . 11129 1 936 . 1 1 78 78 LEU C C 13 177.863 0.300 . 1 . . . . 78 LEU C . 11129 1 937 . 1 1 78 78 LEU CA C 13 55.667 0.300 . 1 . . . . 78 LEU CA . 11129 1 938 . 1 1 78 78 LEU CB C 13 38.999 0.300 . 1 . . . . 78 LEU CB . 11129 1 939 . 1 1 78 78 LEU CD1 C 13 23.733 0.300 . 2 . . . . 78 LEU CD1 . 11129 1 940 . 1 1 78 78 LEU CD2 C 13 18.819 0.300 . 2 . . . . 78 LEU CD2 . 11129 1 941 . 1 1 78 78 LEU CG C 13 24.184 0.300 . 1 . . . . 78 LEU CG . 11129 1 942 . 1 1 78 78 LEU N N 15 120.676 0.300 . 1 . . . . 78 LEU N . 11129 1 943 . 1 1 79 79 LYS H H 1 8.142 0.030 . 1 . . . . 79 LYS H . 11129 1 944 . 1 1 79 79 LYS HA H 1 3.880 0.030 . 1 . . . . 79 LYS HA . 11129 1 945 . 1 1 79 79 LYS HB2 H 1 1.856 0.030 . 1 . . . . 79 LYS HB2 . 11129 1 946 . 1 1 79 79 LYS HB3 H 1 1.856 0.030 . 1 . . . . 79 LYS HB3 . 11129 1 947 . 1 1 79 79 LYS HD2 H 1 1.636 0.030 . 1 . . . . 79 LYS HD2 . 11129 1 948 . 1 1 79 79 LYS HD3 H 1 1.636 0.030 . 1 . . . . 79 LYS HD3 . 11129 1 949 . 1 1 79 79 LYS HE2 H 1 2.885 0.030 . 2 . . . . 79 LYS HE2 . 11129 1 950 . 1 1 79 79 LYS HG2 H 1 1.333 0.030 . 2 . . . . 79 LYS HG2 . 11129 1 951 . 1 1 79 79 LYS HG3 H 1 1.514 0.030 . 2 . . . . 79 LYS HG3 . 11129 1 952 . 1 1 79 79 LYS C C 13 177.663 0.300 . 1 . . . . 79 LYS C . 11129 1 953 . 1 1 79 79 LYS CA C 13 57.332 0.300 . 1 . . . . 79 LYS CA . 11129 1 954 . 1 1 79 79 LYS CB C 13 29.778 0.300 . 1 . . . . 79 LYS CB . 11129 1 955 . 1 1 79 79 LYS CD C 13 27.022 0.300 . 1 . . . . 79 LYS CD . 11129 1 956 . 1 1 79 79 LYS CE C 13 39.891 0.300 . 1 . . . . 79 LYS CE . 11129 1 957 . 1 1 79 79 LYS CG C 13 22.933 0.300 . 1 . . . . 79 LYS CG . 11129 1 958 . 1 1 79 79 LYS N N 15 120.544 0.300 . 1 . . . . 79 LYS N . 11129 1 959 . 1 1 80 80 GLY H H 1 7.589 0.030 . 1 . . . . 80 GLY H . 11129 1 960 . 1 1 80 80 GLY HA2 H 1 3.854 0.030 . 2 . . . . 80 GLY HA2 . 11129 1 961 . 1 1 80 80 GLY HA3 H 1 3.281 0.030 . 2 . . . . 80 GLY HA3 . 11129 1 962 . 1 1 80 80 GLY C C 13 172.792 0.300 . 1 . . . . 80 GLY C . 11129 1 963 . 1 1 80 80 GLY CA C 13 44.276 0.300 . 1 . . . . 80 GLY CA . 11129 1 964 . 1 1 80 80 GLY N N 15 107.428 0.300 . 1 . . . . 80 GLY N . 11129 1 965 . 1 1 81 81 CYS H H 1 7.650 0.030 . 1 . . . . 81 CYS H . 11129 1 966 . 1 1 81 81 CYS HA H 1 3.686 0.030 . 1 . . . . 81 CYS HA . 11129 1 967 . 1 1 81 81 CYS HB2 H 1 2.485 0.030 . 2 . . . . 81 CYS HB2 . 11129 1 968 . 1 1 81 81 CYS HB3 H 1 2.065 0.030 . 2 . . . . 81 CYS HB3 . 11129 1 969 . 1 1 81 81 CYS C C 13 174.153 0.300 . 1 . . . . 81 CYS C . 11129 1 970 . 1 1 81 81 CYS CA C 13 60.260 0.300 . 1 . . . . 81 CYS CA . 11129 1 971 . 1 1 81 81 CYS CB C 13 24.608 0.300 . 1 . . . . 81 CYS CB . 11129 1 972 . 1 1 81 81 CYS N N 15 117.839 0.300 . 1 . . . . 81 CYS N . 11129 1 973 . 1 1 82 82 ALA H H 1 7.536 0.030 . 1 . . . . 82 ALA H . 11129 1 974 . 1 1 82 82 ALA HA H 1 4.025 0.030 . 1 . . . . 82 ALA HA . 11129 1 975 . 1 1 82 82 ALA HB1 H 1 1.401 0.030 . 1 . . . . 82 ALA HB . 11129 1 976 . 1 1 82 82 ALA HB2 H 1 1.401 0.030 . 1 . . . . 82 ALA HB . 11129 1 977 . 1 1 82 82 ALA HB3 H 1 1.401 0.030 . 1 . . . . 82 ALA HB . 11129 1 978 . 1 1 82 82 ALA C C 13 178.479 0.300 . 1 . . . . 82 ALA C . 11129 1 979 . 1 1 82 82 ALA CA C 13 52.938 0.300 . 1 . . . . 82 ALA CA . 11129 1 980 . 1 1 82 82 ALA CB C 13 15.761 0.300 . 1 . . . . 82 ALA CB . 11129 1 981 . 1 1 82 82 ALA N N 15 121.421 0.300 . 1 . . . . 82 ALA N . 11129 1 982 . 1 1 83 83 THR H H 1 7.553 0.030 . 1 . . . . 83 THR H . 11129 1 983 . 1 1 83 83 THR HA H 1 3.996 0.030 . 1 . . . . 83 THR HA . 11129 1 984 . 1 1 83 83 THR HB H 1 4.178 0.030 . 1 . . . . 83 THR HB . 11129 1 985 . 1 1 83 83 THR HG21 H 1 1.179 0.030 . 1 . . . . 83 THR HG2 . 11129 1 986 . 1 1 83 83 THR HG22 H 1 1.179 0.030 . 1 . . . . 83 THR HG2 . 11129 1 987 . 1 1 83 83 THR HG23 H 1 1.179 0.030 . 1 . . . . 83 THR HG2 . 11129 1 988 . 1 1 83 83 THR C C 13 173.239 0.300 . 1 . . . . 83 THR C . 11129 1 989 . 1 1 83 83 THR CA C 13 62.164 0.300 . 1 . . . . 83 THR CA . 11129 1 990 . 1 1 83 83 THR CB C 13 66.457 0.300 . 1 . . . . 83 THR CB . 11129 1 991 . 1 1 83 83 THR CG2 C 13 19.441 0.300 . 1 . . . . 83 THR CG2 . 11129 1 992 . 1 1 83 83 THR N N 15 110.546 0.300 . 1 . . . . 83 THR N . 11129 1 993 . 1 1 84 84 LEU H H 1 7.418 0.030 . 1 . . . . 84 LEU H . 11129 1 994 . 1 1 84 84 LEU HA H 1 4.178 0.030 . 1 . . . . 84 LEU HA . 11129 1 995 . 1 1 84 84 LEU HB2 H 1 1.773 0.030 . 2 . . . . 84 LEU HB2 . 11129 1 996 . 1 1 84 84 LEU HB3 H 1 1.360 0.030 . 2 . . . . 84 LEU HB3 . 11129 1 997 . 1 1 84 84 LEU HD11 H 1 0.748 0.030 . 1 . . . . 84 LEU HD1 . 11129 1 998 . 1 1 84 84 LEU HD12 H 1 0.748 0.030 . 1 . . . . 84 LEU HD1 . 11129 1 999 . 1 1 84 84 LEU HD13 H 1 0.748 0.030 . 1 . . . . 84 LEU HD1 . 11129 1 1000 . 1 1 84 84 LEU HD21 H 1 0.728 0.030 . 1 . . . . 84 LEU HD2 . 11129 1 1001 . 1 1 84 84 LEU HD22 H 1 0.728 0.030 . 1 . . . . 84 LEU HD2 . 11129 1 1002 . 1 1 84 84 LEU HD23 H 1 0.728 0.030 . 1 . . . . 84 LEU HD2 . 11129 1 1003 . 1 1 84 84 LEU HG H 1 1.519 0.030 . 1 . . . . 84 LEU HG . 11129 1 1004 . 1 1 84 84 LEU C C 13 173.692 0.300 . 1 . . . . 84 LEU C . 11129 1 1005 . 1 1 84 84 LEU CA C 13 52.546 0.300 . 1 . . . . 84 LEU CA . 11129 1 1006 . 1 1 84 84 LEU CB C 13 40.800 0.300 . 1 . . . . 84 LEU CB . 11129 1 1007 . 1 1 84 84 LEU CD1 C 13 24.447 0.300 . 2 . . . . 84 LEU CD1 . 11129 1 1008 . 1 1 84 84 LEU CD2 C 13 20.262 0.300 . 2 . . . . 84 LEU CD2 . 11129 1 1009 . 1 1 84 84 LEU CG C 13 24.507 0.300 . 1 . . . . 84 LEU CG . 11129 1 1010 . 1 1 84 84 LEU N N 15 119.388 0.300 . 1 . . . . 84 LEU N . 11129 1 1011 . 1 1 85 85 GLN H H 1 7.806 0.030 . 1 . . . . 85 GLN H . 11129 1 1012 . 1 1 85 85 GLN HA H 1 3.852 0.030 . 1 . . . . 85 GLN HA . 11129 1 1013 . 1 1 85 85 GLN HB2 H 1 2.139 0.030 . 2 . . . . 85 GLN HB2 . 11129 1 1014 . 1 1 85 85 GLN HB3 H 1 2.073 0.030 . 2 . . . . 85 GLN HB3 . 11129 1 1015 . 1 1 85 85 GLN HE21 H 1 6.695 0.030 . 2 . . . . 85 GLN HE21 . 11129 1 1016 . 1 1 85 85 GLN HE22 H 1 7.396 0.030 . 2 . . . . 85 GLN HE22 . 11129 1 1017 . 1 1 85 85 GLN HG2 H 1 2.138 0.030 . 1 . . . . 85 GLN HG2 . 11129 1 1018 . 1 1 85 85 GLN HG3 H 1 2.138 0.030 . 1 . . . . 85 GLN HG3 . 11129 1 1019 . 1 1 85 85 GLN C C 13 172.601 0.300 . 1 . . . . 85 GLN C . 11129 1 1020 . 1 1 85 85 GLN CA C 13 54.323 0.300 . 1 . . . . 85 GLN CA . 11129 1 1021 . 1 1 85 85 GLN CB C 13 23.477 0.300 . 1 . . . . 85 GLN CB . 11129 1 1022 . 1 1 85 85 GLN CG C 13 31.808 0.300 . 1 . . . . 85 GLN CG . 11129 1 1023 . 1 1 85 85 GLN N N 15 112.923 0.300 . 1 . . . . 85 GLN N . 11129 1 1024 . 1 1 85 85 GLN NE2 N 15 111.930 0.300 . 1 . . . . 85 GLN NE2 . 11129 1 1025 . 1 1 86 86 VAL H H 1 6.875 0.030 . 1 . . . . 86 VAL H . 11129 1 1026 . 1 1 86 86 VAL HA H 1 4.376 0.030 . 1 . . . . 86 VAL HA . 11129 1 1027 . 1 1 86 86 VAL HB H 1 2.024 0.030 . 1 . . . . 86 VAL HB . 11129 1 1028 . 1 1 86 86 VAL HG11 H 1 0.672 0.030 . 1 . . . . 86 VAL HG1 . 11129 1 1029 . 1 1 86 86 VAL HG12 H 1 0.672 0.030 . 1 . . . . 86 VAL HG1 . 11129 1 1030 . 1 1 86 86 VAL HG13 H 1 0.672 0.030 . 1 . . . . 86 VAL HG1 . 11129 1 1031 . 1 1 86 86 VAL HG21 H 1 0.535 0.030 . 1 . . . . 86 VAL HG2 . 11129 1 1032 . 1 1 86 86 VAL HG22 H 1 0.535 0.030 . 1 . . . . 86 VAL HG2 . 11129 1 1033 . 1 1 86 86 VAL HG23 H 1 0.535 0.030 . 1 . . . . 86 VAL HG2 . 11129 1 1034 . 1 1 86 86 VAL C C 13 172.846 0.300 . 1 . . . . 86 VAL C . 11129 1 1035 . 1 1 86 86 VAL CA C 13 56.444 0.300 . 1 . . . . 86 VAL CA . 11129 1 1036 . 1 1 86 86 VAL CB C 13 31.617 0.300 . 1 . . . . 86 VAL CB . 11129 1 1037 . 1 1 86 86 VAL CG1 C 13 19.466 0.300 . 2 . . . . 86 VAL CG1 . 11129 1 1038 . 1 1 86 86 VAL CG2 C 13 16.182 0.300 . 2 . . . . 86 VAL CG2 . 11129 1 1039 . 1 1 86 86 VAL N N 15 110.107 0.300 . 1 . . . . 86 VAL N . 11129 1 1040 . 1 1 87 87 GLU H H 1 8.396 0.030 . 1 . . . . 87 GLU H . 11129 1 1041 . 1 1 87 87 GLU HA H 1 4.096 0.030 . 1 . . . . 87 GLU HA . 11129 1 1042 . 1 1 87 87 GLU HB2 H 1 1.867 0.030 . 2 . . . . 87 GLU HB2 . 11129 1 1043 . 1 1 87 87 GLU HB3 H 1 1.832 0.030 . 2 . . . . 87 GLU HB3 . 11129 1 1044 . 1 1 87 87 GLU HG2 H 1 2.227 0.030 . 2 . . . . 87 GLU HG2 . 11129 1 1045 . 1 1 87 87 GLU HG3 H 1 2.168 0.030 . 2 . . . . 87 GLU HG3 . 11129 1 1046 . 1 1 87 87 GLU C C 13 174.696 0.300 . 1 . . . . 87 GLU C . 11129 1 1047 . 1 1 87 87 GLU CA C 13 54.269 0.300 . 1 . . . . 87 GLU CA . 11129 1 1048 . 1 1 87 87 GLU CB C 13 27.499 0.300 . 1 . . . . 87 GLU CB . 11129 1 1049 . 1 1 87 87 GLU CG C 13 33.842 0.300 . 1 . . . . 87 GLU CG . 11129 1 1050 . 1 1 87 87 GLU N N 15 122.308 0.300 . 1 . . . . 87 GLU N . 11129 1 1051 . 1 1 88 88 ILE H H 1 8.004 0.030 . 1 . . . . 88 ILE H . 11129 1 1052 . 1 1 88 88 ILE HA H 1 4.368 0.030 . 1 . . . . 88 ILE HA . 11129 1 1053 . 1 1 88 88 ILE HB H 1 1.728 0.030 . 1 . . . . 88 ILE HB . 11129 1 1054 . 1 1 88 88 ILE HD11 H 1 0.680 0.030 . 1 . . . . 88 ILE HD1 . 11129 1 1055 . 1 1 88 88 ILE HD12 H 1 0.680 0.030 . 1 . . . . 88 ILE HD1 . 11129 1 1056 . 1 1 88 88 ILE HD13 H 1 0.680 0.030 . 1 . . . . 88 ILE HD1 . 11129 1 1057 . 1 1 88 88 ILE HG12 H 1 1.078 0.030 . 2 . . . . 88 ILE HG12 . 11129 1 1058 . 1 1 88 88 ILE HG13 H 1 1.151 0.030 . 2 . . . . 88 ILE HG13 . 11129 1 1059 . 1 1 88 88 ILE HG21 H 1 0.686 0.030 . 1 . . . . 88 ILE HG2 . 11129 1 1060 . 1 1 88 88 ILE HG22 H 1 0.686 0.030 . 1 . . . . 88 ILE HG2 . 11129 1 1061 . 1 1 88 88 ILE HG23 H 1 0.686 0.030 . 1 . . . . 88 ILE HG2 . 11129 1 1062 . 1 1 88 88 ILE C C 13 171.603 0.300 . 1 . . . . 88 ILE C . 11129 1 1063 . 1 1 88 88 ILE CA C 13 58.095 0.300 . 1 . . . . 88 ILE CA . 11129 1 1064 . 1 1 88 88 ILE CB C 13 37.714 0.300 . 1 . . . . 88 ILE CB . 11129 1 1065 . 1 1 88 88 ILE CD1 C 13 11.880 0.300 . 1 . . . . 88 ILE CD1 . 11129 1 1066 . 1 1 88 88 ILE CG1 C 13 23.357 0.300 . 1 . . . . 88 ILE CG1 . 11129 1 1067 . 1 1 88 88 ILE CG2 C 13 16.278 0.300 . 1 . . . . 88 ILE CG2 . 11129 1 1068 . 1 1 88 88 ILE N N 15 116.010 0.300 . 1 . . . . 88 ILE N . 11129 1 1069 . 1 1 89 89 PHE H H 1 6.110 0.030 . 1 . . . . 89 PHE H . 11129 1 1070 . 1 1 89 89 PHE HA H 1 4.803 0.030 . 1 . . . . 89 PHE HA . 11129 1 1071 . 1 1 89 89 PHE HB2 H 1 3.676 0.030 . 2 . . . . 89 PHE HB2 . 11129 1 1072 . 1 1 89 89 PHE HB3 H 1 2.631 0.030 . 2 . . . . 89 PHE HB3 . 11129 1 1073 . 1 1 89 89 PHE HD1 H 1 7.505 0.030 . 1 . . . . 89 PHE HD1 . 11129 1 1074 . 1 1 89 89 PHE HD2 H 1 7.505 0.030 . 1 . . . . 89 PHE HD2 . 11129 1 1075 . 1 1 89 89 PHE HE1 H 1 7.134 0.030 . 1 . . . . 89 PHE HE1 . 11129 1 1076 . 1 1 89 89 PHE HE2 H 1 7.134 0.030 . 1 . . . . 89 PHE HE2 . 11129 1 1077 . 1 1 89 89 PHE HZ H 1 6.983 0.030 . 1 . . . . 89 PHE HZ . 11129 1 1078 . 1 1 89 89 PHE C C 13 170.202 0.300 . 1 . . . . 89 PHE C . 11129 1 1079 . 1 1 89 89 PHE CA C 13 52.071 0.300 . 1 . . . . 89 PHE CA . 11129 1 1080 . 1 1 89 89 PHE CB C 13 37.323 0.300 . 1 . . . . 89 PHE CB . 11129 1 1081 . 1 1 89 89 PHE CD1 C 13 132.136 0.300 . 1 . . . . 89 PHE CD1 . 11129 1 1082 . 1 1 89 89 PHE CD2 C 13 132.136 0.300 . 1 . . . . 89 PHE CD2 . 11129 1 1083 . 1 1 89 89 PHE CE1 C 13 128.474 0.300 . 1 . . . . 89 PHE CE1 . 11129 1 1084 . 1 1 89 89 PHE CE2 C 13 128.474 0.300 . 1 . . . . 89 PHE CE2 . 11129 1 1085 . 1 1 89 89 PHE CZ C 13 126.631 0.300 . 1 . . . . 89 PHE CZ . 11129 1 1086 . 1 1 89 89 PHE N N 15 114.080 0.300 . 1 . . . . 89 PHE N . 11129 1 1087 . 1 1 90 90 ASP H H 1 8.960 0.030 . 1 . . . . 90 ASP H . 11129 1 1088 . 1 1 90 90 ASP HA H 1 4.968 0.030 . 1 . . . . 90 ASP HA . 11129 1 1089 . 1 1 90 90 ASP HB2 H 1 2.494 0.030 . 2 . . . . 90 ASP HB2 . 11129 1 1090 . 1 1 90 90 ASP HB3 H 1 2.739 0.030 . 2 . . . . 90 ASP HB3 . 11129 1 1091 . 1 1 90 90 ASP C C 13 173.783 0.300 . 1 . . . . 90 ASP C . 11129 1 1092 . 1 1 90 90 ASP CA C 13 49.560 0.300 . 1 . . . . 90 ASP CA . 11129 1 1093 . 1 1 90 90 ASP CB C 13 40.261 0.300 . 1 . . . . 90 ASP CB . 11129 1 1094 . 1 1 90 90 ASP N N 15 120.914 0.300 . 1 . . . . 90 ASP N . 11129 1 1095 . 1 1 91 91 PRO HA H 1 4.272 0.030 . 1 . . . . 91 PRO HA . 11129 1 1096 . 1 1 91 91 PRO HB2 H 1 2.106 0.030 . 2 . . . . 91 PRO HB2 . 11129 1 1097 . 1 1 91 91 PRO HB3 H 1 2.064 0.030 . 2 . . . . 91 PRO HB3 . 11129 1 1098 . 1 1 91 91 PRO HD2 H 1 3.688 0.030 . 2 . . . . 91 PRO HD2 . 11129 1 1099 . 1 1 91 91 PRO HD3 H 1 3.814 0.030 . 2 . . . . 91 PRO HD3 . 11129 1 1100 . 1 1 91 91 PRO HG2 H 1 2.208 0.030 . 2 . . . . 91 PRO HG2 . 11129 1 1101 . 1 1 91 91 PRO HG3 H 1 1.982 0.030 . 2 . . . . 91 PRO HG3 . 11129 1 1102 . 1 1 91 91 PRO C C 13 175.680 0.300 . 1 . . . . 91 PRO C . 11129 1 1103 . 1 1 91 91 PRO CA C 13 64.758 0.300 . 1 . . . . 91 PRO CA . 11129 1 1104 . 1 1 91 91 PRO CB C 13 30.121 0.300 . 1 . . . . 91 PRO CB . 11129 1 1105 . 1 1 91 91 PRO CD C 13 47.998 0.300 . 1 . . . . 91 PRO CD . 11129 1 1106 . 1 1 91 91 PRO CG C 13 25.552 0.300 . 1 . . . . 91 PRO CG . 11129 1 1107 . 1 1 92 92 ASP H H 1 8.840 0.030 . 1 . . . . 92 ASP H . 11129 1 1108 . 1 1 92 92 ASP HA H 1 4.587 0.030 . 1 . . . . 92 ASP HA . 11129 1 1109 . 1 1 92 92 ASP HB2 H 1 2.602 0.030 . 2 . . . . 92 ASP HB2 . 11129 1 1110 . 1 1 92 92 ASP HB3 H 1 2.523 0.030 . 2 . . . . 92 ASP HB3 . 11129 1 1111 . 1 1 92 92 ASP C C 13 176.385 0.300 . 1 . . . . 92 ASP C . 11129 1 1112 . 1 1 92 92 ASP CA C 13 55.334 0.300 . 1 . . . . 92 ASP CA . 11129 1 1113 . 1 1 92 92 ASP CB C 13 39.310 0.300 . 1 . . . . 92 ASP CB . 11129 1 1114 . 1 1 92 92 ASP N N 15 115.636 0.300 . 1 . . . . 92 ASP N . 11129 1 1115 . 1 1 93 93 ASP H H 1 8.357 0.030 . 1 . . . . 93 ASP H . 11129 1 1116 . 1 1 93 93 ASP HA H 1 4.268 0.030 . 1 . . . . 93 ASP HA . 11129 1 1117 . 1 1 93 93 ASP HB2 H 1 2.904 0.030 . 2 . . . . 93 ASP HB2 . 11129 1 1118 . 1 1 93 93 ASP HB3 H 1 2.708 0.030 . 2 . . . . 93 ASP HB3 . 11129 1 1119 . 1 1 93 93 ASP C C 13 174.473 0.300 . 1 . . . . 93 ASP C . 11129 1 1120 . 1 1 93 93 ASP CA C 13 55.679 0.300 . 1 . . . . 93 ASP CA . 11129 1 1121 . 1 1 93 93 ASP CB C 13 38.093 0.300 . 1 . . . . 93 ASP CB . 11129 1 1122 . 1 1 93 93 ASP N N 15 120.624 0.300 . 1 . . . . 93 ASP N . 11129 1 1123 . 1 1 94 94 LEU H H 1 6.684 0.030 . 1 . . . . 94 LEU H . 11129 1 1124 . 1 1 94 94 LEU HA H 1 4.285 0.030 . 1 . . . . 94 LEU HA . 11129 1 1125 . 1 1 94 94 LEU HB2 H 1 2.000 0.030 . 2 . . . . 94 LEU HB2 . 11129 1 1126 . 1 1 94 94 LEU HB3 H 1 1.277 0.030 . 2 . . . . 94 LEU HB3 . 11129 1 1127 . 1 1 94 94 LEU HD11 H 1 0.860 0.030 . 1 . . . . 94 LEU HD1 . 11129 1 1128 . 1 1 94 94 LEU HD12 H 1 0.860 0.030 . 1 . . . . 94 LEU HD1 . 11129 1 1129 . 1 1 94 94 LEU HD13 H 1 0.860 0.030 . 1 . . . . 94 LEU HD1 . 11129 1 1130 . 1 1 94 94 LEU HD21 H 1 0.926 0.030 . 1 . . . . 94 LEU HD2 . 11129 1 1131 . 1 1 94 94 LEU HD22 H 1 0.926 0.030 . 1 . . . . 94 LEU HD2 . 11129 1 1132 . 1 1 94 94 LEU HD23 H 1 0.926 0.030 . 1 . . . . 94 LEU HD2 . 11129 1 1133 . 1 1 94 94 LEU HG H 1 1.525 0.030 . 1 . . . . 94 LEU HG . 11129 1 1134 . 1 1 94 94 LEU C C 13 175.335 0.300 . 1 . . . . 94 LEU C . 11129 1 1135 . 1 1 94 94 LEU CA C 13 53.517 0.300 . 1 . . . . 94 LEU CA . 11129 1 1136 . 1 1 94 94 LEU CB C 13 41.000 0.300 . 1 . . . . 94 LEU CB . 11129 1 1137 . 1 1 94 94 LEU CD1 C 13 20.122 0.300 . 2 . . . . 94 LEU CD1 . 11129 1 1138 . 1 1 94 94 LEU CD2 C 13 24.967 0.300 . 2 . . . . 94 LEU CD2 . 11129 1 1139 . 1 1 94 94 LEU CG C 13 25.403 0.300 . 1 . . . . 94 LEU CG . 11129 1 1140 . 1 1 94 94 LEU N N 15 113.579 0.300 . 1 . . . . 94 LEU N . 11129 1 1141 . 1 1 95 95 TYR H H 1 8.775 0.030 . 1 . . . . 95 TYR H . 11129 1 1142 . 1 1 95 95 TYR HA H 1 3.966 0.030 . 1 . . . . 95 TYR HA . 11129 1 1143 . 1 1 95 95 TYR HB2 H 1 2.927 0.030 . 2 . . . . 95 TYR HB2 . 11129 1 1144 . 1 1 95 95 TYR HB3 H 1 2.844 0.030 . 2 . . . . 95 TYR HB3 . 11129 1 1145 . 1 1 95 95 TYR HD1 H 1 7.091 0.030 . 1 . . . . 95 TYR HD1 . 11129 1 1146 . 1 1 95 95 TYR HD2 H 1 7.091 0.030 . 1 . . . . 95 TYR HD2 . 11129 1 1147 . 1 1 95 95 TYR HE1 H 1 6.836 0.030 . 1 . . . . 95 TYR HE1 . 11129 1 1148 . 1 1 95 95 TYR HE2 H 1 6.836 0.030 . 1 . . . . 95 TYR HE2 . 11129 1 1149 . 1 1 95 95 TYR C C 13 173.885 0.300 . 1 . . . . 95 TYR C . 11129 1 1150 . 1 1 95 95 TYR CA C 13 60.703 0.300 . 1 . . . . 95 TYR CA . 11129 1 1151 . 1 1 95 95 TYR CB C 13 36.801 0.300 . 1 . . . . 95 TYR CB . 11129 1 1152 . 1 1 95 95 TYR CD1 C 13 131.125 0.300 . 1 . . . . 95 TYR CD1 . 11129 1 1153 . 1 1 95 95 TYR CD2 C 13 131.125 0.300 . 1 . . . . 95 TYR CD2 . 11129 1 1154 . 1 1 95 95 TYR CE1 C 13 115.501 0.300 . 1 . . . . 95 TYR CE1 . 11129 1 1155 . 1 1 95 95 TYR CE2 C 13 115.501 0.300 . 1 . . . . 95 TYR CE2 . 11129 1 1156 . 1 1 95 95 TYR N N 15 119.618 0.300 . 1 . . . . 95 TYR N . 11129 1 1157 . 1 1 96 96 SER H H 1 7.966 0.030 . 1 . . . . 96 SER H . 11129 1 1158 . 1 1 96 96 SER HA H 1 4.339 0.030 . 1 . . . . 96 SER HA . 11129 1 1159 . 1 1 96 96 SER HB2 H 1 3.937 0.030 . 2 . . . . 96 SER HB2 . 11129 1 1160 . 1 1 96 96 SER C C 13 173.435 0.300 . 1 . . . . 96 SER C . 11129 1 1161 . 1 1 96 96 SER CA C 13 56.744 0.300 . 1 . . . . 96 SER CA . 11129 1 1162 . 1 1 96 96 SER CB C 13 61.128 0.300 . 1 . . . . 96 SER CB . 11129 1 1163 . 1 1 96 96 SER N N 15 108.709 0.300 . 1 . . . . 96 SER N . 11129 1 1164 . 1 1 97 97 GLY H H 1 7.039 0.030 . 1 . . . . 97 GLY H . 11129 1 1165 . 1 1 97 97 GLY HA2 H 1 3.833 0.030 . 2 . . . . 97 GLY HA2 . 11129 1 1166 . 1 1 97 97 GLY HA3 H 1 3.679 0.030 . 2 . . . . 97 GLY HA3 . 11129 1 1167 . 1 1 97 97 GLY C C 13 172.279 0.300 . 1 . . . . 97 GLY C . 11129 1 1168 . 1 1 97 97 GLY CA C 13 44.224 0.300 . 1 . . . . 97 GLY CA . 11129 1 1169 . 1 1 97 97 GLY N N 15 108.102 0.300 . 1 . . . . 97 GLY N . 11129 1 1170 . 1 1 98 98 VAL H H 1 7.539 0.030 . 1 . . . . 98 VAL H . 11129 1 1171 . 1 1 98 98 VAL HA H 1 3.871 0.030 . 1 . . . . 98 VAL HA . 11129 1 1172 . 1 1 98 98 VAL HB H 1 1.940 0.030 . 1 . . . . 98 VAL HB . 11129 1 1173 . 1 1 98 98 VAL HG11 H 1 0.820 0.030 . 1 . . . . 98 VAL HG1 . 11129 1 1174 . 1 1 98 98 VAL HG12 H 1 0.820 0.030 . 1 . . . . 98 VAL HG1 . 11129 1 1175 . 1 1 98 98 VAL HG13 H 1 0.820 0.030 . 1 . . . . 98 VAL HG1 . 11129 1 1176 . 1 1 98 98 VAL HG21 H 1 0.812 0.030 . 1 . . . . 98 VAL HG2 . 11129 1 1177 . 1 1 98 98 VAL HG22 H 1 0.812 0.030 . 1 . . . . 98 VAL HG2 . 11129 1 1178 . 1 1 98 98 VAL HG23 H 1 0.812 0.030 . 1 . . . . 98 VAL HG2 . 11129 1 1179 . 1 1 98 98 VAL C C 13 174.052 0.300 . 1 . . . . 98 VAL C . 11129 1 1180 . 1 1 98 98 VAL CA C 13 61.565 0.300 . 1 . . . . 98 VAL CA . 11129 1 1181 . 1 1 98 98 VAL CB C 13 30.283 0.300 . 1 . . . . 98 VAL CB . 11129 1 1182 . 1 1 98 98 VAL CG1 C 13 18.910 0.300 . 1 . . . . 98 VAL CG1 . 11129 1 1183 . 1 1 98 98 VAL CG2 C 13 18.910 0.300 . 1 . . . . 98 VAL CG2 . 11129 1 1184 . 1 1 98 98 VAL N N 15 117.380 0.300 . 1 . . . . 98 VAL N . 11129 1 1185 . 1 1 99 99 ASN H H 1 8.039 0.030 . 1 . . . . 99 ASN H . 11129 1 1186 . 1 1 99 99 ASN HA H 1 4.826 0.030 . 1 . . . . 99 ASN HA . 11129 1 1187 . 1 1 99 99 ASN HB2 H 1 2.848 0.030 . 2 . . . . 99 ASN HB2 . 11129 1 1188 . 1 1 99 99 ASN HB3 H 1 2.566 0.030 . 2 . . . . 99 ASN HB3 . 11129 1 1189 . 1 1 99 99 ASN HD21 H 1 6.824 0.030 . 2 . . . . 99 ASN HD21 . 11129 1 1190 . 1 1 99 99 ASN HD22 H 1 7.688 0.030 . 2 . . . . 99 ASN HD22 . 11129 1 1191 . 1 1 99 99 ASN C C 13 172.742 0.300 . 1 . . . . 99 ASN C . 11129 1 1192 . 1 1 99 99 ASN CA C 13 49.941 0.300 . 1 . . . . 99 ASN CA . 11129 1 1193 . 1 1 99 99 ASN CB C 13 35.254 0.300 . 1 . . . . 99 ASN CB . 11129 1 1194 . 1 1 99 99 ASN N N 15 117.053 0.300 . 1 . . . . 99 ASN N . 11129 1 1195 . 1 1 99 99 ASN ND2 N 15 112.495 0.300 . 1 . . . . 99 ASN ND2 . 11129 1 1196 . 1 1 100 100 PHE H H 1 8.486 0.030 . 1 . . . . 100 PHE H . 11129 1 1197 . 1 1 100 100 PHE HA H 1 3.793 0.030 . 1 . . . . 100 PHE HA . 11129 1 1198 . 1 1 100 100 PHE HB2 H 1 2.992 0.030 . 2 . . . . 100 PHE HB2 . 11129 1 1199 . 1 1 100 100 PHE HB3 H 1 2.856 0.030 . 2 . . . . 100 PHE HB3 . 11129 1 1200 . 1 1 100 100 PHE HD1 H 1 7.121 0.030 . 1 . . . . 100 PHE HD1 . 11129 1 1201 . 1 1 100 100 PHE HD2 H 1 7.121 0.030 . 1 . . . . 100 PHE HD2 . 11129 1 1202 . 1 1 100 100 PHE HE1 H 1 6.920 0.030 . 1 . . . . 100 PHE HE1 . 11129 1 1203 . 1 1 100 100 PHE HE2 H 1 6.920 0.030 . 1 . . . . 100 PHE HE2 . 11129 1 1204 . 1 1 100 100 PHE HZ H 1 6.706 0.030 . 1 . . . . 100 PHE HZ . 11129 1 1205 . 1 1 100 100 PHE C C 13 174.220 0.300 . 1 . . . . 100 PHE C . 11129 1 1206 . 1 1 100 100 PHE CA C 13 59.341 0.300 . 1 . . . . 100 PHE CA . 11129 1 1207 . 1 1 100 100 PHE CB C 13 36.835 0.300 . 1 . . . . 100 PHE CB . 11129 1 1208 . 1 1 100 100 PHE CD1 C 13 130.076 0.300 . 1 . . . . 100 PHE CD1 . 11129 1 1209 . 1 1 100 100 PHE CD2 C 13 130.076 0.300 . 1 . . . . 100 PHE CD2 . 11129 1 1210 . 1 1 100 100 PHE CE1 C 13 127.623 0.300 . 1 . . . . 100 PHE CE1 . 11129 1 1211 . 1 1 100 100 PHE CE2 C 13 127.623 0.300 . 1 . . . . 100 PHE CE2 . 11129 1 1212 . 1 1 100 100 PHE CZ C 13 125.770 0.300 . 1 . . . . 100 PHE CZ . 11129 1 1213 . 1 1 100 100 PHE N N 15 121.814 0.300 . 1 . . . . 100 PHE N . 11129 1 1214 . 1 1 101 101 SER H H 1 8.651 0.030 . 1 . . . . 101 SER H . 11129 1 1215 . 1 1 101 101 SER HA H 1 3.856 0.030 . 1 . . . . 101 SER HA . 11129 1 1216 . 1 1 101 101 SER C C 13 174.793 0.300 . 1 . . . . 101 SER C . 11129 1 1217 . 1 1 101 101 SER CA C 13 59.602 0.300 . 1 . . . . 101 SER CA . 11129 1 1218 . 1 1 101 101 SER N N 15 114.090 0.300 . 1 . . . . 101 SER N . 11129 1 1219 . 1 1 102 102 LYS H H 1 7.185 0.030 . 1 . . . . 102 LYS H . 11129 1 1220 . 1 1 102 102 LYS HA H 1 3.924 0.030 . 1 . . . . 102 LYS HA . 11129 1 1221 . 1 1 102 102 LYS HB2 H 1 1.870 0.030 . 2 . . . . 102 LYS HB2 . 11129 1 1222 . 1 1 102 102 LYS HB3 H 1 1.653 0.030 . 2 . . . . 102 LYS HB3 . 11129 1 1223 . 1 1 102 102 LYS HD2 H 1 1.606 0.030 . 2 . . . . 102 LYS HD2 . 11129 1 1224 . 1 1 102 102 LYS HD3 H 1 1.701 0.030 . 2 . . . . 102 LYS HD3 . 11129 1 1225 . 1 1 102 102 LYS HE2 H 1 2.896 0.030 . 2 . . . . 102 LYS HE2 . 11129 1 1226 . 1 1 102 102 LYS HG2 H 1 1.329 0.030 . 2 . . . . 102 LYS HG2 . 11129 1 1227 . 1 1 102 102 LYS HG3 H 1 1.444 0.030 . 2 . . . . 102 LYS HG3 . 11129 1 1228 . 1 1 102 102 LYS C C 13 176.260 0.300 . 1 . . . . 102 LYS C . 11129 1 1229 . 1 1 102 102 LYS CA C 13 56.585 0.300 . 1 . . . . 102 LYS CA . 11129 1 1230 . 1 1 102 102 LYS CB C 13 30.390 0.300 . 1 . . . . 102 LYS CB . 11129 1 1231 . 1 1 102 102 LYS CD C 13 26.915 0.300 . 1 . . . . 102 LYS CD . 11129 1 1232 . 1 1 102 102 LYS CE C 13 39.613 0.300 . 1 . . . . 102 LYS CE . 11129 1 1233 . 1 1 102 102 LYS CG C 13 23.119 0.300 . 1 . . . . 102 LYS CG . 11129 1 1234 . 1 1 102 102 LYS N N 15 121.109 0.300 . 1 . . . . 102 LYS N . 11129 1 1235 . 1 1 103 103 VAL H H 1 6.564 0.030 . 1 . . . . 103 VAL H . 11129 1 1236 . 1 1 103 103 VAL HA H 1 2.809 0.030 . 1 . . . . 103 VAL HA . 11129 1 1237 . 1 1 103 103 VAL HB H 1 1.227 0.030 . 1 . . . . 103 VAL HB . 11129 1 1238 . 1 1 103 103 VAL HG11 H 1 0.083 0.030 . 1 . . . . 103 VAL HG1 . 11129 1 1239 . 1 1 103 103 VAL HG12 H 1 0.083 0.030 . 1 . . . . 103 VAL HG1 . 11129 1 1240 . 1 1 103 103 VAL HG13 H 1 0.083 0.030 . 1 . . . . 103 VAL HG1 . 11129 1 1241 . 1 1 103 103 VAL HG21 H 1 -0.216 0.030 . 1 . . . . 103 VAL HG2 . 11129 1 1242 . 1 1 103 103 VAL HG22 H 1 -0.216 0.030 . 1 . . . . 103 VAL HG2 . 11129 1 1243 . 1 1 103 103 VAL HG23 H 1 -0.216 0.030 . 1 . . . . 103 VAL HG2 . 11129 1 1244 . 1 1 103 103 VAL C C 13 175.466 0.300 . 1 . . . . 103 VAL C . 11129 1 1245 . 1 1 103 103 VAL CA C 13 61.911 0.300 . 1 . . . . 103 VAL CA . 11129 1 1246 . 1 1 103 103 VAL CB C 13 27.596 0.300 . 1 . . . . 103 VAL CB . 11129 1 1247 . 1 1 103 103 VAL CG1 C 13 17.293 0.300 . 2 . . . . 103 VAL CG1 . 11129 1 1248 . 1 1 103 103 VAL CG2 C 13 18.143 0.300 . 2 . . . . 103 VAL CG2 . 11129 1 1249 . 1 1 103 103 VAL N N 15 119.774 0.300 . 1 . . . . 103 VAL N . 11129 1 1250 . 1 1 104 104 LEU H H 1 7.526 0.030 . 1 . . . . 104 LEU H . 11129 1 1251 . 1 1 104 104 LEU HA H 1 3.463 0.030 . 1 . . . . 104 LEU HA . 11129 1 1252 . 1 1 104 104 LEU HB2 H 1 1.443 0.030 . 2 . . . . 104 LEU HB2 . 11129 1 1253 . 1 1 104 104 LEU HB3 H 1 1.116 0.030 . 2 . . . . 104 LEU HB3 . 11129 1 1254 . 1 1 104 104 LEU HD11 H 1 0.700 0.030 . 1 . . . . 104 LEU HD1 . 11129 1 1255 . 1 1 104 104 LEU HD12 H 1 0.700 0.030 . 1 . . . . 104 LEU HD1 . 11129 1 1256 . 1 1 104 104 LEU HD13 H 1 0.700 0.030 . 1 . . . . 104 LEU HD1 . 11129 1 1257 . 1 1 104 104 LEU HD21 H 1 0.666 0.030 . 1 . . . . 104 LEU HD2 . 11129 1 1258 . 1 1 104 104 LEU HD22 H 1 0.666 0.030 . 1 . . . . 104 LEU HD2 . 11129 1 1259 . 1 1 104 104 LEU HD23 H 1 0.666 0.030 . 1 . . . . 104 LEU HD2 . 11129 1 1260 . 1 1 104 104 LEU HG H 1 1.296 0.030 . 1 . . . . 104 LEU HG . 11129 1 1261 . 1 1 104 104 LEU C C 13 175.889 0.300 . 1 . . . . 104 LEU C . 11129 1 1262 . 1 1 104 104 LEU CA C 13 55.489 0.300 . 1 . . . . 104 LEU CA . 11129 1 1263 . 1 1 104 104 LEU CB C 13 38.485 0.300 . 1 . . . . 104 LEU CB . 11129 1 1264 . 1 1 104 104 LEU CD1 C 13 22.516 0.300 . 2 . . . . 104 LEU CD1 . 11129 1 1265 . 1 1 104 104 LEU CD2 C 13 22.776 0.300 . 2 . . . . 104 LEU CD2 . 11129 1 1266 . 1 1 104 104 LEU CG C 13 23.838 0.300 . 1 . . . . 104 LEU CG . 11129 1 1267 . 1 1 104 104 LEU N N 15 117.997 0.300 . 1 . . . . 104 LEU N . 11129 1 1268 . 1 1 105 105 SER H H 1 7.790 0.030 . 1 . . . . 105 SER H . 11129 1 1269 . 1 1 105 105 SER HA H 1 3.836 0.030 . 1 . . . . 105 SER HA . 11129 1 1270 . 1 1 105 105 SER HB2 H 1 3.975 0.030 . 2 . . . . 105 SER HB2 . 11129 1 1271 . 1 1 105 105 SER HB3 H 1 3.835 0.030 . 2 . . . . 105 SER HB3 . 11129 1 1272 . 1 1 105 105 SER C C 13 175.797 0.300 . 1 . . . . 105 SER C . 11129 1 1273 . 1 1 105 105 SER CA C 13 60.049 0.300 . 1 . . . . 105 SER CA . 11129 1 1274 . 1 1 105 105 SER CB C 13 60.049 0.300 . 1 . . . . 105 SER CB . 11129 1 1275 . 1 1 105 105 SER N N 15 112.214 0.300 . 1 . . . . 105 SER N . 11129 1 1276 . 1 1 106 106 THR H H 1 7.852 0.030 . 1 . . . . 106 THR H . 11129 1 1277 . 1 1 106 106 THR HA H 1 4.020 0.030 . 1 . . . . 106 THR HA . 11129 1 1278 . 1 1 106 106 THR HB H 1 4.383 0.030 . 1 . . . . 106 THR HB . 11129 1 1279 . 1 1 106 106 THR HG21 H 1 1.369 0.030 . 1 . . . . 106 THR HG2 . 11129 1 1280 . 1 1 106 106 THR HG22 H 1 1.369 0.030 . 1 . . . . 106 THR HG2 . 11129 1 1281 . 1 1 106 106 THR HG23 H 1 1.369 0.030 . 1 . . . . 106 THR HG2 . 11129 1 1282 . 1 1 106 106 THR C C 13 173.671 0.300 . 1 . . . . 106 THR C . 11129 1 1283 . 1 1 106 106 THR CA C 13 65.939 0.300 . 1 . . . . 106 THR CA . 11129 1 1284 . 1 1 106 106 THR CB C 13 66.531 0.300 . 1 . . . . 106 THR CB . 11129 1 1285 . 1 1 106 106 THR CG2 C 13 19.697 0.300 . 1 . . . . 106 THR CG2 . 11129 1 1286 . 1 1 106 106 THR N N 15 120.926 0.300 . 1 . . . . 106 THR N . 11129 1 1287 . 1 1 107 107 LEU H H 1 8.341 0.030 . 1 . . . . 107 LEU H . 11129 1 1288 . 1 1 107 107 LEU HA H 1 3.983 0.030 . 1 . . . . 107 LEU HA . 11129 1 1289 . 1 1 107 107 LEU HB2 H 1 1.963 0.030 . 2 . . . . 107 LEU HB2 . 11129 1 1290 . 1 1 107 107 LEU HB3 H 1 1.368 0.030 . 2 . . . . 107 LEU HB3 . 11129 1 1291 . 1 1 107 107 LEU HD11 H 1 0.652 0.030 . 1 . . . . 107 LEU HD1 . 11129 1 1292 . 1 1 107 107 LEU HD12 H 1 0.652 0.030 . 1 . . . . 107 LEU HD1 . 11129 1 1293 . 1 1 107 107 LEU HD13 H 1 0.652 0.030 . 1 . . . . 107 LEU HD1 . 11129 1 1294 . 1 1 107 107 LEU HD21 H 1 0.757 0.030 . 1 . . . . 107 LEU HD2 . 11129 1 1295 . 1 1 107 107 LEU HD22 H 1 0.757 0.030 . 1 . . . . 107 LEU HD2 . 11129 1 1296 . 1 1 107 107 LEU HD23 H 1 0.757 0.030 . 1 . . . . 107 LEU HD2 . 11129 1 1297 . 1 1 107 107 LEU HG H 1 1.884 0.030 . 1 . . . . 107 LEU HG . 11129 1 1298 . 1 1 107 107 LEU C C 13 176.350 0.300 . 1 . . . . 107 LEU C . 11129 1 1299 . 1 1 107 107 LEU CA C 13 56.639 0.300 . 1 . . . . 107 LEU CA . 11129 1 1300 . 1 1 107 107 LEU CB C 13 38.823 0.300 . 1 . . . . 107 LEU CB . 11129 1 1301 . 1 1 107 107 LEU CD1 C 13 23.838 0.300 . 2 . . . . 107 LEU CD1 . 11129 1 1302 . 1 1 107 107 LEU CD2 C 13 20.136 0.300 . 2 . . . . 107 LEU CD2 . 11129 1 1303 . 1 1 107 107 LEU CG C 13 24.600 0.300 . 1 . . . . 107 LEU CG . 11129 1 1304 . 1 1 107 107 LEU N N 15 120.171 0.300 . 1 . . . . 107 LEU N . 11129 1 1305 . 1 1 108 108 LEU H H 1 8.701 0.030 . 1 . . . . 108 LEU H . 11129 1 1306 . 1 1 108 108 LEU HA H 1 3.658 0.030 . 1 . . . . 108 LEU HA . 11129 1 1307 . 1 1 108 108 LEU HB2 H 1 1.729 0.030 . 2 . . . . 108 LEU HB2 . 11129 1 1308 . 1 1 108 108 LEU HB3 H 1 1.285 0.030 . 2 . . . . 108 LEU HB3 . 11129 1 1309 . 1 1 108 108 LEU HD11 H 1 0.699 0.030 . 1 . . . . 108 LEU HD1 . 11129 1 1310 . 1 1 108 108 LEU HD12 H 1 0.699 0.030 . 1 . . . . 108 LEU HD1 . 11129 1 1311 . 1 1 108 108 LEU HD13 H 1 0.699 0.030 . 1 . . . . 108 LEU HD1 . 11129 1 1312 . 1 1 108 108 LEU HD21 H 1 0.651 0.030 . 1 . . . . 108 LEU HD2 . 11129 1 1313 . 1 1 108 108 LEU HD22 H 1 0.651 0.030 . 1 . . . . 108 LEU HD2 . 11129 1 1314 . 1 1 108 108 LEU HD23 H 1 0.651 0.030 . 1 . . . . 108 LEU HD2 . 11129 1 1315 . 1 1 108 108 LEU HG H 1 1.466 0.030 . 1 . . . . 108 LEU HG . 11129 1 1316 . 1 1 108 108 LEU C C 13 176.924 0.300 . 1 . . . . 108 LEU C . 11129 1 1317 . 1 1 108 108 LEU CA C 13 55.860 0.300 . 1 . . . . 108 LEU CA . 11129 1 1318 . 1 1 108 108 LEU CB C 13 39.127 0.300 . 1 . . . . 108 LEU CB . 11129 1 1319 . 1 1 108 108 LEU CD1 C 13 23.456 0.300 . 2 . . . . 108 LEU CD1 . 11129 1 1320 . 1 1 108 108 LEU CD2 C 13 20.353 0.300 . 2 . . . . 108 LEU CD2 . 11129 1 1321 . 1 1 108 108 LEU CG C 13 24.871 0.300 . 1 . . . . 108 LEU CG . 11129 1 1322 . 1 1 108 108 LEU N N 15 119.462 0.300 . 1 . . . . 108 LEU N . 11129 1 1323 . 1 1 109 109 ALA H H 1 7.836 0.030 . 1 . . . . 109 ALA H . 11129 1 1324 . 1 1 109 109 ALA HA H 1 4.080 0.030 . 1 . . . . 109 ALA HA . 11129 1 1325 . 1 1 109 109 ALA HB1 H 1 1.564 0.030 . 1 . . . . 109 ALA HB . 11129 1 1326 . 1 1 109 109 ALA HB2 H 1 1.564 0.030 . 1 . . . . 109 ALA HB . 11129 1 1327 . 1 1 109 109 ALA HB3 H 1 1.564 0.030 . 1 . . . . 109 ALA HB . 11129 1 1328 . 1 1 109 109 ALA C C 13 178.935 0.300 . 1 . . . . 109 ALA C . 11129 1 1329 . 1 1 109 109 ALA CA C 13 52.795 0.300 . 1 . . . . 109 ALA CA . 11129 1 1330 . 1 1 109 109 ALA CB C 13 15.994 0.300 . 1 . . . . 109 ALA CB . 11129 1 1331 . 1 1 109 109 ALA N N 15 122.668 0.300 . 1 . . . . 109 ALA N . 11129 1 1332 . 1 1 110 110 VAL H H 1 8.759 0.030 . 1 . . . . 110 VAL H . 11129 1 1333 . 1 1 110 110 VAL HA H 1 3.425 0.030 . 1 . . . . 110 VAL HA . 11129 1 1334 . 1 1 110 110 VAL HB H 1 2.391 0.030 . 1 . . . . 110 VAL HB . 11129 1 1335 . 1 1 110 110 VAL HG11 H 1 0.969 0.030 . 1 . . . . 110 VAL HG1 . 11129 1 1336 . 1 1 110 110 VAL HG12 H 1 0.969 0.030 . 1 . . . . 110 VAL HG1 . 11129 1 1337 . 1 1 110 110 VAL HG13 H 1 0.969 0.030 . 1 . . . . 110 VAL HG1 . 11129 1 1338 . 1 1 110 110 VAL HG21 H 1 1.133 0.030 . 1 . . . . 110 VAL HG2 . 11129 1 1339 . 1 1 110 110 VAL HG22 H 1 1.133 0.030 . 1 . . . . 110 VAL HG2 . 11129 1 1340 . 1 1 110 110 VAL HG23 H 1 1.133 0.030 . 1 . . . . 110 VAL HG2 . 11129 1 1341 . 1 1 110 110 VAL C C 13 175.894 0.300 . 1 . . . . 110 VAL C . 11129 1 1342 . 1 1 110 110 VAL CA C 13 64.694 0.300 . 1 . . . . 110 VAL CA . 11129 1 1343 . 1 1 110 110 VAL CB C 13 29.426 0.300 . 1 . . . . 110 VAL CB . 11129 1 1344 . 1 1 110 110 VAL CG1 C 13 20.058 0.300 . 2 . . . . 110 VAL CG1 . 11129 1 1345 . 1 1 110 110 VAL CG2 C 13 22.119 0.300 . 2 . . . . 110 VAL CG2 . 11129 1 1346 . 1 1 110 110 VAL N N 15 121.244 0.300 . 1 . . . . 110 VAL N . 11129 1 1347 . 1 1 111 111 ASN H H 1 8.066 0.030 . 1 . . . . 111 ASN H . 11129 1 1348 . 1 1 111 111 ASN HA H 1 3.431 0.030 . 1 . . . . 111 ASN HA . 11129 1 1349 . 1 1 111 111 ASN HB2 H 1 2.199 0.030 . 2 . . . . 111 ASN HB2 . 11129 1 1350 . 1 1 111 111 ASN HB3 H 1 0.744 0.030 . 2 . . . . 111 ASN HB3 . 11129 1 1351 . 1 1 111 111 ASN HD21 H 1 4.186 0.030 . 2 . . . . 111 ASN HD21 . 11129 1 1352 . 1 1 111 111 ASN HD22 H 1 6.358 0.030 . 2 . . . . 111 ASN HD22 . 11129 1 1353 . 1 1 111 111 ASN C C 13 174.032 0.300 . 1 . . . . 111 ASN C . 11129 1 1354 . 1 1 111 111 ASN CA C 13 55.082 0.300 . 1 . . . . 111 ASN CA . 11129 1 1355 . 1 1 111 111 ASN CB C 13 35.790 0.300 . 1 . . . . 111 ASN CB . 11129 1 1356 . 1 1 111 111 ASN N N 15 120.570 0.300 . 1 . . . . 111 ASN N . 11129 1 1357 . 1 1 111 111 ASN ND2 N 15 107.952 0.300 . 1 . . . . 111 ASN ND2 . 11129 1 1358 . 1 1 112 112 LYS H H 1 7.818 0.030 . 1 . . . . 112 LYS H . 11129 1 1359 . 1 1 112 112 LYS HA H 1 3.811 0.030 . 1 . . . . 112 LYS HA . 11129 1 1360 . 1 1 112 112 LYS HB2 H 1 1.741 0.030 . 2 . . . . 112 LYS HB2 . 11129 1 1361 . 1 1 112 112 LYS HD2 H 1 1.529 0.030 . 2 . . . . 112 LYS HD2 . 11129 1 1362 . 1 1 112 112 LYS HE2 H 1 2.820 0.030 . 2 . . . . 112 LYS HE2 . 11129 1 1363 . 1 1 112 112 LYS HG2 H 1 1.340 0.030 . 2 . . . . 112 LYS HG2 . 11129 1 1364 . 1 1 112 112 LYS C C 13 176.415 0.300 . 1 . . . . 112 LYS C . 11129 1 1365 . 1 1 112 112 LYS CA C 13 56.409 0.300 . 1 . . . . 112 LYS CA . 11129 1 1366 . 1 1 112 112 LYS CB C 13 29.704 0.300 . 1 . . . . 112 LYS CB . 11129 1 1367 . 1 1 112 112 LYS CD C 13 26.325 0.300 . 1 . . . . 112 LYS CD . 11129 1 1368 . 1 1 112 112 LYS CE C 13 39.665 0.300 . 1 . . . . 112 LYS CE . 11129 1 1369 . 1 1 112 112 LYS CG C 13 22.284 0.300 . 1 . . . . 112 LYS CG . 11129 1 1370 . 1 1 112 112 LYS N N 15 118.053 0.300 . 1 . . . . 112 LYS N . 11129 1 1371 . 1 1 113 113 ALA H H 1 7.992 0.030 . 1 . . . . 113 ALA H . 11129 1 1372 . 1 1 113 113 ALA HA H 1 4.158 0.030 . 1 . . . . 113 ALA HA . 11129 1 1373 . 1 1 113 113 ALA HB1 H 1 1.439 0.030 . 1 . . . . 113 ALA HB . 11129 1 1374 . 1 1 113 113 ALA HB2 H 1 1.439 0.030 . 1 . . . . 113 ALA HB . 11129 1 1375 . 1 1 113 113 ALA HB3 H 1 1.439 0.030 . 1 . . . . 113 ALA HB . 11129 1 1376 . 1 1 113 113 ALA C C 13 176.616 0.300 . 1 . . . . 113 ALA C . 11129 1 1377 . 1 1 113 113 ALA CA C 13 51.694 0.300 . 1 . . . . 113 ALA CA . 11129 1 1378 . 1 1 113 113 ALA CB C 13 16.864 0.300 . 1 . . . . 113 ALA CB . 11129 1 1379 . 1 1 113 113 ALA N N 15 118.700 0.300 . 1 . . . . 113 ALA N . 11129 1 1380 . 1 1 114 114 THR H H 1 7.475 0.030 . 1 . . . . 114 THR H . 11129 1 1381 . 1 1 114 114 THR HA H 1 4.446 0.030 . 1 . . . . 114 THR HA . 11129 1 1382 . 1 1 114 114 THR HB H 1 4.493 0.030 . 1 . . . . 114 THR HB . 11129 1 1383 . 1 1 114 114 THR HG21 H 1 1.270 0.030 . 1 . . . . 114 THR HG2 . 11129 1 1384 . 1 1 114 114 THR HG22 H 1 1.270 0.030 . 1 . . . . 114 THR HG2 . 11129 1 1385 . 1 1 114 114 THR HG23 H 1 1.270 0.030 . 1 . . . . 114 THR HG2 . 11129 1 1386 . 1 1 114 114 THR C C 13 172.718 0.300 . 1 . . . . 114 THR C . 11129 1 1387 . 1 1 114 114 THR CA C 13 59.407 0.300 . 1 . . . . 114 THR CA . 11129 1 1388 . 1 1 114 114 THR CB C 13 68.239 0.300 . 1 . . . . 114 THR CB . 11129 1 1389 . 1 1 114 114 THR CG2 C 13 19.891 0.300 . 1 . . . . 114 THR CG2 . 11129 1 1390 . 1 1 114 114 THR N N 15 104.807 0.300 . 1 . . . . 114 THR N . 11129 1 1391 . 1 1 115 115 GLU H H 1 7.502 0.030 . 1 . . . . 115 GLU H . 11129 1 1392 . 1 1 115 115 GLU HA H 1 4.257 0.030 . 1 . . . . 115 GLU HA . 11129 1 1393 . 1 1 115 115 GLU HB2 H 1 1.935 0.030 . 1 . . . . 115 GLU HB2 . 11129 1 1394 . 1 1 115 115 GLU HB3 H 1 1.935 0.030 . 1 . . . . 115 GLU HB3 . 11129 1 1395 . 1 1 115 115 GLU HG2 H 1 2.142 0.030 . 2 . . . . 115 GLU HG2 . 11129 1 1396 . 1 1 115 115 GLU HG3 H 1 2.189 0.030 . 2 . . . . 115 GLU HG3 . 11129 1 1397 . 1 1 115 115 GLU C C 13 174.464 0.300 . 1 . . . . 115 GLU C . 11129 1 1398 . 1 1 115 115 GLU CA C 13 55.047 0.300 . 1 . . . . 115 GLU CA . 11129 1 1399 . 1 1 115 115 GLU CB C 13 27.617 0.300 . 1 . . . . 115 GLU CB . 11129 1 1400 . 1 1 115 115 GLU CG C 13 33.548 0.300 . 1 . . . . 115 GLU CG . 11129 1 1401 . 1 1 115 115 GLU N N 15 122.783 0.300 . 1 . . . . 115 GLU N . 11129 1 1402 . 1 1 116 116 SER H H 1 8.274 0.030 . 1 . . . . 116 SER H . 11129 1 1403 . 1 1 116 116 SER HA H 1 4.461 0.030 . 1 . . . . 116 SER HA . 11129 1 1404 . 1 1 116 116 SER HB2 H 1 3.822 0.030 . 2 . . . . 116 SER HB2 . 11129 1 1405 . 1 1 116 116 SER C C 13 172.402 0.300 . 1 . . . . 116 SER C . 11129 1 1406 . 1 1 116 116 SER CA C 13 56.143 0.300 . 1 . . . . 116 SER CA . 11129 1 1407 . 1 1 116 116 SER CB C 13 61.581 0.300 . 1 . . . . 116 SER CB . 11129 1 1408 . 1 1 116 116 SER N N 15 116.125 0.300 . 1 . . . . 116 SER N . 11129 1 1409 . 1 1 117 117 GLY H H 1 8.127 0.030 . 1 . . . . 117 GLY H . 11129 1 1410 . 1 1 117 117 GLY HA2 H 1 4.010 0.030 . 2 . . . . 117 GLY HA2 . 11129 1 1411 . 1 1 117 117 GLY HA3 H 1 4.102 0.030 . 2 . . . . 117 GLY HA3 . 11129 1 1412 . 1 1 117 117 GLY C C 13 169.532 0.300 . 1 . . . . 117 GLY C . 11129 1 1413 . 1 1 117 117 GLY CA C 13 42.400 0.300 . 1 . . . . 117 GLY CA . 11129 1 1414 . 1 1 117 117 GLY N N 15 110.272 0.300 . 1 . . . . 117 GLY N . 11129 1 1415 . 1 1 118 118 PRO HA H 1 4.399 0.030 . 1 . . . . 118 PRO HA . 11129 1 1416 . 1 1 118 118 PRO HB2 H 1 2.208 0.030 . 2 . . . . 118 PRO HB2 . 11129 1 1417 . 1 1 118 118 PRO HB3 H 1 1.880 0.030 . 2 . . . . 118 PRO HB3 . 11129 1 1418 . 1 1 118 118 PRO HD2 H 1 3.557 0.030 . 1 . . . . 118 PRO HD2 . 11129 1 1419 . 1 1 118 118 PRO HD3 H 1 3.557 0.030 . 1 . . . . 118 PRO HD3 . 11129 1 1420 . 1 1 118 118 PRO HG2 H 1 1.931 0.030 . 2 . . . . 118 PRO HG2 . 11129 1 1421 . 1 1 118 118 PRO CA C 13 60.917 0.300 . 1 . . . . 118 PRO CA . 11129 1 1422 . 1 1 118 118 PRO CB C 13 29.843 0.300 . 1 . . . . 118 PRO CB . 11129 1 1423 . 1 1 118 118 PRO CD C 13 47.510 0.300 . 1 . . . . 118 PRO CD . 11129 1 1424 . 1 1 118 118 PRO CG C 13 24.871 0.300 . 1 . . . . 118 PRO CG . 11129 1 1425 . 1 1 119 119 SER H H 1 8.456 0.030 . 1 . . . . 119 SER H . 11129 1 1426 . 1 1 119 119 SER CA C 13 56.017 0.300 . 1 . . . . 119 SER CA . 11129 1 1427 . 1 1 119 119 SER CB C 13 61.539 0.300 . 1 . . . . 119 SER CB . 11129 1 1428 . 1 1 119 119 SER N N 15 116.119 0.300 . 1 . . . . 119 SER N . 11129 1 1429 . 1 1 120 120 SER CA C 13 56.099 0.300 . 1 . . . . 120 SER CA . 11129 1 1430 . 1 1 120 120 SER CB C 13 61.704 0.300 . 1 . . . . 120 SER CB . 11129 1 1431 . 1 1 121 121 GLY H H 1 7.970 0.030 . 1 . . . . 121 GLY H . 11129 1 1432 . 1 1 121 121 GLY CA C 13 44.064 0.300 . 1 . . . . 121 GLY CA . 11129 1 1433 . 1 1 121 121 GLY N N 15 116.483 0.300 . 1 . . . . 121 GLY N . 11129 1 stop_ save_