data_27753 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27753 _Entry.Title ; The cytoplasm-entry domain of antibacterial CdiA is a dynamic alpha-helical bundle with disulfide-dependent structural features ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-01-15 _Entry.Accession_date 2019-01-15 _Entry.Last_release_date 2019-01-16 _Entry.Original_release_date 2019-01-16 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Nicholas Bartelli . L. . . 27753 2 Sheng Sun . . . . 27753 3 Grant Gucinski . C. . . 27753 4 Hongjun Zhou . . . . 27753 5 Kiho Song . . . . 27753 6 Christopher Hayes . S. . . 27753 7 Frederick Dahlquist . . . . 27753 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of California Santa Barbara' . 27753 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27753 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 421 27753 '15N chemical shifts' 136 27753 '1H chemical shifts' 847 27753 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 2 . . 2019-09-23 2019-01-15 update BMRB 'update entry citation' 27753 1 . . 2019-01-18 2019-01-15 original author 'original release' 27753 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27754 'CdiA-CT MHI813 Cys21Ser Cys27Ser cytoplasm entry domain monomer' 27753 BMRB 27755 'CdiA-CT MHI813 Cys49Ser Cys56Ser cytoplasm entry domain monomer' 27753 NCBI WP_001383049.1 'CdiA from Escherichia coli MHI813' 27753 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27753 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 31181288 _Citation.Full_citation . _Citation.Title ; The Cytoplasm-Entry Domain of Antibacterial CdiA Is a Dynamic alpha-Helical Bundle with Disulfide-Dependent Structural Features ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 431 _Citation.Journal_issue 17 _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 3203 _Citation.Year 3216 _Citation.Details 2019 loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Nicholas Bartelli . L. . . 27753 1 2 Sheng Sun . . . . 27753 1 3 Grant Gucinski . C. . . 27753 1 4 Hongjun Zhou . . . . 27753 1 5 Kiho Song . . . . 27753 1 6 Christopher Hayes . S. . . 27753 1 7 Frederick Dahlquist . W. . . 27753 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID CdiA 27753 1 MetI 27753 1 T5SS 27753 1 antibacterial 27753 1 'cytoplasm entry' 27753 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 27753 _Assembly.ID 1 _Assembly.Name CdiA-CT _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 15943 _Assembly.Enzyme_commission_number . _Assembly.Details 'CdiA-CT MHI813 cytoplasm entry domain monomer' _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 CdiA-CT 1 $CdiA-CT A . yes 'partially disordered' no no . . . 27753 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'entry of nuclease toxin into bacterial cytoplasm' 27753 1 'metI dependent bacterial cytoplasm entry' 27753 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CdiA-CT _Entity.Sf_category entity _Entity.Sf_framecode CdiA-CT _Entity.Entry_ID 27753 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CdiA-CT _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; VENNFLTADQIDSFAAKAKG CEVRGDCKQIVKEMEELSLK QQQEMIAVCATNPAACKEKF GDIPAKGMLVREAIDRVLGT DVPSAMKNDMSSLLAQQIEA EGVVTSTEFASQLQNRYGID KQQAEILAVAALGAVTGGMG KSGTSTVTKN ; _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 150 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'cytoplasm entry domain' _Entity.Mutation WT _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15943 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes NCBI WP_001383049.1 . CdiA . . . . . . . . . . . . . . 27753 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Entry of nuclease toxin into bacterial cytoplasm' 27753 1 'metI dependent bacterial cytoplasm entry' 27753 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 . VAL . 27753 1 2 . GLU . 27753 1 3 . ASN . 27753 1 4 . ASN . 27753 1 5 . PHE . 27753 1 6 . LEU . 27753 1 7 . THR . 27753 1 8 . ALA . 27753 1 9 . ASP . 27753 1 10 . GLN . 27753 1 11 . ILE . 27753 1 12 . ASP . 27753 1 13 . SER . 27753 1 14 . PHE . 27753 1 15 . ALA . 27753 1 16 . ALA . 27753 1 17 . LYS . 27753 1 18 . ALA . 27753 1 19 . LYS . 27753 1 20 . GLY . 27753 1 21 . CYS . 27753 1 22 . GLU . 27753 1 23 . VAL . 27753 1 24 . ARG . 27753 1 25 . GLY . 27753 1 26 . ASP . 27753 1 27 . CYS . 27753 1 28 . LYS . 27753 1 29 . GLN . 27753 1 30 . ILE . 27753 1 31 . VAL . 27753 1 32 . LYS . 27753 1 33 . GLU . 27753 1 34 . MET . 27753 1 35 . GLU . 27753 1 36 . GLU . 27753 1 37 . LEU . 27753 1 38 . SER . 27753 1 39 . LEU . 27753 1 40 . LYS . 27753 1 41 . GLN . 27753 1 42 . GLN . 27753 1 43 . GLN . 27753 1 44 . GLU . 27753 1 45 . MET . 27753 1 46 . ILE . 27753 1 47 . ALA . 27753 1 48 . VAL . 27753 1 49 . CYS . 27753 1 50 . ALA . 27753 1 51 . THR . 27753 1 52 . ASN . 27753 1 53 . PRO . 27753 1 54 . ALA . 27753 1 55 . ALA . 27753 1 56 . CYS . 27753 1 57 . LYS . 27753 1 58 . GLU . 27753 1 59 . LYS . 27753 1 60 . PHE . 27753 1 61 . GLY . 27753 1 62 . ASP . 27753 1 63 . ILE . 27753 1 64 . PRO . 27753 1 65 . ALA . 27753 1 66 . LYS . 27753 1 67 . GLY . 27753 1 68 . MET . 27753 1 69 . LEU . 27753 1 70 . VAL . 27753 1 71 . ARG . 27753 1 72 . GLU . 27753 1 73 . ALA . 27753 1 74 . ILE . 27753 1 75 . ASP . 27753 1 76 . ARG . 27753 1 77 . VAL . 27753 1 78 . LEU . 27753 1 79 . GLY . 27753 1 80 . THR . 27753 1 81 . ASP . 27753 1 82 . VAL . 27753 1 83 . PRO . 27753 1 84 . SER . 27753 1 85 . ALA . 27753 1 86 . MET . 27753 1 87 . LYS . 27753 1 88 . ASN . 27753 1 89 . ASP . 27753 1 90 . MET . 27753 1 91 . SER . 27753 1 92 . SER . 27753 1 93 . LEU . 27753 1 94 . LEU . 27753 1 95 . ALA . 27753 1 96 . GLN . 27753 1 97 . GLN . 27753 1 98 . ILE . 27753 1 99 . GLU . 27753 1 100 . ALA . 27753 1 101 . GLU . 27753 1 102 . GLY . 27753 1 103 . VAL . 27753 1 104 . VAL . 27753 1 105 . THR . 27753 1 106 . SER . 27753 1 107 . THR . 27753 1 108 . GLU . 27753 1 109 . PHE . 27753 1 110 . ALA . 27753 1 111 . SER . 27753 1 112 . GLN . 27753 1 113 . LEU . 27753 1 114 . GLN . 27753 1 115 . ASN . 27753 1 116 . ARG . 27753 1 117 . TYR . 27753 1 118 . GLY . 27753 1 119 . ILE . 27753 1 120 . ASP . 27753 1 121 . LYS . 27753 1 122 . GLN . 27753 1 123 . GLN . 27753 1 124 . ALA . 27753 1 125 . GLU . 27753 1 126 . ILE . 27753 1 127 . LEU . 27753 1 128 . ALA . 27753 1 129 . VAL . 27753 1 130 . ALA . 27753 1 131 . ALA . 27753 1 132 . LEU . 27753 1 133 . GLY . 27753 1 134 . ALA . 27753 1 135 . VAL . 27753 1 136 . THR . 27753 1 137 . GLY . 27753 1 138 . GLY . 27753 1 139 . MET . 27753 1 140 . GLY . 27753 1 141 . LYS . 27753 1 142 . SER . 27753 1 143 . GLY . 27753 1 144 . THR . 27753 1 145 . SER . 27753 1 146 . THR . 27753 1 147 . VAL . 27753 1 148 . THR . 27753 1 149 . LYS . 27753 1 150 . ASN . 27753 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 . VAL 1 1 27753 1 . GLU 2 2 27753 1 . ASN 3 3 27753 1 . ASN 4 4 27753 1 . PHE 5 5 27753 1 . LEU 6 6 27753 1 . THR 7 7 27753 1 . ALA 8 8 27753 1 . ASP 9 9 27753 1 . GLN 10 10 27753 1 . ILE 11 11 27753 1 . ASP 12 12 27753 1 . SER 13 13 27753 1 . PHE 14 14 27753 1 . ALA 15 15 27753 1 . ALA 16 16 27753 1 . LYS 17 17 27753 1 . ALA 18 18 27753 1 . LYS 19 19 27753 1 . GLY 20 20 27753 1 . CYS 21 21 27753 1 . GLU 22 22 27753 1 . VAL 23 23 27753 1 . ARG 24 24 27753 1 . GLY 25 25 27753 1 . ASP 26 26 27753 1 . CYS 27 27 27753 1 . LYS 28 28 27753 1 . GLN 29 29 27753 1 . ILE 30 30 27753 1 . VAL 31 31 27753 1 . LYS 32 32 27753 1 . GLU 33 33 27753 1 . MET 34 34 27753 1 . GLU 35 35 27753 1 . GLU 36 36 27753 1 . LEU 37 37 27753 1 . SER 38 38 27753 1 . LEU 39 39 27753 1 . LYS 40 40 27753 1 . GLN 41 41 27753 1 . GLN 42 42 27753 1 . GLN 43 43 27753 1 . GLU 44 44 27753 1 . MET 45 45 27753 1 . ILE 46 46 27753 1 . ALA 47 47 27753 1 . VAL 48 48 27753 1 . CYS 49 49 27753 1 . ALA 50 50 27753 1 . THR 51 51 27753 1 . ASN 52 52 27753 1 . PRO 53 53 27753 1 . ALA 54 54 27753 1 . ALA 55 55 27753 1 . CYS 56 56 27753 1 . LYS 57 57 27753 1 . GLU 58 58 27753 1 . LYS 59 59 27753 1 . PHE 60 60 27753 1 . GLY 61 61 27753 1 . ASP 62 62 27753 1 . ILE 63 63 27753 1 . PRO 64 64 27753 1 . ALA 65 65 27753 1 . LYS 66 66 27753 1 . GLY 67 67 27753 1 . MET 68 68 27753 1 . LEU 69 69 27753 1 . VAL 70 70 27753 1 . ARG 71 71 27753 1 . GLU 72 72 27753 1 . ALA 73 73 27753 1 . ILE 74 74 27753 1 . ASP 75 75 27753 1 . ARG 76 76 27753 1 . VAL 77 77 27753 1 . LEU 78 78 27753 1 . GLY 79 79 27753 1 . THR 80 80 27753 1 . ASP 81 81 27753 1 . VAL 82 82 27753 1 . PRO 83 83 27753 1 . SER 84 84 27753 1 . ALA 85 85 27753 1 . MET 86 86 27753 1 . LYS 87 87 27753 1 . ASN 88 88 27753 1 . ASP 89 89 27753 1 . MET 90 90 27753 1 . SER 91 91 27753 1 . SER 92 92 27753 1 . LEU 93 93 27753 1 . LEU 94 94 27753 1 . ALA 95 95 27753 1 . GLN 96 96 27753 1 . GLN 97 97 27753 1 . ILE 98 98 27753 1 . GLU 99 99 27753 1 . ALA 100 100 27753 1 . GLU 101 101 27753 1 . GLY 102 102 27753 1 . VAL 103 103 27753 1 . VAL 104 104 27753 1 . THR 105 105 27753 1 . SER 106 106 27753 1 . THR 107 107 27753 1 . GLU 108 108 27753 1 . PHE 109 109 27753 1 . ALA 110 110 27753 1 . SER 111 111 27753 1 . GLN 112 112 27753 1 . LEU 113 113 27753 1 . GLN 114 114 27753 1 . ASN 115 115 27753 1 . ARG 116 116 27753 1 . TYR 117 117 27753 1 . GLY 118 118 27753 1 . ILE 119 119 27753 1 . ASP 120 120 27753 1 . LYS 121 121 27753 1 . GLN 122 122 27753 1 . GLN 123 123 27753 1 . ALA 124 124 27753 1 . GLU 125 125 27753 1 . ILE 126 126 27753 1 . LEU 127 127 27753 1 . ALA 128 128 27753 1 . VAL 129 129 27753 1 . ALA 130 130 27753 1 . ALA 131 131 27753 1 . LEU 132 132 27753 1 . GLY 133 133 27753 1 . ALA 134 134 27753 1 . VAL 135 135 27753 1 . THR 136 136 27753 1 . GLY 137 137 27753 1 . GLY 138 138 27753 1 . MET 139 139 27753 1 . GLY 140 140 27753 1 . LYS 141 141 27753 1 . SER 142 142 27753 1 . GLY 143 143 27753 1 . THR 144 144 27753 1 . SER 145 145 27753 1 . THR 146 146 27753 1 . VAL 147 147 27753 1 . THR 148 148 27753 1 . LYS 149 149 27753 1 . ASN 150 150 27753 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 27753 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $CdiA-CT . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli MHI813 . . . . . . . . . . cdiA 'antibacterial contact dependent inhibition toxin' 27753 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 27753 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $CdiA-CT . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET21d . . . 27753 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27753 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details 'CdiA-CT reduced by the presence of 10 mM dithiothreitol' _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 CdiA-CT '[U-99% 13C; U-99% 15N]' . . 1 $CdiA-CT . . 1.4 . . mM . . . . 27753 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27753 1 3 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 27753 1 4 Dithiothrietol 'natural abundance' . . . . . . 10 . . mM . . . . 27753 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27753 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details 'These details applicable to all samples' 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' 0.1 . M 27753 1 pH 6.5 . pH 27753 1 pressure 1 . atm 27753 1 temperature 273 . K 27753 1 stop_ save_ ############################ # Computer software used # ############################ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 27753 _Software.ID 1 _Software.Type . _Software.Name ANSIG _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kraulis . . 27753 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27753 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27753 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27753 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 27753 2 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 27753 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 27753 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 27753 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 27753 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27753 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27753 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27753 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27753 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27753 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27753 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27753 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27753 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 27753 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 3 '3D HNCACB' . . . 27753 1 4 '3D CBCA(CO)NH' . . . 27753 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 $ANSIG . . 27753 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 VAL H H 1 8.08 0.02 . 1 . . . . . 1 VAL HN . 27753 1 2 . 1 1 1 1 VAL HA H 1 4.14 0.02 . 1 . . . . . 1 VAL HA . 27753 1 3 . 1 1 1 1 VAL HB H 1 2.05 0.02 . 1 . . . . . 1 VAL HB . 27753 1 4 . 1 1 1 1 VAL HG11 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 5 . 1 1 1 1 VAL HG12 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 6 . 1 1 1 1 VAL HG13 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 7 . 1 1 1 1 VAL HG21 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 8 . 1 1 1 1 VAL HG22 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 9 . 1 1 1 1 VAL HG23 H 1 0.93 0.02 . 1 . . . . . 1 VAL HG . 27753 1 10 . 1 1 1 1 VAL CA C 13 62.49 0.3 . 1 . . . . . 1 VAL CA . 27753 1 11 . 1 1 1 1 VAL CB C 13 32.81 0.3 . 1 . . . . . 1 VAL CB . 27753 1 12 . 1 1 1 1 VAL CG1 C 13 20.93 0.3 . 1 . . . . . 1 VAL CG . 27753 1 13 . 1 1 1 1 VAL CG2 C 13 20.93 0.3 . 1 . . . . . 1 VAL CG . 27753 1 14 . 1 1 1 1 VAL N N 15 124.63 0.15 . 1 . . . . . 1 VAL N . 27753 1 15 . 1 1 2 2 GLU H H 1 8.58 0.02 . 1 . . . . . 2 GLU HN . 27753 1 16 . 1 1 2 2 GLU HA H 1 4.35 0.02 . 1 . . . . . 2 GLU HA . 27753 1 17 . 1 1 2 2 GLU HB2 H 1 2.03 0.02 . 2 . . . . . 2 GLU HB2 . 27753 1 18 . 1 1 2 2 GLU HB3 H 1 1.91 0.02 . 2 . . . . . 2 GLU HB3 . 27753 1 19 . 1 1 2 2 GLU HG2 H 1 2.25 0.02 . 1 . . . . . 2 GLU HG . 27753 1 20 . 1 1 2 2 GLU HG3 H 1 2.25 0.02 . 1 . . . . . 2 GLU HG . 27753 1 21 . 1 1 2 2 GLU CA C 13 56.35 0.3 . 1 . . . . . 2 GLU CA . 27753 1 22 . 1 1 2 2 GLU CB C 13 30.44 0.3 . 1 . . . . . 2 GLU CB . 27753 1 23 . 1 1 2 2 GLU CG C 13 36.21 0.3 . 1 . . . . . 2 GLU CG . 27753 1 24 . 1 1 2 2 GLU N N 15 125 0.15 . 1 . . . . . 2 GLU N . 27753 1 25 . 1 1 3 3 ASN H H 1 8.54 0.02 . 1 . . . . . 3 ASN HN . 27753 1 26 . 1 1 3 3 ASN HA H 1 4.62 0.02 . 1 . . . . . 3 ASN HA . 27753 1 27 . 1 1 3 3 ASN HB2 H 1 2.67 0.02 . 1 . . . . . 3 ASN HB . 27753 1 28 . 1 1 3 3 ASN HB3 H 1 2.67 0.02 . 1 . . . . . 3 ASN HB . 27753 1 29 . 1 1 3 3 ASN CA C 13 53.22 0.3 . 1 . . . . . 3 ASN CA . 27753 1 30 . 1 1 3 3 ASN CB C 13 39.01 0.3 . 1 . . . . . 3 ASN CB . 27753 1 31 . 1 1 3 3 ASN N N 15 120.18 0.15 . 1 . . . . . 3 ASN N . 27753 1 32 . 1 1 4 4 ASN H H 1 8.36 0.02 . 1 . . . . . 4 ASN HN . 27753 1 33 . 1 1 4 4 ASN HA H 1 4.63 0.02 . 1 . . . . . 4 ASN HA . 27753 1 34 . 1 1 4 4 ASN HB2 H 1 2.67 0.02 . 1 . . . . . 4 ASN HB . 27753 1 35 . 1 1 4 4 ASN HB3 H 1 2.67 0.02 . 1 . . . . . 4 ASN HB . 27753 1 36 . 1 1 4 4 ASN CA C 13 53.32 0.3 . 1 . . . . . 4 ASN CA . 27753 1 37 . 1 1 4 4 ASN CB C 13 38.78 0.3 . 1 . . . . . 4 ASN CB . 27753 1 38 . 1 1 4 4 ASN N N 15 119.21 0.15 . 1 . . . . . 4 ASN N . 27753 1 39 . 1 1 5 5 PHE H H 1 8.09 0.02 . 1 . . . . . 5 PHE HN . 27753 1 40 . 1 1 5 5 PHE HA H 1 4.61 0.02 . 1 . . . . . 5 PHE HA . 27753 1 41 . 1 1 5 5 PHE HB2 H 1 3.16 0.02 . 1 . . . . . 5 PHE HB2 . 27753 1 42 . 1 1 5 5 PHE HB3 H 1 3.02 0.02 . 1 . . . . . 5 PHE HB3 . 27753 1 43 . 1 1 5 5 PHE CA C 13 57.75 0.3 . 1 . . . . . 5 PHE CA . 27753 1 44 . 1 1 5 5 PHE CB C 13 39.22 0.3 . 1 . . . . . 5 PHE CB . 27753 1 45 . 1 1 5 5 PHE N N 15 119.73 0.15 . 1 . . . . . 5 PHE N . 27753 1 46 . 1 1 6 6 LEU H H 1 8.03 0.02 . 1 . . . . . 6 LEU HN . 27753 1 47 . 1 1 6 6 LEU HA H 1 4.43 0.02 . 1 . . . . . 6 LEU HA . 27753 1 48 . 1 1 6 6 LEU HB2 H 1 1.63 0.02 . 1 . . . . . 6 LEU HB . 27753 1 49 . 1 1 6 6 LEU HB3 H 1 1.63 0.02 . 1 . . . . . 6 LEU HB . 27753 1 50 . 1 1 6 6 LEU HG H 1 1.54 0.02 . 1 . . . . . 6 LEU HG . 27753 1 51 . 1 1 6 6 LEU HD11 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 52 . 1 1 6 6 LEU HD12 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 53 . 1 1 6 6 LEU HD13 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 54 . 1 1 6 6 LEU HD21 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 55 . 1 1 6 6 LEU HD22 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 56 . 1 1 6 6 LEU HD23 H 1 0.86 0.02 . 1 . . . . . 6 LEU HD . 27753 1 57 . 1 1 6 6 LEU CA C 13 55.03 0.3 . 1 . . . . . 6 LEU CA . 27753 1 58 . 1 1 6 6 LEU CB C 13 42.8 0.3 . 1 . . . . . 6 LEU CB . 27753 1 59 . 1 1 6 6 LEU CG C 13 26.91 0.3 . 1 . . . . . 6 LEU CG . 27753 1 60 . 1 1 6 6 LEU CD1 C 13 25.18 0.3 . 1 . . . . . 6 LEU CD1 . 27753 1 61 . 1 1 6 6 LEU CD2 C 13 23.52 0.3 . 1 . . . . . 6 LEU CD2 . 27753 1 62 . 1 1 6 6 LEU N N 15 122.62 0.15 . 1 . . . . . 6 LEU N . 27753 1 63 . 1 1 7 7 THR H H 1 8.06 0.02 . 1 . . . . . 7 THR HN . 27753 1 64 . 1 1 7 7 THR HA H 1 4.36 0.02 . 1 . . . . . 7 THR HA . 27753 1 65 . 1 1 7 7 THR HB H 1 4.36 0.02 . 1 . . . . . 7 THR HB . 27753 1 66 . 1 1 7 7 THR HG21 H 1 1.22 0.02 . 1 . . . . . 7 THR HG2 . 27753 1 67 . 1 1 7 7 THR HG22 H 1 1.22 0.02 . 1 . . . . . 7 THR HG2 . 27753 1 68 . 1 1 7 7 THR HG23 H 1 1.22 0.02 . 1 . . . . . 7 THR HG2 . 27753 1 69 . 1 1 7 7 THR CA C 13 61.31 0.3 . 1 . . . . . 7 THR CA . 27753 1 70 . 1 1 7 7 THR CB C 13 70.14 0.3 . 1 . . . . . 7 THR CB . 27753 1 71 . 1 1 7 7 THR CG2 C 13 21.71 0.3 . 1 . . . . . 7 THR CG2 . 27753 1 72 . 1 1 7 7 THR N N 15 113.6 0.15 . 1 . . . . . 7 THR N . 27753 1 73 . 1 1 8 8 ALA H H 1 8.39 0.02 . 1 . . . . . 8 ALA HN . 27753 1 74 . 1 1 8 8 ALA HA H 1 4.21 0.02 . 1 . . . . . 8 ALA HA . 27753 1 75 . 1 1 8 8 ALA HB1 H 1 1.41 0.02 . 1 . . . . . 8 ALA HB . 27753 1 76 . 1 1 8 8 ALA HB2 H 1 1.41 0.02 . 1 . . . . . 8 ALA HB . 27753 1 77 . 1 1 8 8 ALA HB3 H 1 1.41 0.02 . 1 . . . . . 8 ALA HB . 27753 1 78 . 1 1 8 8 ALA CA C 13 53.58 0.3 . 1 . . . . . 8 ALA CA . 27753 1 79 . 1 1 8 8 ALA CB C 13 19.02 0.3 . 1 . . . . . 8 ALA CB . 27753 1 80 . 1 1 8 8 ALA N N 15 125.01 0.15 . 1 . . . . . 8 ALA N . 27753 1 81 . 1 1 9 9 ASP H H 1 8.26 0.02 . 1 . . . . . 9 ASP HN . 27753 1 82 . 1 1 9 9 ASP HA H 1 4.49 0.02 . 1 . . . . . 9 ASP HA . 27753 1 83 . 1 1 9 9 ASP HB2 H 1 2.62 0.02 . 1 . . . . . 9 ASP HB . 27753 1 84 . 1 1 9 9 ASP HB3 H 1 2.62 0.02 . 1 . . . . . 9 ASP HB . 27753 1 85 . 1 1 9 9 ASP CA C 13 55.01 0.3 . 1 . . . . . 9 ASP CA . 27753 1 86 . 1 1 9 9 ASP CB C 13 40.92 0.3 . 1 . . . . . 9 ASP CB . 27753 1 87 . 1 1 9 9 ASP N N 15 117.47 0.15 . 1 . . . . . 9 ASP N . 27753 1 88 . 1 1 10 10 GLN H H 1 8.01 0.02 . 1 . . . . . 10 GLN HN . 27753 1 89 . 1 1 10 10 GLN HA H 1 4.26 0.02 . 1 . . . . . 10 GLN HA . 27753 1 90 . 1 1 10 10 GLN HB2 H 1 2.08 0.02 . 1 . . . . . 10 GLN HB . 27753 1 91 . 1 1 10 10 GLN HB3 H 1 2.08 0.02 . 1 . . . . . 10 GLN HB . 27753 1 92 . 1 1 10 10 GLN HG2 H 1 2.33 0.02 . 1 . . . . . 10 GLN HG . 27753 1 93 . 1 1 10 10 GLN HG3 H 1 2.33 0.02 . 1 . . . . . 10 GLN HG . 27753 1 94 . 1 1 10 10 GLN CA C 13 56.37 0.3 . 1 . . . . . 10 GLN CA . 27753 1 95 . 1 1 10 10 GLN CB C 13 29.56 0.3 . 1 . . . . . 10 GLN CB . 27753 1 96 . 1 1 10 10 GLN CG C 13 34.01 0.3 . 1 . . . . . 10 GLN CG . 27753 1 97 . 1 1 10 10 GLN N N 15 119.68 0.15 . 1 . . . . . 10 GLN N . 27753 1 98 . 1 1 11 11 ILE H H 1 8.01 0.02 . 1 . . . . . 11 ILE HN . 27753 1 99 . 1 1 11 11 ILE HA H 1 4.01 0.02 . 1 . . . . . 11 ILE HA . 27753 1 100 . 1 1 11 11 ILE HB H 1 1.86 0.02 . 1 . . . . . 11 ILE HB . 27753 1 101 . 1 1 11 11 ILE HG12 H 1 1.49 0.02 . 2 . . . . . 11 ILE HG12 . 27753 1 102 . 1 1 11 11 ILE HG13 H 1 1.14 0.02 . 2 . . . . . 11 ILE HG13 . 27753 1 103 . 1 1 11 11 ILE CA C 13 62.19 0.3 . 1 . . . . . 11 ILE CA . 27753 1 104 . 1 1 11 11 ILE CB C 13 38.72 0.3 . 1 . . . . . 11 ILE CB . 27753 1 105 . 1 1 11 11 ILE CG1 C 13 27.74 0.3 . 1 . . . . . 11 ILE CG1 . 27753 1 106 . 1 1 11 11 ILE CG2 C 13 17.43 0.3 . 1 . . . . . 11 ILE CG2 . 27753 1 107 . 1 1 11 11 ILE CD1 C 13 13.06 0.3 . 1 . . . . . 11 ILE CD1 . 27753 1 108 . 1 1 11 11 ILE N N 15 121.18 0.15 . 1 . . . . . 11 ILE N . 27753 1 109 . 1 1 12 12 ASP H H 1 8.3 0.02 . 1 . . . . . 12 ASP HN . 27753 1 110 . 1 1 12 12 ASP HA H 1 4.58 0.02 . 1 . . . . . 12 ASP HA . 27753 1 111 . 1 1 12 12 ASP HB2 H 1 2.66 0.02 . 1 . . . . . 12 ASP HB . 27753 1 112 . 1 1 12 12 ASP HB3 H 1 2.66 0.02 . 1 . . . . . 12 ASP HB . 27753 1 113 . 1 1 12 12 ASP CA C 13 54.9 0.3 . 1 . . . . . 12 ASP CA . 27753 1 114 . 1 1 12 12 ASP CB C 13 41.13 0.3 . 1 . . . . . 12 ASP CB . 27753 1 115 . 1 1 12 12 ASP N N 15 122.91 0.15 . 1 . . . . . 12 ASP N . 27753 1 116 . 1 1 13 13 SER H H 1 8.13 0.02 . 1 . . . . . 13 SER HN . 27753 1 117 . 1 1 13 13 SER HA H 1 4.29 0.02 . 1 . . . . . 13 SER HA . 27753 1 118 . 1 1 13 13 SER HB2 H 1 3.81 0.02 . 1 . . . . . 13 SER HB . 27753 1 119 . 1 1 13 13 SER HB3 H 1 3.81 0.02 . 1 . . . . . 13 SER HB . 27753 1 120 . 1 1 13 13 SER CA C 13 59.63 0.3 . 1 . . . . . 13 SER CA . 27753 1 121 . 1 1 13 13 SER CB C 13 63.46 0.3 . 1 . . . . . 13 SER CB . 27753 1 122 . 1 1 13 13 SER N N 15 116.46 0.15 . 1 . . . . . 13 SER N . 27753 1 123 . 1 1 14 14 PHE H H 1 8.17 0.02 . 1 . . . . . 14 PHE HN . 27753 1 124 . 1 1 14 14 PHE HA H 1 4.47 0.02 . 1 . . . . . 14 PHE HA . 27753 1 125 . 1 1 14 14 PHE HB2 H 1 3.15 0.02 . 1 . . . . . 14 PHE HB . 27753 1 126 . 1 1 14 14 PHE HB3 H 1 3.15 0.02 . 1 . . . . . 14 PHE HB . 27753 1 127 . 1 1 14 14 PHE CA C 13 59 0.3 . 1 . . . . . 14 PHE CA . 27753 1 128 . 1 1 14 14 PHE CB C 13 38.95 0.3 . 1 . . . . . 14 PHE CB . 27753 1 129 . 1 1 14 14 PHE N N 15 121.63 0.15 . 1 . . . . . 14 PHE N . 27753 1 130 . 1 1 15 15 ALA H H 1 8.01 0.02 . 1 . . . . . 15 ALA HN . 27753 1 131 . 1 1 15 15 ALA HA H 1 4.19 0.02 . 1 . . . . . 15 ALA HA . 27753 1 132 . 1 1 15 15 ALA HB1 H 1 1.39 0.02 . 1 . . . . . 15 ALA HB . 27753 1 133 . 1 1 15 15 ALA HB2 H 1 1.39 0.02 . 1 . . . . . 15 ALA HB . 27753 1 134 . 1 1 15 15 ALA HB3 H 1 1.39 0.02 . 1 . . . . . 15 ALA HB . 27753 1 135 . 1 1 15 15 ALA CA C 13 53.32 0.3 . 1 . . . . . 15 ALA CA . 27753 1 136 . 1 1 15 15 ALA CB C 13 18.87 0.3 . 1 . . . . . 15 ALA CB . 27753 1 137 . 1 1 15 15 ALA N N 15 123.68 0.15 . 1 . . . . . 15 ALA N . 27753 1 138 . 1 1 16 16 ALA H H 1 7.98 0.02 . 1 . . . . . 16 ALA HN . 27753 1 139 . 1 1 16 16 ALA HA H 1 4.19 0.02 . 1 . . . . . 16 ALA HA . 27753 1 140 . 1 1 16 16 ALA HB1 H 1 1.4 0.02 . 1 . . . . . 16 ALA HB . 27753 1 141 . 1 1 16 16 ALA HB2 H 1 1.4 0.02 . 1 . . . . . 16 ALA HB . 27753 1 142 . 1 1 16 16 ALA HB3 H 1 1.4 0.02 . 1 . . . . . 16 ALA HB . 27753 1 143 . 1 1 16 16 ALA CA C 13 53.17 0.3 . 1 . . . . . 16 ALA CA . 27753 1 144 . 1 1 16 16 ALA CB C 13 18.88 0.3 . 1 . . . . . 16 ALA CB . 27753 1 145 . 1 1 16 16 ALA N N 15 121.65 0.15 . 1 . . . . . 16 ALA N . 27753 1 146 . 1 1 17 17 LYS H H 1 7.95 0.02 . 1 . . . . . 17 LYS HN . 27753 1 147 . 1 1 17 17 LYS HA H 1 4.22 0.02 . 1 . . . . . 17 LYS HA . 27753 1 148 . 1 1 17 17 LYS HB2 H 1 1.8 0.02 . 1 . . . . . 17 LYS HB . 27753 1 149 . 1 1 17 17 LYS HB3 H 1 1.8 0.02 . 1 . . . . . 17 LYS HB . 27753 1 150 . 1 1 17 17 LYS HG2 H 1 1.45 0.02 . 1 . . . . . 17 LYS HG . 27753 1 151 . 1 1 17 17 LYS HG3 H 1 1.45 0.02 . 1 . . . . . 17 LYS HG . 27753 1 152 . 1 1 17 17 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 17 LYS HD . 27753 1 153 . 1 1 17 17 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 17 LYS HD . 27753 1 154 . 1 1 17 17 LYS HE2 H 1 2.97 0.02 . 1 . . . . . 17 LYS HE . 27753 1 155 . 1 1 17 17 LYS HE3 H 1 2.97 0.02 . 1 . . . . . 17 LYS HE . 27753 1 156 . 1 1 17 17 LYS CA C 13 56.69 0.3 . 1 . . . . . 17 LYS CA . 27753 1 157 . 1 1 17 17 LYS CB C 13 32.94 0.3 . 1 . . . . . 17 LYS CB . 27753 1 158 . 1 1 17 17 LYS CG C 13 24.82 0.3 . 1 . . . . . 17 LYS CG . 27753 1 159 . 1 1 17 17 LYS CD C 13 29.11 0.3 . 1 . . . . . 17 LYS CD . 27753 1 160 . 1 1 17 17 LYS CE C 13 42.12 0.3 . 1 . . . . . 17 LYS CE . 27753 1 161 . 1 1 17 17 LYS N N 15 119.31 0.15 . 1 . . . . . 17 LYS N . 27753 1 162 . 1 1 18 18 ALA H H 1 8.05 0.02 . 1 . . . . . 18 ALA HN . 27753 1 163 . 1 1 18 18 ALA HA H 1 4.2 0.02 . 1 . . . . . 18 ALA HA . 27753 1 164 . 1 1 18 18 ALA HB1 H 1 1.36 0.02 . 1 . . . . . 18 ALA HB . 27753 1 165 . 1 1 18 18 ALA HB2 H 1 1.36 0.02 . 1 . . . . . 18 ALA HB . 27753 1 166 . 1 1 18 18 ALA HB3 H 1 1.36 0.02 . 1 . . . . . 18 ALA HB . 27753 1 167 . 1 1 18 18 ALA CA C 13 52.81 0.3 . 1 . . . . . 18 ALA CA . 27753 1 168 . 1 1 18 18 ALA CB C 13 19.15 0.3 . 1 . . . . . 18 ALA CB . 27753 1 169 . 1 1 18 18 ALA N N 15 124.08 0.15 . 1 . . . . . 18 ALA N . 27753 1 170 . 1 1 19 19 LYS H H 1 8.13 0.02 . 1 . . . . . 19 LYS HN . 27753 1 171 . 1 1 19 19 LYS HA H 1 4.27 0.02 . 1 . . . . . 19 LYS HA . 27753 1 172 . 1 1 19 19 LYS HB2 H 1 1.83 0.02 . 1 . . . . . 19 LYS HB . 27753 1 173 . 1 1 19 19 LYS HB3 H 1 1.83 0.02 . 1 . . . . . 19 LYS HB . 27753 1 174 . 1 1 19 19 LYS HG2 H 1 1.46 0.02 . 1 . . . . . 19 LYS HG . 27753 1 175 . 1 1 19 19 LYS HG3 H 1 1.46 0.02 . 1 . . . . . 19 LYS HG . 27753 1 176 . 1 1 19 19 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 19 LYS HD . 27753 1 177 . 1 1 19 19 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 19 LYS HD . 27753 1 178 . 1 1 19 19 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 19 LYS HE . 27753 1 179 . 1 1 19 19 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 19 LYS HE . 27753 1 180 . 1 1 19 19 LYS CA C 13 56.69 0.3 . 1 . . . . . 19 LYS CA . 27753 1 181 . 1 1 19 19 LYS CB C 13 33 0.3 . 1 . . . . . 19 LYS CB . 27753 1 182 . 1 1 19 19 LYS CG C 13 24.73 0.3 . 1 . . . . . 19 LYS CG . 27753 1 183 . 1 1 19 19 LYS CD C 13 29.08 0.3 . 1 . . . . . 19 LYS CD . 27753 1 184 . 1 1 19 19 LYS CE C 13 42.1 0.3 . 1 . . . . . 19 LYS CE . 27753 1 185 . 1 1 19 19 LYS N N 15 120.02 0.15 . 1 . . . . . 19 LYS N . 27753 1 186 . 1 1 20 20 GLY H H 1 8.37 0.02 . 1 . . . . . 20 GLY HN . 27753 1 187 . 1 1 20 20 GLY HA2 H 1 3.99 0.02 . 1 . . . . . 20 GLY HA . 27753 1 188 . 1 1 20 20 GLY HA3 H 1 3.99 0.02 . 1 . . . . . 20 GLY HA . 27753 1 189 . 1 1 20 20 GLY CA C 13 45.47 0.3 . 1 . . . . . 20 GLY CA . 27753 1 190 . 1 1 20 20 GLY N N 15 109.67 0.15 . 1 . . . . . 20 GLY N . 27753 1 191 . 1 1 21 21 CYS H H 1 8.16 0.02 . 1 . . . . . 21 CYS HN . 27753 1 192 . 1 1 21 21 CYS HA H 1 4.52 0.02 . 1 . . . . . 21 CYS HA . 27753 1 193 . 1 1 21 21 CYS HB2 H 1 2.93 0.02 . 1 . . . . . 21 CYS HB . 27753 1 194 . 1 1 21 21 CYS HB3 H 1 2.93 0.02 . 1 . . . . . 21 CYS HB . 27753 1 195 . 1 1 21 21 CYS CA C 13 58.45 0.3 . 1 . . . . . 21 CYS CA . 27753 1 196 . 1 1 21 21 CYS CB C 13 28.22 0.3 . 1 . . . . . 21 CYS CB . 27753 1 197 . 1 1 21 21 CYS N N 15 118.4 0.15 . 1 . . . . . 21 CYS N . 27753 1 198 . 1 1 22 22 GLU H H 1 8.56 0.02 . 1 . . . . . 22 GLU HN . 27753 1 199 . 1 1 22 22 GLU HA H 1 4.29 0.02 . 1 . . . . . 22 GLU HA . 27753 1 200 . 1 1 22 22 GLU HB2 H 1 1.97 0.02 . 1 . . . . . 22 GLU HB . 27753 1 201 . 1 1 22 22 GLU HB3 H 1 1.97 0.02 . 1 . . . . . 22 GLU HB . 27753 1 202 . 1 1 22 22 GLU HG2 H 1 2.24 0.02 . 1 . . . . . 22 GLU HG . 27753 1 203 . 1 1 22 22 GLU HG3 H 1 2.24 0.02 . 1 . . . . . 22 GLU HG . 27753 1 204 . 1 1 22 22 GLU CA C 13 56.83 0.3 . 1 . . . . . 22 GLU CA . 27753 1 205 . 1 1 22 22 GLU CB C 13 30.23 0.3 . 1 . . . . . 22 GLU CB . 27753 1 206 . 1 1 22 22 GLU CG C 13 36.29 0.3 . 1 . . . . . 22 GLU CG . 27753 1 207 . 1 1 22 22 GLU N N 15 123.39 0.15 . 1 . . . . . 22 GLU N . 27753 1 208 . 1 1 23 23 VAL H H 1 8.18 0.02 . 1 . . . . . 23 VAL HN . 27753 1 209 . 1 1 23 23 VAL HA H 1 4.1 0.02 . 1 . . . . . 23 VAL HA . 27753 1 210 . 1 1 23 23 VAL HB H 1 2.05 0.02 . 1 . . . . . 23 VAL HB . 27753 1 211 . 1 1 23 23 VAL HG11 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 212 . 1 1 23 23 VAL HG12 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 213 . 1 1 23 23 VAL HG13 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 214 . 1 1 23 23 VAL HG21 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 215 . 1 1 23 23 VAL HG22 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 216 . 1 1 23 23 VAL HG23 H 1 0.91 0.02 . 1 . . . . . 23 VAL HG . 27753 1 217 . 1 1 23 23 VAL CA C 13 62.38 0.3 . 1 . . . . . 23 VAL CA . 27753 1 218 . 1 1 23 23 VAL CB C 13 32.65 0.3 . 1 . . . . . 23 VAL CB . 27753 1 219 . 1 1 23 23 VAL CG1 C 13 21.12 0.3 . 1 . . . . . 23 VAL CG . 27753 1 220 . 1 1 23 23 VAL CG2 C 13 21.12 0.3 . 1 . . . . . 23 VAL CG . 27753 1 221 . 1 1 23 23 VAL N N 15 121.74 0.15 . 1 . . . . . 23 VAL N . 27753 1 222 . 1 1 24 24 ARG H H 1 8.42 0.02 . 1 . . . . . 24 ARG HN . 27753 1 223 . 1 1 24 24 ARG HA H 1 4.38 0.02 . 1 . . . . . 24 ARG HA . 27753 1 224 . 1 1 24 24 ARG HB2 H 1 1.77 0.02 . 1 . . . . . 24 ARG HB . 27753 1 225 . 1 1 24 24 ARG HB3 H 1 1.77 0.02 . 1 . . . . . 24 ARG HB . 27753 1 226 . 1 1 24 24 ARG HG2 H 1 1.63 0.02 . 1 . . . . . 24 ARG HG . 27753 1 227 . 1 1 24 24 ARG HG3 H 1 1.63 0.02 . 1 . . . . . 24 ARG HG . 27753 1 228 . 1 1 24 24 ARG HD2 H 1 3.2 0.02 . 1 . . . . . 24 ARG HD . 27753 1 229 . 1 1 24 24 ARG HD3 H 1 3.2 0.02 . 1 . . . . . 24 ARG HD . 27753 1 230 . 1 1 24 24 ARG CA C 13 56.03 0.3 . 1 . . . . . 24 ARG CA . 27753 1 231 . 1 1 24 24 ARG CB C 13 31.14 0.3 . 1 . . . . . 24 ARG CB . 27753 1 232 . 1 1 24 24 ARG CG C 13 27.17 0.3 . 1 . . . . . 24 ARG CG . 27753 1 233 . 1 1 24 24 ARG CD C 13 43.32 0.3 . 1 . . . . . 24 ARG CD . 27753 1 234 . 1 1 24 24 ARG N N 15 125.09 0.15 . 1 . . . . . 24 ARG N . 27753 1 235 . 1 1 25 25 GLY H H 1 8.4 0.02 . 1 . . . . . 25 GLY HN . 27753 1 236 . 1 1 25 25 GLY HA2 H 1 3.95 0.02 . 1 . . . . . 25 GLY HA . 27753 1 237 . 1 1 25 25 GLY HA3 H 1 3.95 0.02 . 1 . . . . . 25 GLY HA . 27753 1 238 . 1 1 25 25 GLY CA C 13 45.44 0.3 . 1 . . . . . 25 GLY CA . 27753 1 239 . 1 1 25 25 GLY N N 15 109.94 0.15 . 1 . . . . . 25 GLY N . 27753 1 240 . 1 1 26 26 ASP H H 1 8.28 0.02 . 1 . . . . . 26 ASP HN . 27753 1 241 . 1 1 26 26 ASP HA H 1 4.62 0.02 . 1 . . . . . 26 ASP HA . 27753 1 242 . 1 1 26 26 ASP HB2 H 1 2.68 0.02 . 1 . . . . . 26 ASP HB . 27753 1 243 . 1 1 26 26 ASP HB3 H 1 2.68 0.02 . 1 . . . . . 26 ASP HB . 27753 1 244 . 1 1 26 26 ASP CA C 13 54.08 0.3 . 1 . . . . . 26 ASP CA . 27753 1 245 . 1 1 26 26 ASP CB C 13 41.22 0.3 . 1 . . . . . 26 ASP CB . 27753 1 246 . 1 1 26 26 ASP N N 15 120.12 0.15 . 1 . . . . . 26 ASP N . 27753 1 247 . 1 1 27 27 CYS H H 1 8.31 0.02 . 1 . . . . . 27 CYS HN . 27753 1 248 . 1 1 27 27 CYS HA H 1 4.46 0.02 . 1 . . . . . 27 CYS HA . 27753 1 249 . 1 1 27 27 CYS HB2 H 1 2.95 0.02 . 1 . . . . . 27 CYS HB . 27753 1 250 . 1 1 27 27 CYS HB3 H 1 2.95 0.02 . 1 . . . . . 27 CYS HB . 27753 1 251 . 1 1 27 27 CYS CA C 13 58.88 0.3 . 1 . . . . . 27 CYS CA . 27753 1 252 . 1 1 27 27 CYS CB C 13 27.83 0.3 . 1 . . . . . 27 CYS CB . 27753 1 253 . 1 1 27 27 CYS N N 15 119.52 0.15 . 1 . . . . . 27 CYS N . 27753 1 254 . 1 1 28 28 LYS H H 1 8.37 0.02 . 1 . . . . . 28 LYS HN . 27753 1 255 . 1 1 28 28 LYS CA C 13 56.9 0.3 . 1 . . . . . 28 LYS CA . 27753 1 256 . 1 1 28 28 LYS CB C 13 32.74 0.3 . 1 . . . . . 28 LYS CB . 27753 1 257 . 1 1 28 28 LYS N N 15 123.08 0.15 . 1 . . . . . 28 LYS N . 27753 1 258 . 1 1 29 29 GLN HA H 1 4.33 0.02 . 1 . . . . . 29 GLN HA . 27753 1 259 . 1 1 29 29 GLN HB2 H 1 1.99 0.02 . 1 . . . . . 29 GLN HB . 27753 1 260 . 1 1 29 29 GLN HB3 H 1 1.99 0.02 . 1 . . . . . 29 GLN HB . 27753 1 261 . 1 1 29 29 GLN HG2 H 1 2.32 0.02 . 1 . . . . . 29 GLN HG . 27753 1 262 . 1 1 29 29 GLN HG3 H 1 2.32 0.02 . 1 . . . . . 29 GLN HG . 27753 1 263 . 1 1 29 29 GLN CA C 13 56.24 0.3 . 1 . . . . . 29 GLN CA . 27753 1 264 . 1 1 29 29 GLN CB C 13 29.34 0.3 . 1 . . . . . 29 GLN CB . 27753 1 265 . 1 1 29 29 GLN CG C 13 33.74 0.3 . 1 . . . . . 29 GLN CG . 27753 1 266 . 1 1 30 30 ILE H H 1 8.13 0.02 . 1 . . . . . 30 ILE HN . 27753 1 267 . 1 1 30 30 ILE HA H 1 4.11 0.02 . 1 . . . . . 30 ILE HA . 27753 1 268 . 1 1 30 30 ILE HB H 1 1.85 0.02 . 1 . . . . . 30 ILE HB . 27753 1 269 . 1 1 30 30 ILE HG12 H 1 1.48 0.02 . 2 . . . . . 30 ILE HG12 . 27753 1 270 . 1 1 30 30 ILE HG13 H 1 1.18 0.02 . 2 . . . . . 30 ILE HG13 . 27753 1 271 . 1 1 30 30 ILE CA C 13 61.61 0.3 . 1 . . . . . 30 ILE CA . 27753 1 272 . 1 1 30 30 ILE CB C 13 38.55 0.3 . 1 . . . . . 30 ILE CB . 27753 1 273 . 1 1 30 30 ILE CG1 C 13 27.57 0.3 . 1 . . . . . 30 ILE CG1 . 27753 1 274 . 1 1 30 30 ILE CG2 C 13 17.62 0.3 . 1 . . . . . 30 ILE CG2 . 27753 1 275 . 1 1 30 30 ILE CD1 C 13 12.93 0.3 . 1 . . . . . 30 ILE CD1 . 27753 1 276 . 1 1 30 30 ILE N N 15 122.29 0.15 . 1 . . . . . 30 ILE N . 27753 1 277 . 1 1 31 31 VAL H H 1 8.11 0.02 . 1 . . . . . 31 VAL HN . 27753 1 278 . 1 1 31 31 VAL HA H 1 4.04 0.02 . 1 . . . . . 31 VAL HA . 27753 1 279 . 1 1 31 31 VAL HB H 1 2.06 0.02 . 1 . . . . . 31 VAL HB . 27753 1 280 . 1 1 31 31 VAL HG11 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 281 . 1 1 31 31 VAL HG12 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 282 . 1 1 31 31 VAL HG13 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 283 . 1 1 31 31 VAL HG21 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 284 . 1 1 31 31 VAL HG22 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 285 . 1 1 31 31 VAL HG23 H 1 0.93 0.02 . 1 . . . . . 31 VAL HG . 27753 1 286 . 1 1 31 31 VAL CA C 13 62.99 0.3 . 1 . . . . . 31 VAL CA . 27753 1 287 . 1 1 31 31 VAL CB C 13 32.58 0.3 . 1 . . . . . 31 VAL CB . 27753 1 288 . 1 1 31 31 VAL CG1 C 13 21.16 0.3 . 1 . . . . . 31 VAL CG . 27753 1 289 . 1 1 31 31 VAL CG2 C 13 21.16 0.3 . 1 . . . . . 31 VAL CG . 27753 1 290 . 1 1 31 31 VAL N N 15 124.17 0.15 . 1 . . . . . 31 VAL N . 27753 1 291 . 1 1 32 32 LYS H H 1 8.26 0.02 . 1 . . . . . 32 LYS HN . 27753 1 292 . 1 1 32 32 LYS CA C 13 56.98 0.3 . 1 . . . . . 32 LYS CA . 27753 1 293 . 1 1 32 32 LYS CB C 13 32.95 0.3 . 1 . . . . . 32 LYS CB . 27753 1 294 . 1 1 32 32 LYS N N 15 124.86 0.15 . 1 . . . . . 32 LYS N . 27753 1 295 . 1 1 36 36 GLU HA H 1 4.2 0.02 . 1 . . . . . 36 GLU HA . 27753 1 296 . 1 1 36 36 GLU HB2 H 1 2.01 0.02 . 1 . . . . . 36 GLU HB . 27753 1 297 . 1 1 36 36 GLU HB3 H 1 2.01 0.02 . 1 . . . . . 36 GLU HB . 27753 1 298 . 1 1 36 36 GLU HG2 H 1 2.22 0.02 . 1 . . . . . 36 GLU HG . 27753 1 299 . 1 1 36 36 GLU HG3 H 1 2.22 0.02 . 1 . . . . . 36 GLU HG . 27753 1 300 . 1 1 36 36 GLU CA C 13 57.6 0.3 . 1 . . . . . 36 GLU CA . 27753 1 301 . 1 1 36 36 GLU CB C 13 30 0.3 . 1 . . . . . 36 GLU CB . 27753 1 302 . 1 1 36 36 GLU CG C 13 36.36 0.3 . 1 . . . . . 36 GLU CG . 27753 1 303 . 1 1 37 37 LEU H H 1 8.14 0.02 . 1 . . . . . 37 LEU HN . 27753 1 304 . 1 1 37 37 LEU HA H 1 4.29 0.02 . 1 . . . . . 37 LEU HA . 27753 1 305 . 1 1 37 37 LEU HB2 H 1 1.71 0.02 . 1 . . . . . 37 LEU HB . 27753 1 306 . 1 1 37 37 LEU HB3 H 1 1.71 0.02 . 1 . . . . . 37 LEU HB . 27753 1 307 . 1 1 37 37 LEU HG H 1 1.62 0.02 . 1 . . . . . 37 LEU HG . 27753 1 308 . 1 1 37 37 LEU HD11 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 309 . 1 1 37 37 LEU HD12 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 310 . 1 1 37 37 LEU HD13 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 311 . 1 1 37 37 LEU HD21 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 312 . 1 1 37 37 LEU HD22 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 313 . 1 1 37 37 LEU HD23 H 1 0.9 0.02 . 1 . . . . . 37 LEU HD . 27753 1 314 . 1 1 37 37 LEU CA C 13 56.2 0.3 . 1 . . . . . 37 LEU CA . 27753 1 315 . 1 1 37 37 LEU CB C 13 42.31 0.3 . 1 . . . . . 37 LEU CB . 27753 1 316 . 1 1 37 37 LEU CG C 13 27.07 0.3 . 1 . . . . . 37 LEU CG . 27753 1 317 . 1 1 37 37 LEU CD1 C 13 24.92 0.3 . 1 . . . . . 37 LEU CD1 . 27753 1 318 . 1 1 37 37 LEU CD2 C 13 23.67 0.3 . 1 . . . . . 37 LEU CD2 . 27753 1 319 . 1 1 37 37 LEU N N 15 122.23 0.15 . 1 . . . . . 37 LEU N . 27753 1 320 . 1 1 38 38 SER H H 1 8.28 0.02 . 1 . . . . . 38 SER HN . 27753 1 321 . 1 1 38 38 SER HA H 1 4.37 0.02 . 1 . . . . . 38 SER HA . 27753 1 322 . 1 1 38 38 SER HB2 H 1 3.97 0.02 . 1 . . . . . 38 SER HB . 27753 1 323 . 1 1 38 38 SER HB3 H 1 3.97 0.02 . 1 . . . . . 38 SER HB . 27753 1 324 . 1 1 38 38 SER CA C 13 59.27 0.3 . 1 . . . . . 38 SER CA . 27753 1 325 . 1 1 38 38 SER CB C 13 63.61 0.3 . 1 . . . . . 38 SER CB . 27753 1 326 . 1 1 38 38 SER N N 15 116.18 0.15 . 1 . . . . . 38 SER N . 27753 1 327 . 1 1 39 39 LEU H H 1 8.12 0.02 . 1 . . . . . 39 LEU HN . 27753 1 328 . 1 1 39 39 LEU HA H 1 4.23 0.02 . 1 . . . . . 39 LEU HA . 27753 1 329 . 1 1 39 39 LEU HB2 H 1 1.65 0.02 . 1 . . . . . 39 LEU HB . 27753 1 330 . 1 1 39 39 LEU HB3 H 1 1.65 0.02 . 1 . . . . . 39 LEU HB . 27753 1 331 . 1 1 39 39 LEU HD11 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 332 . 1 1 39 39 LEU HD12 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 333 . 1 1 39 39 LEU HD13 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 334 . 1 1 39 39 LEU HD21 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 335 . 1 1 39 39 LEU HD22 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 336 . 1 1 39 39 LEU HD23 H 1 0.9 0.02 . 1 . . . . . 39 LEU HD . 27753 1 337 . 1 1 39 39 LEU CA C 13 56.72 0.3 . 1 . . . . . 39 LEU CA . 27753 1 338 . 1 1 39 39 LEU CB C 13 41.99 0.3 . 1 . . . . . 39 LEU CB . 27753 1 339 . 1 1 39 39 LEU CG C 13 27.03 0.3 . 1 . . . . . 39 LEU CG . 27753 1 340 . 1 1 39 39 LEU CD1 C 13 24.79 0.3 . 1 . . . . . 39 LEU CD1 . 27753 1 341 . 1 1 39 39 LEU CD2 C 13 23.59 0.3 . 1 . . . . . 39 LEU CD2 . 27753 1 342 . 1 1 39 39 LEU N N 15 123.07 0.15 . 1 . . . . . 39 LEU N . 27753 1 343 . 1 1 40 40 LYS H H 1 8.06 0.02 . 1 . . . . . 40 LYS HN . 27753 1 344 . 1 1 40 40 LYS HA H 1 4.19 0.02 . 1 . . . . . 40 LYS HA . 27753 1 345 . 1 1 40 40 LYS HB2 H 1 1.84 0.02 . 1 . . . . . 40 LYS HB . 27753 1 346 . 1 1 40 40 LYS HB3 H 1 1.84 0.02 . 1 . . . . . 40 LYS HB . 27753 1 347 . 1 1 40 40 LYS HG2 H 1 1.52 0.02 . 1 . . . . . 40 LYS HG . 27753 1 348 . 1 1 40 40 LYS HG3 H 1 1.52 0.02 . 1 . . . . . 40 LYS HG . 27753 1 349 . 1 1 40 40 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 40 LYS HD . 27753 1 350 . 1 1 40 40 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 40 LYS HD . 27753 1 351 . 1 1 40 40 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 40 LYS HE . 27753 1 352 . 1 1 40 40 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 40 LYS HE . 27753 1 353 . 1 1 40 40 LYS CA C 13 57.81 0.3 . 1 . . . . . 40 LYS CA . 27753 1 354 . 1 1 40 40 LYS CB C 13 32.68 0.3 . 1 . . . . . 40 LYS CB . 27753 1 355 . 1 1 40 40 LYS CG C 13 24.83 0.3 . 1 . . . . . 40 LYS CG . 27753 1 356 . 1 1 40 40 LYS CD C 13 29.18 0.3 . 1 . . . . . 40 LYS CD . 27753 1 357 . 1 1 40 40 LYS CE C 13 42.11 0.3 . 1 . . . . . 40 LYS CE . 27753 1 358 . 1 1 40 40 LYS N N 15 120.29 0.15 . 1 . . . . . 40 LYS N . 27753 1 359 . 1 1 41 41 GLN H H 1 8.13 0.02 . 1 . . . . . 41 GLN HN . 27753 1 360 . 1 1 41 41 GLN HA H 1 4.2 0.02 . 1 . . . . . 41 GLN HA . 27753 1 361 . 1 1 41 41 GLN HB2 H 1 2.09 0.02 . 1 . . . . . 41 GLN HB . 27753 1 362 . 1 1 41 41 GLN HB3 H 1 2.09 0.02 . 1 . . . . . 41 GLN HB . 27753 1 363 . 1 1 41 41 GLN HG2 H 1 2.4 0.02 . 1 . . . . . 41 GLN HG . 27753 1 364 . 1 1 41 41 GLN HG3 H 1 2.4 0.02 . 1 . . . . . 41 GLN HG . 27753 1 365 . 1 1 41 41 GLN CA C 13 57.37 0.3 . 1 . . . . . 41 GLN CA . 27753 1 366 . 1 1 41 41 GLN CB C 13 29.21 0.3 . 1 . . . . . 41 GLN CB . 27753 1 367 . 1 1 41 41 GLN CG C 13 34.1 0.3 . 1 . . . . . 41 GLN CG . 27753 1 368 . 1 1 41 41 GLN N N 15 119.48 0.15 . 1 . . . . . 41 GLN N . 27753 1 369 . 1 1 42 42 GLN H H 1 8.28 0.02 . 1 . . . . . 42 GLN HN . 27753 1 370 . 1 1 42 42 GLN CA C 13 57.32 0.3 . 1 . . . . . 42 GLN CA . 27753 1 371 . 1 1 42 42 GLN CB C 13 29.22 0.3 . 1 . . . . . 42 GLN CB . 27753 1 372 . 1 1 42 42 GLN N N 15 120.07 0.15 . 1 . . . . . 42 GLN N . 27753 1 373 . 1 1 44 44 GLU HA H 1 4.2 0.02 . 1 . . . . . 44 GLU HA . 27753 1 374 . 1 1 44 44 GLU HB2 H 1 2.02 0.02 . 1 . . . . . 44 GLU HB . 27753 1 375 . 1 1 44 44 GLU HB3 H 1 2.02 0.02 . 1 . . . . . 44 GLU HB . 27753 1 376 . 1 1 44 44 GLU HG2 H 1 2.29 0.02 . 1 . . . . . 44 GLU HG . 27753 1 377 . 1 1 44 44 GLU HG3 H 1 2.29 0.02 . 1 . . . . . 44 GLU HG . 27753 1 378 . 1 1 44 44 GLU CB C 13 29.85 0.3 . 1 . . . . . 44 GLU CB . 27753 1 379 . 1 1 44 44 GLU CG C 13 36.37 0.3 . 1 . . . . . 44 GLU CG . 27753 1 380 . 1 1 45 45 MET H H 1 8.29 0.02 . 1 . . . . . 45 MET HN . 27753 1 381 . 1 1 45 45 MET HA H 1 4.39 0.02 . 1 . . . . . 45 MET HA . 27753 1 382 . 1 1 45 45 MET HB2 H 1 2.08 0.02 . 1 . . . . . 45 MET HB . 27753 1 383 . 1 1 45 45 MET HB3 H 1 2.08 0.02 . 1 . . . . . 45 MET HB . 27753 1 384 . 1 1 45 45 MET HG2 H 1 2.58 0.02 . 1 . . . . . 45 MET HG . 27753 1 385 . 1 1 45 45 MET HG3 H 1 2.58 0.02 . 1 . . . . . 45 MET HG . 27753 1 386 . 1 1 45 45 MET CA C 13 56.4 0.3 . 1 . . . . . 45 MET CA . 27753 1 387 . 1 1 45 45 MET CB C 13 32.92 0.3 . 1 . . . . . 45 MET CB . 27753 1 388 . 1 1 45 45 MET CG C 13 32.12 0.3 . 1 . . . . . 45 MET CG . 27753 1 389 . 1 1 45 45 MET N N 15 120.03 0.15 . 1 . . . . . 45 MET N . 27753 1 390 . 1 1 46 46 ILE H H 1 7.93 0.02 . 1 . . . . . 46 ILE HN . 27753 1 391 . 1 1 46 46 ILE HA H 1 4.05 0.02 . 1 . . . . . 46 ILE HA . 27753 1 392 . 1 1 46 46 ILE HB H 1 1.87 0.02 . 1 . . . . . 46 ILE HB . 27753 1 393 . 1 1 46 46 ILE HG12 H 1 1.52 0.02 . 2 . . . . . 46 ILE HG12 . 27753 1 394 . 1 1 46 46 ILE HG13 H 1 1.18 0.02 . 2 . . . . . 46 ILE HG13 . 27753 1 395 . 1 1 46 46 ILE CA C 13 61.95 0.3 . 1 . . . . . 46 ILE CA . 27753 1 396 . 1 1 46 46 ILE CB C 13 38.64 0.3 . 1 . . . . . 46 ILE CB . 27753 1 397 . 1 1 46 46 ILE CG1 C 13 27.69 0.3 . 1 . . . . . 46 ILE CG1 . 27753 1 398 . 1 1 46 46 ILE CG2 C 13 17.5 0.3 . 1 . . . . . 46 ILE CG2 . 27753 1 399 . 1 1 46 46 ILE CD1 C 13 13.05 0.3 . 1 . . . . . 46 ILE CD1 . 27753 1 400 . 1 1 46 46 ILE N N 15 120.94 0.15 . 1 . . . . . 46 ILE N . 27753 1 401 . 1 1 47 47 ALA H H 1 8.11 0.02 . 1 . . . . . 47 ALA HN . 27753 1 402 . 1 1 47 47 ALA HA H 1 4.33 0.02 . 1 . . . . . 47 ALA HA . 27753 1 403 . 1 1 47 47 ALA HB1 H 1 1.4 0.02 . 1 . . . . . 47 ALA HB . 27753 1 404 . 1 1 47 47 ALA HB2 H 1 1.4 0.02 . 1 . . . . . 47 ALA HB . 27753 1 405 . 1 1 47 47 ALA HB3 H 1 1.4 0.02 . 1 . . . . . 47 ALA HB . 27753 1 406 . 1 1 47 47 ALA CA C 13 52.94 0.3 . 1 . . . . . 47 ALA CA . 27753 1 407 . 1 1 47 47 ALA CB C 13 19.21 0.3 . 1 . . . . . 47 ALA CB . 27753 1 408 . 1 1 47 47 ALA N N 15 126.37 0.15 . 1 . . . . . 47 ALA N . 27753 1 409 . 1 1 48 48 VAL H H 1 8 0.02 . 1 . . . . . 48 VAL HN . 27753 1 410 . 1 1 48 48 VAL HA H 1 4.08 0.02 . 1 . . . . . 48 VAL HA . 27753 1 411 . 1 1 48 48 VAL HB H 1 2.12 0.02 . 1 . . . . . 48 VAL HB . 27753 1 412 . 1 1 48 48 VAL HG11 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 413 . 1 1 48 48 VAL HG12 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 414 . 1 1 48 48 VAL HG13 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 415 . 1 1 48 48 VAL HG21 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 416 . 1 1 48 48 VAL HG22 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 417 . 1 1 48 48 VAL HG23 H 1 0.96 0.02 . 1 . . . . . 48 VAL HG . 27753 1 418 . 1 1 48 48 VAL CA C 13 62.86 0.3 . 1 . . . . . 48 VAL CA . 27753 1 419 . 1 1 48 48 VAL CB C 13 32.63 0.3 . 1 . . . . . 48 VAL CB . 27753 1 420 . 1 1 48 48 VAL CG1 C 13 21.2 0.3 . 1 . . . . . 48 VAL CG . 27753 1 421 . 1 1 48 48 VAL CG2 C 13 21.2 0.3 . 1 . . . . . 48 VAL CG . 27753 1 422 . 1 1 48 48 VAL N N 15 118.61 0.15 . 1 . . . . . 48 VAL N . 27753 1 423 . 1 1 49 49 CYS H H 1 8.27 0.02 . 1 . . . . . 49 CYS HN . 27753 1 424 . 1 1 49 49 CYS HA H 1 4.46 0.02 . 1 . . . . . 49 CYS HA . 27753 1 425 . 1 1 49 49 CYS HB2 H 1 2.93 0.02 . 1 . . . . . 49 CYS HB . 27753 1 426 . 1 1 49 49 CYS HB3 H 1 2.93 0.02 . 1 . . . . . 49 CYS HB . 27753 1 427 . 1 1 49 49 CYS CA C 13 58.95 0.3 . 1 . . . . . 49 CYS CA . 27753 1 428 . 1 1 49 49 CYS CB C 13 27.92 0.3 . 1 . . . . . 49 CYS CB . 27753 1 429 . 1 1 49 49 CYS N N 15 121.97 0.15 . 1 . . . . . 49 CYS N . 27753 1 430 . 1 1 50 50 ALA H H 1 8.33 0.02 . 1 . . . . . 50 ALA HN . 27753 1 431 . 1 1 50 50 ALA HA H 1 4.34 0.02 . 1 . . . . . 50 ALA HA . 27753 1 432 . 1 1 50 50 ALA HB1 H 1 1.42 0.02 . 1 . . . . . 50 ALA HB . 27753 1 433 . 1 1 50 50 ALA HB2 H 1 1.42 0.02 . 1 . . . . . 50 ALA HB . 27753 1 434 . 1 1 50 50 ALA HB3 H 1 1.42 0.02 . 1 . . . . . 50 ALA HB . 27753 1 435 . 1 1 50 50 ALA CA C 13 52.97 0.3 . 1 . . . . . 50 ALA CA . 27753 1 436 . 1 1 50 50 ALA CB C 13 19.33 0.3 . 1 . . . . . 50 ALA CB . 27753 1 437 . 1 1 50 50 ALA N N 15 125.86 0.15 . 1 . . . . . 50 ALA N . 27753 1 438 . 1 1 51 51 THR H H 1 7.97 0.02 . 1 . . . . . 51 THR HN . 27753 1 439 . 1 1 51 51 THR HA H 1 4.25 0.02 . 1 . . . . . 51 THR HA . 27753 1 440 . 1 1 51 51 THR HB H 1 4.25 0.02 . 1 . . . . . 51 THR HB . 27753 1 441 . 1 1 51 51 THR HG21 H 1 1.18 0.02 . 1 . . . . . 51 THR HG2 . 27753 1 442 . 1 1 51 51 THR HG22 H 1 1.18 0.02 . 1 . . . . . 51 THR HG2 . 27753 1 443 . 1 1 51 51 THR HG23 H 1 1.18 0.02 . 1 . . . . . 51 THR HG2 . 27753 1 444 . 1 1 51 51 THR CA C 13 61.93 0.3 . 1 . . . . . 51 THR CA . 27753 1 445 . 1 1 51 51 THR CB C 13 69.76 0.3 . 1 . . . . . 51 THR CB . 27753 1 446 . 1 1 51 51 THR CG2 C 13 21.81 0.3 . 1 . . . . . 51 THR CG2 . 27753 1 447 . 1 1 51 51 THR N N 15 112.12 0.15 . 1 . . . . . 51 THR N . 27753 1 448 . 1 1 52 52 ASN H H 1 8.28 0.02 . 1 . . . . . 52 ASN HN . 27753 1 449 . 1 1 52 52 ASN CA C 13 51.17 0.3 . 1 . . . . . 52 ASN CA . 27753 1 450 . 1 1 52 52 ASN CB C 13 39.01 0.3 . 1 . . . . . 52 ASN CB . 27753 1 451 . 1 1 52 52 ASN N N 15 121.38 0.15 . 1 . . . . . 52 ASN N . 27753 1 452 . 1 1 53 53 PRO HA H 1 4.38 0.02 . 1 . . . . . 53 PRO HA . 27753 1 453 . 1 1 53 53 PRO HB2 H 1 2.24 0.02 . 1 . . . . . 53 PRO HB . 27753 1 454 . 1 1 53 53 PRO HB3 H 1 2.24 0.02 . 1 . . . . . 53 PRO HB . 27753 1 455 . 1 1 53 53 PRO HG2 H 1 2.01 0.02 . 2 . . . . . 53 PRO HG2 . 27753 1 456 . 1 1 53 53 PRO CA C 13 63.97 0.3 . 1 . . . . . 53 PRO CA . 27753 1 457 . 1 1 53 53 PRO CB C 13 32.07 0.3 . 1 . . . . . 53 PRO CB . 27753 1 458 . 1 1 53 53 PRO CG C 13 27.24 0.3 . 1 . . . . . 53 PRO CG . 27753 1 459 . 1 1 53 53 PRO CD C 13 50.69 0.3 . 1 . . . . . 53 PRO CD . 27753 1 460 . 1 1 54 54 ALA H H 1 8.13 0.02 . 1 . . . . . 54 ALA HN . 27753 1 461 . 1 1 54 54 ALA HA H 1 4.25 0.02 . 1 . . . . . 54 ALA HA . 27753 1 462 . 1 1 54 54 ALA HB1 H 1 1.39 0.02 . 1 . . . . . 54 ALA HB . 27753 1 463 . 1 1 54 54 ALA HB2 H 1 1.39 0.02 . 1 . . . . . 54 ALA HB . 27753 1 464 . 1 1 54 54 ALA HB3 H 1 1.39 0.02 . 1 . . . . . 54 ALA HB . 27753 1 465 . 1 1 54 54 ALA CA C 13 52.83 0.3 . 1 . . . . . 54 ALA CA . 27753 1 466 . 1 1 54 54 ALA CB C 13 18.96 0.3 . 1 . . . . . 54 ALA CB . 27753 1 467 . 1 1 54 54 ALA N N 15 121.97 0.15 . 1 . . . . . 54 ALA N . 27753 1 468 . 1 1 55 55 ALA H H 1 7.95 0.02 . 1 . . . . . 55 ALA HN . 27753 1 469 . 1 1 55 55 ALA HA H 1 4.28 0.02 . 1 . . . . . 55 ALA HA . 27753 1 470 . 1 1 55 55 ALA HB1 H 1 1.42 0.02 . 1 . . . . . 55 ALA HB . 27753 1 471 . 1 1 55 55 ALA HB2 H 1 1.42 0.02 . 1 . . . . . 55 ALA HB . 27753 1 472 . 1 1 55 55 ALA HB3 H 1 1.42 0.02 . 1 . . . . . 55 ALA HB . 27753 1 473 . 1 1 55 55 ALA CA C 13 52.79 0.3 . 1 . . . . . 55 ALA CA . 27753 1 474 . 1 1 55 55 ALA CB C 13 19.22 0.3 . 1 . . . . . 55 ALA CB . 27753 1 475 . 1 1 55 55 ALA N N 15 122.03 0.15 . 1 . . . . . 55 ALA N . 27753 1 476 . 1 1 56 56 CYS H H 1 8.09 0.02 . 1 . . . . . 56 CYS HN . 27753 1 477 . 1 1 56 56 CYS HA H 1 4.46 0.02 . 1 . . . . . 56 CYS HA . 27753 1 478 . 1 1 56 56 CYS HB2 H 1 2.95 0.02 . 1 . . . . . 56 CYS HB . 27753 1 479 . 1 1 56 56 CYS HB3 H 1 2.95 0.02 . 1 . . . . . 56 CYS HB . 27753 1 480 . 1 1 56 56 CYS CA C 13 58.85 0.3 . 1 . . . . . 56 CYS CA . 27753 1 481 . 1 1 56 56 CYS CB C 13 27.88 0.3 . 1 . . . . . 56 CYS CB . 27753 1 482 . 1 1 56 56 CYS N N 15 117.89 0.15 . 1 . . . . . 56 CYS N . 27753 1 483 . 1 1 57 57 LYS H H 1 8.3 0.02 . 1 . . . . . 57 LYS HN . 27753 1 484 . 1 1 57 57 LYS HA H 1 4.25 0.02 . 1 . . . . . 57 LYS HA . 27753 1 485 . 1 1 57 57 LYS HB2 H 1 1.8 0.02 . 1 . . . . . 57 LYS HB . 27753 1 486 . 1 1 57 57 LYS HB3 H 1 1.8 0.02 . 1 . . . . . 57 LYS HB . 27753 1 487 . 1 1 57 57 LYS HG2 H 1 1.43 0.02 . 1 . . . . . 57 LYS HG . 27753 1 488 . 1 1 57 57 LYS HG3 H 1 1.43 0.02 . 1 . . . . . 57 LYS HG . 27753 1 489 . 1 1 57 57 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 57 LYS HD . 27753 1 490 . 1 1 57 57 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 57 LYS HD . 27753 1 491 . 1 1 57 57 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 57 LYS HE . 27753 1 492 . 1 1 57 57 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 57 LYS HE . 27753 1 493 . 1 1 57 57 LYS CA C 13 57 0.3 . 1 . . . . . 57 LYS CA . 27753 1 494 . 1 1 57 57 LYS CB C 13 33 0.3 . 1 . . . . . 57 LYS CB . 27753 1 495 . 1 1 57 57 LYS CG C 13 24.64 0.3 . 1 . . . . . 57 LYS CG . 27753 1 496 . 1 1 57 57 LYS CD C 13 29.19 0.3 . 1 . . . . . 57 LYS CD . 27753 1 497 . 1 1 57 57 LYS CE C 13 42.1 0.3 . 1 . . . . . 57 LYS CE . 27753 1 498 . 1 1 57 57 LYS N N 15 123.42 0.15 . 1 . . . . . 57 LYS N . 27753 1 499 . 1 1 58 58 GLU H H 1 8.44 0.02 . 1 . . . . . 58 GLU HN . 27753 1 500 . 1 1 58 58 GLU HA H 1 4.19 0.02 . 1 . . . . . 58 GLU HA . 27753 1 501 . 1 1 58 58 GLU HB2 H 1 1.92 0.02 . 1 . . . . . 58 GLU HB . 27753 1 502 . 1 1 58 58 GLU HB3 H 1 1.92 0.02 . 1 . . . . . 58 GLU HB . 27753 1 503 . 1 1 58 58 GLU HG2 H 1 2.22 0.02 . 1 . . . . . 58 GLU HG . 27753 1 504 . 1 1 58 58 GLU HG3 H 1 2.22 0.02 . 1 . . . . . 58 GLU HG . 27753 1 505 . 1 1 58 58 GLU CA C 13 57.02 0.3 . 1 . . . . . 58 GLU CA . 27753 1 506 . 1 1 58 58 GLU CB C 13 30.16 0.3 . 1 . . . . . 58 GLU CB . 27753 1 507 . 1 1 58 58 GLU CG C 13 36.27 0.3 . 1 . . . . . 58 GLU CG . 27753 1 508 . 1 1 58 58 GLU N N 15 121.34 0.15 . 1 . . . . . 58 GLU N . 27753 1 509 . 1 1 59 59 LYS H H 1 8.14 0.02 . 1 . . . . . 59 LYS HN . 27753 1 510 . 1 1 59 59 LYS HA H 1 4.2 0.02 . 1 . . . . . 59 LYS HA . 27753 1 511 . 1 1 59 59 LYS HB2 H 1 1.9 0.02 . 1 . . . . . 59 LYS HB . 27753 1 512 . 1 1 59 59 LYS HB3 H 1 1.9 0.02 . 1 . . . . . 59 LYS HB . 27753 1 513 . 1 1 59 59 LYS HG2 H 1 1.26 0.02 . 1 . . . . . 59 LYS HG . 27753 1 514 . 1 1 59 59 LYS HG3 H 1 1.26 0.02 . 1 . . . . . 59 LYS HG . 27753 1 515 . 1 1 59 59 LYS HD2 H 1 1.62 0.02 . 1 . . . . . 59 LYS HD . 27753 1 516 . 1 1 59 59 LYS HD3 H 1 1.62 0.02 . 1 . . . . . 59 LYS HD . 27753 1 517 . 1 1 59 59 LYS HE2 H 1 2.93 0.02 . 1 . . . . . 59 LYS HE . 27753 1 518 . 1 1 59 59 LYS HE3 H 1 2.93 0.02 . 1 . . . . . 59 LYS HE . 27753 1 519 . 1 1 59 59 LYS CA C 13 56.47 0.3 . 1 . . . . . 59 LYS CA . 27753 1 520 . 1 1 59 59 LYS CB C 13 33.11 0.3 . 1 . . . . . 59 LYS CB . 27753 1 521 . 1 1 59 59 LYS CG C 13 24.6 0.3 . 1 . . . . . 59 LYS CG . 27753 1 522 . 1 1 59 59 LYS CD C 13 29.05 0.3 . 1 . . . . . 59 LYS CD . 27753 1 523 . 1 1 59 59 LYS CE C 13 42.07 0.3 . 1 . . . . . 59 LYS CE . 27753 1 524 . 1 1 59 59 LYS N N 15 121.24 0.15 . 1 . . . . . 59 LYS N . 27753 1 525 . 1 1 60 60 PHE H H 1 8.24 0.02 . 1 . . . . . 60 PHE HN . 27753 1 526 . 1 1 60 60 PHE HA H 1 4.63 0.02 . 1 . . . . . 60 PHE HA . 27753 1 527 . 1 1 60 60 PHE HB2 H 1 3.19 0.02 . 1 . . . . . 60 PHE HB2 . 27753 1 528 . 1 1 60 60 PHE HB3 H 1 3.02 0.02 . 1 . . . . . 60 PHE HB3 . 27753 1 529 . 1 1 60 60 PHE CA C 13 57.83 0.3 . 1 . . . . . 60 PHE CA . 27753 1 530 . 1 1 60 60 PHE CB C 13 39.64 0.3 . 1 . . . . . 60 PHE CB . 27753 1 531 . 1 1 60 60 PHE N N 15 120.36 0.15 . 1 . . . . . 60 PHE N . 27753 1 532 . 1 1 61 61 GLY H H 1 8.25 0.02 . 1 . . . . . 61 GLY HN . 27753 1 533 . 1 1 61 61 GLY HA2 H 1 3.92 0.02 . 1 . . . . . 61 GLY HA . 27753 1 534 . 1 1 61 61 GLY HA3 H 1 3.92 0.02 . 1 . . . . . 61 GLY HA . 27753 1 535 . 1 1 61 61 GLY CA C 13 45.44 0.3 . 1 . . . . . 61 GLY CA . 27753 1 536 . 1 1 61 61 GLY N N 15 109.85 0.15 . 1 . . . . . 61 GLY N . 27753 1 537 . 1 1 62 62 ASP H H 1 8.17 0.02 . 1 . . . . . 62 ASP HN . 27753 1 538 . 1 1 62 62 ASP HA H 1 4.62 0.02 . 1 . . . . . 62 ASP HA . 27753 1 539 . 1 1 62 62 ASP HB2 H 1 2.68 0.02 . 2 . . . . . 62 ASP HB2 . 27753 1 540 . 1 1 62 62 ASP HB3 H 1 2.57 0.02 . 2 . . . . . 62 ASP HB3 . 27753 1 541 . 1 1 62 62 ASP CA C 13 54.28 0.3 . 1 . . . . . 62 ASP CA . 27753 1 542 . 1 1 62 62 ASP CB C 13 41.29 0.3 . 1 . . . . . 62 ASP CB . 27753 1 543 . 1 1 62 62 ASP N N 15 120.35 0.15 . 1 . . . . . 62 ASP N . 27753 1 544 . 1 1 63 63 ILE H H 1 8.07 0.02 . 1 . . . . . 63 ILE HN . 27753 1 545 . 1 1 63 63 ILE CA C 13 59.71 0.3 . 1 . . . . . 63 ILE CA . 27753 1 546 . 1 1 63 63 ILE CB C 13 38.3 0.3 . 1 . . . . . 63 ILE CB . 27753 1 547 . 1 1 63 63 ILE N N 15 121.57 0.15 . 1 . . . . . 63 ILE N . 27753 1 548 . 1 1 64 64 PRO HA H 1 4.39 0.02 . 1 . . . . . 64 PRO HA . 27753 1 549 . 1 1 64 64 PRO HB2 H 1 2.29 0.02 . 1 . . . . . 64 PRO HB . 27753 1 550 . 1 1 64 64 PRO HB3 H 1 2.29 0.02 . 1 . . . . . 64 PRO HB . 27753 1 551 . 1 1 64 64 PRO HG2 H 1 1.88 0.02 . 1 . . . . . 64 PRO HG . 27753 1 552 . 1 1 64 64 PRO HG3 H 1 1.88 0.02 . 1 . . . . . 64 PRO HG . 27753 1 553 . 1 1 64 64 PRO HD2 H 1 3.85 0.02 . 2 . . . . . 64 PRO HD2 . 27753 1 554 . 1 1 64 64 PRO HD3 H 1 3.68 0.02 . 2 . . . . . 64 PRO HD3 . 27753 1 555 . 1 1 64 64 PRO CA C 13 63.58 0.3 . 1 . . . . . 64 PRO CA . 27753 1 556 . 1 1 64 64 PRO CB C 13 31.98 0.3 . 1 . . . . . 64 PRO CB . 27753 1 557 . 1 1 64 64 PRO CG C 13 27.61 0.3 . 1 . . . . . 64 PRO CG . 27753 1 558 . 1 1 64 64 PRO CD C 13 50.77 0.3 . 1 . . . . . 64 PRO CD . 27753 1 559 . 1 1 65 65 ALA H H 1 8.27 0.02 . 1 . . . . . 65 ALA HN . 27753 1 560 . 1 1 65 65 ALA HA H 1 4.24 0.02 . 1 . . . . . 65 ALA HA . 27753 1 561 . 1 1 65 65 ALA HB1 H 1 1.43 0.02 . 1 . . . . . 65 ALA HB . 27753 1 562 . 1 1 65 65 ALA HB2 H 1 1.43 0.02 . 1 . . . . . 65 ALA HB . 27753 1 563 . 1 1 65 65 ALA HB3 H 1 1.43 0.02 . 1 . . . . . 65 ALA HB . 27753 1 564 . 1 1 65 65 ALA CA C 13 53.48 0.3 . 1 . . . . . 65 ALA CA . 27753 1 565 . 1 1 65 65 ALA CB C 13 18.9 0.3 . 1 . . . . . 65 ALA CB . 27753 1 566 . 1 1 65 65 ALA N N 15 123.54 0.15 . 1 . . . . . 65 ALA N . 27753 1 567 . 1 1 66 66 LYS H H 1 8.44 0.02 . 1 . . . . . 66 LYS HN . 27753 1 568 . 1 1 66 66 LYS HA H 1 4.11 0.02 . 1 . . . . . 66 LYS HA . 27753 1 569 . 1 1 66 66 LYS HB2 H 1 1.83 0.02 . 1 . . . . . 66 LYS HB . 27753 1 570 . 1 1 66 66 LYS HB3 H 1 1.83 0.02 . 1 . . . . . 66 LYS HB . 27753 1 571 . 1 1 66 66 LYS HG2 H 1 1.43 0.02 . 1 . . . . . 66 LYS HG . 27753 1 572 . 1 1 66 66 LYS HG3 H 1 1.43 0.02 . 1 . . . . . 66 LYS HG . 27753 1 573 . 1 1 66 66 LYS HD2 H 1 1.68 0.02 . 1 . . . . . 66 LYS HD2 . 27753 1 574 . 1 1 66 66 LYS HD3 H 1 1.57 0.02 . 1 . . . . . 66 LYS HD3 . 27753 1 575 . 1 1 66 66 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 66 LYS HE . 27753 1 576 . 1 1 66 66 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 66 LYS HE . 27753 1 577 . 1 1 66 66 LYS CA C 13 58.57 0.3 . 1 . . . . . 66 LYS CA . 27753 1 578 . 1 1 66 66 LYS CB C 13 32.55 0.3 . 1 . . . . . 66 LYS CB . 27753 1 579 . 1 1 66 66 LYS CG C 13 25.34 0.3 . 1 . . . . . 66 LYS CG . 27753 1 580 . 1 1 66 66 LYS CD C 13 29.25 0.3 . 1 . . . . . 66 LYS CD . 27753 1 581 . 1 1 66 66 LYS CE C 13 42.04 0.3 . 1 . . . . . 66 LYS CE . 27753 1 582 . 1 1 66 66 LYS N N 15 119.12 0.15 . 1 . . . . . 66 LYS N . 27753 1 583 . 1 1 67 67 GLY H H 1 8.43 0.02 . 1 . . . . . 67 GLY HN . 27753 1 584 . 1 1 67 67 GLY HA2 H 1 3.85 0.02 . 1 . . . . . 67 GLY HA . 27753 1 585 . 1 1 67 67 GLY HA3 H 1 3.85 0.02 . 1 . . . . . 67 GLY HA . 27753 1 586 . 1 1 67 67 GLY CA C 13 46.75 0.3 . 1 . . . . . 67 GLY CA . 27753 1 587 . 1 1 67 67 GLY N N 15 106.96 0.15 . 1 . . . . . 67 GLY N . 27753 1 588 . 1 1 68 68 MET HA H 1 4.28 0.02 . 1 . . . . . 68 MET HA . 27753 1 589 . 1 1 68 68 MET HB2 H 1 2.13 0.02 . 1 . . . . . 68 MET HB . 27753 1 590 . 1 1 68 68 MET HB3 H 1 2.13 0.02 . 1 . . . . . 68 MET HB . 27753 1 591 . 1 1 68 68 MET HG2 H 1 2.64 0.02 . 2 . . . . . 68 MET HG2 . 27753 1 592 . 1 1 68 68 MET HG3 H 1 2.52 0.02 . 2 . . . . . 68 MET HG3 . 27753 1 593 . 1 1 68 68 MET CA C 13 57.66 0.3 . 1 . . . . . 68 MET CA . 27753 1 594 . 1 1 68 68 MET CB C 13 32.26 0.3 . 1 . . . . . 68 MET CB . 27753 1 595 . 1 1 68 68 MET CG C 13 31.95 0.3 . 1 . . . . . 68 MET CG . 27753 1 596 . 1 1 69 69 LEU H H 1 7.87 0.02 . 1 . . . . . 69 LEU HN . 27753 1 597 . 1 1 69 69 LEU HA H 1 4.19 0.02 . 1 . . . . . 69 LEU HA . 27753 1 598 . 1 1 69 69 LEU HB2 H 1 1.86 0.02 . 2 . . . . . 69 LEU HB2 . 27753 1 599 . 1 1 69 69 LEU HB3 H 1 1.75 0.02 . 2 . . . . . 69 LEU HB3 . 27753 1 600 . 1 1 69 69 LEU HG H 1 1.57 0.02 . 1 . . . . . 69 LEU HG . 27753 1 601 . 1 1 69 69 LEU HD11 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 602 . 1 1 69 69 LEU HD12 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 603 . 1 1 69 69 LEU HD13 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 604 . 1 1 69 69 LEU HD21 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 605 . 1 1 69 69 LEU HD22 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 606 . 1 1 69 69 LEU HD23 H 1 0.91 0.02 . 1 . . . . . 69 LEU HD . 27753 1 607 . 1 1 69 69 LEU CA C 13 57.32 0.3 . 1 . . . . . 69 LEU CA . 27753 1 608 . 1 1 69 69 LEU CB C 13 41.8 0.3 . 1 . . . . . 69 LEU CB . 27753 1 609 . 1 1 69 69 LEU CG C 13 26.99 0.3 . 1 . . . . . 69 LEU CG . 27753 1 610 . 1 1 69 69 LEU CD1 C 13 25.45 0.3 . 1 . . . . . 69 LEU CD1 . 27753 1 611 . 1 1 69 69 LEU CD2 C 13 23.28 0.3 . 1 . . . . . 69 LEU CD2 . 27753 1 612 . 1 1 69 69 LEU N N 15 120.65 0.15 . 1 . . . . . 69 LEU N . 27753 1 613 . 1 1 70 70 VAL H H 1 7.96 0.02 . 1 . . . . . 70 VAL HN . 27753 1 614 . 1 1 70 70 VAL HA H 1 3.59 0.02 . 1 . . . . . 70 VAL HA . 27753 1 615 . 1 1 70 70 VAL HB H 1 2.17 0.02 . 1 . . . . . 70 VAL HB . 27753 1 616 . 1 1 70 70 VAL HG11 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 617 . 1 1 70 70 VAL HG12 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 618 . 1 1 70 70 VAL HG13 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 619 . 1 1 70 70 VAL HG21 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 620 . 1 1 70 70 VAL HG22 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 621 . 1 1 70 70 VAL HG23 H 1 0.99 0.02 . 1 . . . . . 70 VAL HG . 27753 1 622 . 1 1 70 70 VAL CA C 13 66.27 0.3 . 1 . . . . . 70 VAL CA . 27753 1 623 . 1 1 70 70 VAL CB C 13 31.76 0.3 . 1 . . . . . 70 VAL CB . 27753 1 624 . 1 1 70 70 VAL CG1 C 13 22.76 0.3 . 1 . . . . . 70 VAL CG . 27753 1 625 . 1 1 70 70 VAL CG2 C 13 22.76 0.3 . 1 . . . . . 70 VAL CG . 27753 1 626 . 1 1 70 70 VAL N N 15 119.68 0.15 . 1 . . . . . 70 VAL N . 27753 1 627 . 1 1 71 71 ARG H H 1 8.05 0.02 . 1 . . . . . 71 ARG HN . 27753 1 628 . 1 1 71 71 ARG HA H 1 4.04 0.02 . 1 . . . . . 71 ARG HA . 27753 1 629 . 1 1 71 71 ARG HB2 H 1 1.94 0.02 . 1 . . . . . 71 ARG HB . 27753 1 630 . 1 1 71 71 ARG HB3 H 1 1.94 0.02 . 1 . . . . . 71 ARG HB . 27753 1 631 . 1 1 71 71 ARG HG2 H 1 1.76 0.02 . 1 . . . . . 71 ARG HG . 27753 1 632 . 1 1 71 71 ARG HG3 H 1 1.76 0.02 . 1 . . . . . 71 ARG HG . 27753 1 633 . 1 1 71 71 ARG HD2 H 1 3.13 0.02 . 1 . . . . . 71 ARG HD . 27753 1 634 . 1 1 71 71 ARG HD3 H 1 3.13 0.02 . 1 . . . . . 71 ARG HD . 27753 1 635 . 1 1 71 71 ARG CA C 13 58.79 0.3 . 1 . . . . . 71 ARG CA . 27753 1 636 . 1 1 71 71 ARG CB C 13 29.39 0.3 . 1 . . . . . 71 ARG CB . 27753 1 637 . 1 1 71 71 ARG CG C 13 27.4 0.3 . 1 . . . . . 71 ARG CG . 27753 1 638 . 1 1 71 71 ARG CD C 13 42.68 0.3 . 1 . . . . . 71 ARG CD . 27753 1 639 . 1 1 71 71 ARG N N 15 120.26 0.15 . 1 . . . . . 71 ARG N . 27753 1 640 . 1 1 72 72 GLU H H 1 7.98 0.02 . 1 . . . . . 72 GLU HN . 27753 1 641 . 1 1 72 72 GLU HA H 1 4.07 0.02 . 1 . . . . . 72 GLU HA . 27753 1 642 . 1 1 72 72 GLU HB2 H 1 2.08 0.02 . 1 . . . . . 72 GLU HB . 27753 1 643 . 1 1 72 72 GLU HB3 H 1 2.08 0.02 . 1 . . . . . 72 GLU HB . 27753 1 644 . 1 1 72 72 GLU HG2 H 1 2.43 0.02 . 2 . . . . . 72 GLU HG2 . 27753 1 645 . 1 1 72 72 GLU HG3 H 1 2.27 0.02 . 2 . . . . . 72 GLU HG3 . 27753 1 646 . 1 1 72 72 GLU CA C 13 59.18 0.3 . 1 . . . . . 72 GLU CA . 27753 1 647 . 1 1 72 72 GLU CB C 13 29.64 0.3 . 1 . . . . . 72 GLU CB . 27753 1 648 . 1 1 72 72 GLU CG C 13 36.54 0.3 . 1 . . . . . 72 GLU CG . 27753 1 649 . 1 1 72 72 GLU N N 15 118.21 0.15 . 1 . . . . . 72 GLU N . 27753 1 650 . 1 1 73 73 ALA H H 1 7.65 0.02 . 1 . . . . . 73 ALA HN . 27753 1 651 . 1 1 73 73 ALA HA H 1 4.1 0.02 . 1 . . . . . 73 ALA HA . 27753 1 652 . 1 1 73 73 ALA HB1 H 1 1.44 0.02 . 1 . . . . . 73 ALA HB . 27753 1 653 . 1 1 73 73 ALA HB2 H 1 1.44 0.02 . 1 . . . . . 73 ALA HB . 27753 1 654 . 1 1 73 73 ALA HB3 H 1 1.44 0.02 . 1 . . . . . 73 ALA HB . 27753 1 655 . 1 1 73 73 ALA CA C 13 54.94 0.3 . 1 . . . . . 73 ALA CA . 27753 1 656 . 1 1 73 73 ALA CB C 13 18.45 0.3 . 1 . . . . . 73 ALA CB . 27753 1 657 . 1 1 73 73 ALA N N 15 121.87 0.15 . 1 . . . . . 73 ALA N . 27753 1 658 . 1 1 74 74 ILE H H 1 8.19 0.02 . 1 . . . . . 74 ILE HN . 27753 1 659 . 1 1 74 74 ILE HA H 1 3.67 0.02 . 1 . . . . . 74 ILE HA . 27753 1 660 . 1 1 74 74 ILE HB H 1 1.82 0.02 . 1 . . . . . 74 ILE HB . 27753 1 661 . 1 1 74 74 ILE HG12 H 1 1.56 0.02 . 1 . . . . . 74 ILE HG1 . 27753 1 662 . 1 1 74 74 ILE HG13 H 1 1.56 0.02 . 1 . . . . . 74 ILE HG1 . 27753 1 663 . 1 1 74 74 ILE HG21 H 1 0.89 0.02 . 1 . . . . . 74 ILE HG2 . 27753 1 664 . 1 1 74 74 ILE HG22 H 1 0.89 0.02 . 1 . . . . . 74 ILE HG2 . 27753 1 665 . 1 1 74 74 ILE HG23 H 1 0.89 0.02 . 1 . . . . . 74 ILE HG2 . 27753 1 666 . 1 1 74 74 ILE HD11 H 1 0.79 0.02 . 1 . . . . . 74 ILE HD1 . 27753 1 667 . 1 1 74 74 ILE HD12 H 1 0.79 0.02 . 1 . . . . . 74 ILE HD1 . 27753 1 668 . 1 1 74 74 ILE HD13 H 1 0.79 0.02 . 1 . . . . . 74 ILE HD1 . 27753 1 669 . 1 1 74 74 ILE CA C 13 64.46 0.3 . 1 . . . . . 74 ILE CA . 27753 1 670 . 1 1 74 74 ILE CB C 13 37.47 0.3 . 1 . . . . . 74 ILE CB . 27753 1 671 . 1 1 74 74 ILE CG1 C 13 26.91 0.3 . 1 . . . . . 74 ILE CG1 . 27753 1 672 . 1 1 74 74 ILE CG2 C 13 17.79 0.3 . 1 . . . . . 74 ILE CG2 . 27753 1 673 . 1 1 74 74 ILE CD1 C 13 13.46 0.3 . 1 . . . . . 74 ILE CD1 . 27753 1 674 . 1 1 74 74 ILE N N 15 117.06 0.15 . 1 . . . . . 74 ILE N . 27753 1 675 . 1 1 75 75 ASP H H 1 8.26 0.02 . 1 . . . . . 75 ASP HN . 27753 1 676 . 1 1 75 75 ASP HA H 1 4.25 0.02 . 1 . . . . . 75 ASP HA . 27753 1 677 . 1 1 75 75 ASP HB2 H 1 2.81 0.02 . 2 . . . . . 75 ASP HB2 . 27753 1 678 . 1 1 75 75 ASP HB3 H 1 2.64 0.02 . 2 . . . . . 75 ASP HB3 . 27753 1 679 . 1 1 75 75 ASP CA C 13 57.59 0.3 . 1 . . . . . 75 ASP CA . 27753 1 680 . 1 1 75 75 ASP CB C 13 41 0.3 . 1 . . . . . 75 ASP CB . 27753 1 681 . 1 1 75 75 ASP N N 15 120.9 0.15 . 1 . . . . . 75 ASP N . 27753 1 682 . 1 1 76 76 ARG H H 1 7.71 0.02 . 1 . . . . . 76 ARG HN . 27753 1 683 . 1 1 76 76 ARG HA H 1 4.1 0.02 . 1 . . . . . 76 ARG HA . 27753 1 684 . 1 1 76 76 ARG HB2 H 1 1.95 0.02 . 2 . . . . . 76 ARG HB2 . 27753 1 685 . 1 1 76 76 ARG HB3 H 1 1.8 0.02 . 2 . . . . . 76 ARG HB3 . 27753 1 686 . 1 1 76 76 ARG HG2 H 1 1.64 0.02 . 1 . . . . . 76 ARG HG . 27753 1 687 . 1 1 76 76 ARG HG3 H 1 1.64 0.02 . 1 . . . . . 76 ARG HG . 27753 1 688 . 1 1 76 76 ARG HD2 H 1 3.22 0.02 . 1 . . . . . 76 ARG HD . 27753 1 689 . 1 1 76 76 ARG HD3 H 1 3.22 0.02 . 1 . . . . . 76 ARG HD . 27753 1 690 . 1 1 76 76 ARG CA C 13 58.56 0.3 . 1 . . . . . 76 ARG CA . 27753 1 691 . 1 1 76 76 ARG CB C 13 30.6 0.3 . 1 . . . . . 76 ARG CB . 27753 1 692 . 1 1 76 76 ARG CG C 13 27.67 0.3 . 1 . . . . . 76 ARG CG . 27753 1 693 . 1 1 76 76 ARG CD C 13 43.42 0.3 . 1 . . . . . 76 ARG CD . 27753 1 694 . 1 1 76 76 ARG N N 15 117.29 0.15 . 1 . . . . . 76 ARG N . 27753 1 695 . 1 1 77 77 VAL H H 1 7.66 0.02 . 1 . . . . . 77 VAL HN . 27753 1 696 . 1 1 77 77 VAL HA H 1 4.06 0.02 . 1 . . . . . 77 VAL HA . 27753 1 697 . 1 1 77 77 VAL HB H 1 2.06 0.02 . 1 . . . . . 77 VAL HB . 27753 1 698 . 1 1 77 77 VAL HG11 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 699 . 1 1 77 77 VAL HG12 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 700 . 1 1 77 77 VAL HG13 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 701 . 1 1 77 77 VAL HG21 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 702 . 1 1 77 77 VAL HG22 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 703 . 1 1 77 77 VAL HG23 H 1 0.96 0.02 . 1 . . . . . 77 VAL HG . 27753 1 704 . 1 1 77 77 VAL CA C 13 64.07 0.3 . 1 . . . . . 77 VAL CA . 27753 1 705 . 1 1 77 77 VAL CB C 13 32.87 0.3 . 1 . . . . . 77 VAL CB . 27753 1 706 . 1 1 77 77 VAL CG1 C 13 21.56 0.3 . 1 . . . . . 77 VAL CG . 27753 1 707 . 1 1 77 77 VAL CG2 C 13 21.56 0.3 . 1 . . . . . 77 VAL CG . 27753 1 708 . 1 1 77 77 VAL N N 15 115.67 0.15 . 1 . . . . . 77 VAL N . 27753 1 709 . 1 1 78 78 LEU H H 1 8.21 0.02 . 1 . . . . . 78 LEU HN . 27753 1 710 . 1 1 78 78 LEU HA H 1 4.39 0.02 . 1 . . . . . 78 LEU HA . 27753 1 711 . 1 1 78 78 LEU HB2 H 1 1.76 0.02 . 1 . . . . . 78 LEU HB . 27753 1 712 . 1 1 78 78 LEU HB3 H 1 1.76 0.02 . 1 . . . . . 78 LEU HB . 27753 1 713 . 1 1 78 78 LEU HG H 1 1.41 0.02 . 1 . . . . . 78 LEU HG . 27753 1 714 . 1 1 78 78 LEU HD11 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 715 . 1 1 78 78 LEU HD12 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 716 . 1 1 78 78 LEU HD13 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 717 . 1 1 78 78 LEU HD21 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 718 . 1 1 78 78 LEU HD22 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 719 . 1 1 78 78 LEU HD23 H 1 0.83 0.02 . 1 . . . . . 78 LEU HD . 27753 1 720 . 1 1 78 78 LEU CA C 13 55.32 0.3 . 1 . . . . . 78 LEU CA . 27753 1 721 . 1 1 78 78 LEU CB C 13 42.56 0.3 . 1 . . . . . 78 LEU CB . 27753 1 722 . 1 1 78 78 LEU CG C 13 26.39 0.3 . 1 . . . . . 78 LEU CG . 27753 1 723 . 1 1 78 78 LEU CD1 C 13 22.91 0.3 . 1 . . . . . 78 LEU CD . 27753 1 724 . 1 1 78 78 LEU CD2 C 13 22.91 0.3 . 1 . . . . . 78 LEU CD . 27753 1 725 . 1 1 78 78 LEU N N 15 118.79 0.15 . 1 . . . . . 78 LEU N . 27753 1 726 . 1 1 79 79 GLY H H 1 7.95 0.02 . 1 . . . . . 79 GLY HN . 27753 1 727 . 1 1 79 79 GLY HA2 H 1 4.06 0.02 . 1 . . . . . 79 GLY HA . 27753 1 728 . 1 1 79 79 GLY HA3 H 1 4.06 0.02 . 1 . . . . . 79 GLY HA . 27753 1 729 . 1 1 79 79 GLY CA C 13 45.72 0.3 . 1 . . . . . 79 GLY CA . 27753 1 730 . 1 1 79 79 GLY N N 15 107.04 0.15 . 1 . . . . . 79 GLY N . 27753 1 731 . 1 1 80 80 THR H H 1 8.29 0.02 . 1 . . . . . 80 THR HN . 27753 1 732 . 1 1 80 80 THR HA H 1 4.41 0.02 . 1 . . . . . 80 THR HA . 27753 1 733 . 1 1 80 80 THR HB H 1 4.3 0.02 . 1 . . . . . 80 THR HB . 27753 1 734 . 1 1 80 80 THR HG21 H 1 1.2 0.02 . 1 . . . . . 80 THR HG2 . 27753 1 735 . 1 1 80 80 THR HG22 H 1 1.2 0.02 . 1 . . . . . 80 THR HG2 . 27753 1 736 . 1 1 80 80 THR HG23 H 1 1.2 0.02 . 1 . . . . . 80 THR HG2 . 27753 1 737 . 1 1 80 80 THR CA C 13 62.37 0.3 . 1 . . . . . 80 THR CA . 27753 1 738 . 1 1 80 80 THR CB C 13 69.03 0.3 . 1 . . . . . 80 THR CB . 27753 1 739 . 1 1 80 80 THR CG2 C 13 21.62 0.3 . 1 . . . . . 80 THR CG2 . 27753 1 740 . 1 1 80 80 THR N N 15 111.71 0.15 . 1 . . . . . 80 THR N . 27753 1 741 . 1 1 81 81 ASP H H 1 8.52 0.02 . 1 . . . . . 81 ASP HN . 27753 1 742 . 1 1 81 81 ASP HA H 1 4.55 0.02 . 1 . . . . . 81 ASP HA . 27753 1 743 . 1 1 81 81 ASP HB2 H 1 2.71 0.02 . 1 . . . . . 81 ASP HB . 27753 1 744 . 1 1 81 81 ASP HB3 H 1 2.71 0.02 . 1 . . . . . 81 ASP HB . 27753 1 745 . 1 1 81 81 ASP CA C 13 55.24 0.3 . 1 . . . . . 81 ASP CA . 27753 1 746 . 1 1 81 81 ASP CB C 13 40.67 0.3 . 1 . . . . . 81 ASP CB . 27753 1 747 . 1 1 81 81 ASP N N 15 120.68 0.15 . 1 . . . . . 81 ASP N . 27753 1 748 . 1 1 82 82 VAL H H 1 7.05 0.02 . 1 . . . . . 82 VAL HN . 27753 1 749 . 1 1 82 82 VAL CA C 13 59.18 0.3 . 1 . . . . . 82 VAL CA . 27753 1 750 . 1 1 82 82 VAL CB C 13 33.37 0.3 . 1 . . . . . 82 VAL CB . 27753 1 751 . 1 1 82 82 VAL N N 15 118.37 0.15 . 1 . . . . . 82 VAL N . 27753 1 752 . 1 1 85 85 ALA HA H 1 4.15 0.02 . 1 . . . . . 85 ALA HA . 27753 1 753 . 1 1 85 85 ALA HB1 H 1 1.44 0.02 . 1 . . . . . 85 ALA HB . 27753 1 754 . 1 1 85 85 ALA HB2 H 1 1.44 0.02 . 1 . . . . . 85 ALA HB . 27753 1 755 . 1 1 85 85 ALA HB3 H 1 1.44 0.02 . 1 . . . . . 85 ALA HB . 27753 1 756 . 1 1 85 85 ALA CA C 13 55.33 0.3 . 1 . . . . . 85 ALA CA . 27753 1 757 . 1 1 85 85 ALA CB C 13 18.3 0.3 . 1 . . . . . 85 ALA CB . 27753 1 758 . 1 1 86 86 MET H H 1 7.03 0.02 . 1 . . . . . 86 MET HN . 27753 1 759 . 1 1 86 86 MET HA H 1 4.13 0.02 . 1 . . . . . 86 MET HA . 27753 1 760 . 1 1 86 86 MET HB2 H 1 2.07 0.02 . 1 . . . . . 86 MET HB . 27753 1 761 . 1 1 86 86 MET HB3 H 1 2.07 0.02 . 1 . . . . . 86 MET HB . 27753 1 762 . 1 1 86 86 MET HG2 H 1 2.26 0.02 . 1 . . . . . 86 MET HG . 27753 1 763 . 1 1 86 86 MET HG3 H 1 2.26 0.02 . 1 . . . . . 86 MET HG . 27753 1 764 . 1 1 86 86 MET CA C 13 58.31 0.3 . 1 . . . . . 86 MET CA . 27753 1 765 . 1 1 86 86 MET CB C 13 33 0.3 . 1 . . . . . 86 MET CB . 27753 1 766 . 1 1 86 86 MET CG C 13 32.09 0.3 . 1 . . . . . 86 MET CG . 27753 1 767 . 1 1 86 86 MET N N 15 116.88 0.15 . 1 . . . . . 86 MET N . 27753 1 768 . 1 1 87 87 LYS H H 1 7.76 0.02 . 1 . . . . . 87 LYS HN . 27753 1 769 . 1 1 87 87 LYS HA H 1 3.78 0.02 . 1 . . . . . 87 LYS HA . 27753 1 770 . 1 1 87 87 LYS HB2 H 1 1.91 0.02 . 1 . . . . . 87 LYS HB . 27753 1 771 . 1 1 87 87 LYS HB3 H 1 1.91 0.02 . 1 . . . . . 87 LYS HB . 27753 1 772 . 1 1 87 87 LYS HG2 H 1 1.47 0.02 . 1 . . . . . 87 LYS HG . 27753 1 773 . 1 1 87 87 LYS HG3 H 1 1.47 0.02 . 1 . . . . . 87 LYS HG . 27753 1 774 . 1 1 87 87 LYS HD2 H 1 1.65 0.02 . 1 . . . . . 87 LYS HD . 27753 1 775 . 1 1 87 87 LYS HD3 H 1 1.65 0.02 . 1 . . . . . 87 LYS HD . 27753 1 776 . 1 1 87 87 LYS HE2 H 1 2.84 0.02 . 1 . . . . . 87 LYS HE . 27753 1 777 . 1 1 87 87 LYS HE3 H 1 2.84 0.02 . 1 . . . . . 87 LYS HE . 27753 1 778 . 1 1 87 87 LYS CA C 13 60.54 0.3 . 1 . . . . . 87 LYS CA . 27753 1 779 . 1 1 87 87 LYS CB C 13 32.07 0.3 . 1 . . . . . 87 LYS CB . 27753 1 780 . 1 1 87 87 LYS CG C 13 26.33 0.3 . 1 . . . . . 87 LYS CG . 27753 1 781 . 1 1 87 87 LYS CD C 13 29.84 0.3 . 1 . . . . . 87 LYS CD . 27753 1 782 . 1 1 87 87 LYS CE C 13 41.98 0.3 . 1 . . . . . 87 LYS CE . 27753 1 783 . 1 1 87 87 LYS N N 15 119.04 0.15 . 1 . . . . . 87 LYS N . 27753 1 784 . 1 1 88 88 ASN H H 1 8.53 0.02 . 1 . . . . . 88 ASN HN . 27753 1 785 . 1 1 88 88 ASN HA H 1 4.41 0.02 . 1 . . . . . 88 ASN HA . 27753 1 786 . 1 1 88 88 ASN HB2 H 1 2.88 0.02 . 1 . . . . . 88 ASN HB . 27753 1 787 . 1 1 88 88 ASN HB3 H 1 2.88 0.02 . 1 . . . . . 88 ASN HB . 27753 1 788 . 1 1 88 88 ASN CA C 13 55.92 0.3 . 1 . . . . . 88 ASN CA . 27753 1 789 . 1 1 88 88 ASN CB C 13 37.86 0.3 . 1 . . . . . 88 ASN CB . 27753 1 790 . 1 1 88 88 ASN N N 15 118.71 0.15 . 1 . . . . . 88 ASN N . 27753 1 791 . 1 1 89 89 ASP H H 1 7.89 0.02 . 1 . . . . . 89 ASP HN . 27753 1 792 . 1 1 89 89 ASP HA H 1 4.43 0.02 . 1 . . . . . 89 ASP HA . 27753 1 793 . 1 1 89 89 ASP HB2 H 1 2.88 0.02 . 1 . . . . . 89 ASP HB . 27753 1 794 . 1 1 89 89 ASP HB3 H 1 2.88 0.02 . 1 . . . . . 89 ASP HB . 27753 1 795 . 1 1 89 89 ASP CA C 13 57.79 0.3 . 1 . . . . . 89 ASP CA . 27753 1 796 . 1 1 89 89 ASP CB C 13 42.07 0.3 . 1 . . . . . 89 ASP CB . 27753 1 797 . 1 1 89 89 ASP N N 15 122.29 0.15 . 1 . . . . . 89 ASP N . 27753 1 798 . 1 1 90 90 MET H H 1 8.57 0.02 . 1 . . . . . 90 MET HN . 27753 1 799 . 1 1 90 90 MET HA H 1 4.11 0.02 . 1 . . . . . 90 MET HA . 27753 1 800 . 1 1 90 90 MET HB2 H 1 2.1 0.02 . 1 . . . . . 90 MET HB2 . 27753 1 801 . 1 1 90 90 MET HB3 H 1 1.9 0.02 . 1 . . . . . 90 MET HB3 . 27753 1 802 . 1 1 90 90 MET HG2 H 1 2.51 0.02 . 2 . . . . . 90 MET HG2 . 27753 1 803 . 1 1 90 90 MET HG3 H 1 2.24 0.02 . 2 . . . . . 90 MET HG3 . 27753 1 804 . 1 1 90 90 MET CA C 13 59.58 0.3 . 1 . . . . . 90 MET CA . 27753 1 805 . 1 1 90 90 MET CB C 13 33.7 0.3 . 1 . . . . . 90 MET CB . 27753 1 806 . 1 1 90 90 MET CG C 13 32.31 0.3 . 1 . . . . . 90 MET CG . 27753 1 807 . 1 1 90 90 MET N N 15 118.56 0.15 . 1 . . . . . 90 MET N . 27753 1 808 . 1 1 91 91 SER H H 1 8.09 0.02 . 1 . . . . . 91 SER HN . 27753 1 809 . 1 1 91 91 SER HA H 1 4.05 0.02 . 1 . . . . . 91 SER HA . 27753 1 810 . 1 1 91 91 SER HB2 H 1 3.87 0.02 . 1 . . . . . 91 SER HB . 27753 1 811 . 1 1 91 91 SER HB3 H 1 3.87 0.02 . 1 . . . . . 91 SER HB . 27753 1 812 . 1 1 91 91 SER CA C 13 62.46 0.3 . 1 . . . . . 91 SER CA . 27753 1 813 . 1 1 91 91 SER CB C 13 62.78 0.3 . 1 . . . . . 91 SER CB . 27753 1 814 . 1 1 91 91 SER N N 15 114.24 0.15 . 1 . . . . . 91 SER N . 27753 1 815 . 1 1 92 92 SER H H 1 7.89 0.02 . 1 . . . . . 92 SER HN . 27753 1 816 . 1 1 92 92 SER HA H 1 4.22 0.02 . 1 . . . . . 92 SER HA . 27753 1 817 . 1 1 92 92 SER HB2 H 1 4.04 0.02 . 1 . . . . . 92 SER HB . 27753 1 818 . 1 1 92 92 SER HB3 H 1 4.04 0.02 . 1 . . . . . 92 SER HB . 27753 1 819 . 1 1 92 92 SER CA C 13 61.5 0.3 . 1 . . . . . 92 SER CA . 27753 1 820 . 1 1 92 92 SER CB C 13 62.79 0.3 . 1 . . . . . 92 SER CB . 27753 1 821 . 1 1 92 92 SER N N 15 117.71 0.15 . 1 . . . . . 92 SER N . 27753 1 822 . 1 1 93 93 LEU H H 1 8.08 0.02 . 1 . . . . . 93 LEU HN . 27753 1 823 . 1 1 93 93 LEU HA H 1 4.15 0.02 . 1 . . . . . 93 LEU HA . 27753 1 824 . 1 1 93 93 LEU HB2 H 1 1.96 0.02 . 2 . . . . . 93 LEU HB2 . 27753 1 825 . 1 1 93 93 LEU HB3 H 1 1.85 0.02 . 2 . . . . . 93 LEU HB3 . 27753 1 826 . 1 1 93 93 LEU HG H 1 1.72 0.02 . 1 . . . . . 93 LEU HG . 27753 1 827 . 1 1 93 93 LEU HD11 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 828 . 1 1 93 93 LEU HD12 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 829 . 1 1 93 93 LEU HD13 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 830 . 1 1 93 93 LEU HD21 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 831 . 1 1 93 93 LEU HD22 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 832 . 1 1 93 93 LEU HD23 H 1 0.91 0.02 . 1 . . . . . 93 LEU HD . 27753 1 833 . 1 1 93 93 LEU CA C 13 58.17 0.3 . 1 . . . . . 93 LEU CA . 27753 1 834 . 1 1 93 93 LEU CB C 13 42.24 0.3 . 1 . . . . . 93 LEU CB . 27753 1 835 . 1 1 93 93 LEU CG C 13 27.22 0.3 . 1 . . . . . 93 LEU CG . 27753 1 836 . 1 1 93 93 LEU CD1 C 13 24.83 0.3 . 1 . . . . . 93 LEU CD1 . 27753 1 837 . 1 1 93 93 LEU CD2 C 13 24.06 0.3 . 1 . . . . . 93 LEU CD2 . 27753 1 838 . 1 1 93 93 LEU N N 15 123.22 0.15 . 1 . . . . . 93 LEU N . 27753 1 839 . 1 1 94 94 LEU H H 1 8.18 0.02 . 1 . . . . . 94 LEU HN . 27753 1 840 . 1 1 94 94 LEU HA H 1 3.92 0.02 . 1 . . . . . 94 LEU HA . 27753 1 841 . 1 1 94 94 LEU HB2 H 1 1.88 0.02 . 1 . . . . . 94 LEU HB . 27753 1 842 . 1 1 94 94 LEU HB3 H 1 1.88 0.02 . 1 . . . . . 94 LEU HB . 27753 1 843 . 1 1 94 94 LEU HG H 1 1.61 0.02 . 1 . . . . . 94 LEU HG . 27753 1 844 . 1 1 94 94 LEU HD11 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 845 . 1 1 94 94 LEU HD12 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 846 . 1 1 94 94 LEU HD13 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 847 . 1 1 94 94 LEU HD21 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 848 . 1 1 94 94 LEU HD22 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 849 . 1 1 94 94 LEU HD23 H 1 0.49 0.02 . 1 . . . . . 94 LEU HD . 27753 1 850 . 1 1 94 94 LEU CA C 13 57.71 0.3 . 1 . . . . . 94 LEU CA . 27753 1 851 . 1 1 94 94 LEU CB C 13 41.47 0.3 . 1 . . . . . 94 LEU CB . 27753 1 852 . 1 1 94 94 LEU CG C 13 27.1 0.3 . 1 . . . . . 94 LEU CG . 27753 1 853 . 1 1 94 94 LEU CD1 C 13 24.56 0.3 . 2 . . . . . 94 LEU CD1 . 27753 1 854 . 1 1 94 94 LEU CD2 C 13 23.87 0.3 . 2 . . . . . 94 LEU CD2 . 27753 1 855 . 1 1 94 94 LEU N N 15 118.44 0.15 . 1 . . . . . 94 LEU N . 27753 1 856 . 1 1 95 95 ALA H H 1 8.2 0.02 . 1 . . . . . 95 ALA HN . 27753 1 857 . 1 1 95 95 ALA HA H 1 3.92 0.02 . 1 . . . . . 95 ALA HA . 27753 1 858 . 1 1 95 95 ALA HB1 H 1 1.47 0.02 . 1 . . . . . 95 ALA HB . 27753 1 859 . 1 1 95 95 ALA HB2 H 1 1.47 0.02 . 1 . . . . . 95 ALA HB . 27753 1 860 . 1 1 95 95 ALA HB3 H 1 1.47 0.02 . 1 . . . . . 95 ALA HB . 27753 1 861 . 1 1 95 95 ALA CA C 13 55.46 0.3 . 1 . . . . . 95 ALA CA . 27753 1 862 . 1 1 95 95 ALA CB C 13 18.23 0.3 . 1 . . . . . 95 ALA CB . 27753 1 863 . 1 1 95 95 ALA N N 15 119.62 0.15 . 1 . . . . . 95 ALA N . 27753 1 864 . 1 1 96 96 GLN H H 1 7.96 0.02 . 1 . . . . . 96 GLN HN . 27753 1 865 . 1 1 96 96 GLN HA H 1 4.1 0.02 . 1 . . . . . 96 GLN HA . 27753 1 866 . 1 1 96 96 GLN HB2 H 1 2.23 0.02 . 1 . . . . . 96 GLN HB . 27753 1 867 . 1 1 96 96 GLN HB3 H 1 2.23 0.02 . 1 . . . . . 96 GLN HB . 27753 1 868 . 1 1 96 96 GLN HG2 H 1 2.56 0.02 . 2 . . . . . 96 GLN HG2 . 27753 1 869 . 1 1 96 96 GLN HG3 H 1 2.41 0.02 . 2 . . . . . 96 GLN HG3 . 27753 1 870 . 1 1 96 96 GLN CA C 13 58.54 0.3 . 1 . . . . . 96 GLN CA . 27753 1 871 . 1 1 96 96 GLN CB C 13 28.75 0.3 . 1 . . . . . 96 GLN CB . 27753 1 872 . 1 1 96 96 GLN CG C 13 34.22 0.3 . 1 . . . . . 96 GLN CG . 27753 1 873 . 1 1 96 96 GLN N N 15 115.92 0.15 . 1 . . . . . 96 GLN N . 27753 1 874 . 1 1 97 97 GLN H H 1 7.96 0.02 . 1 . . . . . 97 GLN HN . 27753 1 875 . 1 1 97 97 GLN HA H 1 4.12 0.02 . 1 . . . . . 97 GLN HA . 27753 1 876 . 1 1 97 97 GLN HB2 H 1 2.09 0.02 . 1 . . . . . 97 GLN HB . 27753 1 877 . 1 1 97 97 GLN HB3 H 1 2.09 0.02 . 1 . . . . . 97 GLN HB . 27753 1 878 . 1 1 97 97 GLN HG2 H 1 2.39 0.02 . 1 . . . . . 97 GLN HG . 27753 1 879 . 1 1 97 97 GLN HG3 H 1 2.39 0.02 . 1 . . . . . 97 GLN HG . 27753 1 880 . 1 1 97 97 GLN CA C 13 58.36 0.3 . 1 . . . . . 97 GLN CA . 27753 1 881 . 1 1 97 97 GLN CB C 13 29.05 0.3 . 1 . . . . . 97 GLN CB . 27753 1 882 . 1 1 97 97 GLN CG C 13 34.39 0.3 . 1 . . . . . 97 GLN CG . 27753 1 883 . 1 1 97 97 GLN N N 15 119.24 0.15 . 1 . . . . . 97 GLN N . 27753 1 884 . 1 1 98 98 ILE H H 1 8.16 0.02 . 1 . . . . . 98 ILE HN . 27753 1 885 . 1 1 98 98 ILE HA H 1 3.73 0.02 . 1 . . . . . 98 ILE HA . 27753 1 886 . 1 1 98 98 ILE HB H 1 1.84 0.02 . 1 . . . . . 98 ILE HB . 27753 1 887 . 1 1 98 98 ILE HG12 H 1 1.05 0.02 . 1 . . . . . 98 ILE HG1 . 27753 1 888 . 1 1 98 98 ILE HG13 H 1 1.05 0.02 . 1 . . . . . 98 ILE HG1 . 27753 1 889 . 1 1 98 98 ILE HG21 H 1 0.84 0.02 . 1 . . . . . 98 ILE HG2 . 27753 1 890 . 1 1 98 98 ILE HG22 H 1 0.84 0.02 . 1 . . . . . 98 ILE HG2 . 27753 1 891 . 1 1 98 98 ILE HG23 H 1 0.84 0.02 . 1 . . . . . 98 ILE HG2 . 27753 1 892 . 1 1 98 98 ILE HD11 H 1 0.69 0.02 . 1 . . . . . 98 ILE HD1 . 27753 1 893 . 1 1 98 98 ILE HD12 H 1 0.69 0.02 . 1 . . . . . 98 ILE HD1 . 27753 1 894 . 1 1 98 98 ILE HD13 H 1 0.69 0.02 . 1 . . . . . 98 ILE HD1 . 27753 1 895 . 1 1 98 98 ILE CA C 13 64.06 0.3 . 1 . . . . . 98 ILE CA . 27753 1 896 . 1 1 98 98 ILE CB C 13 38.09 0.3 . 1 . . . . . 98 ILE CB . 27753 1 897 . 1 1 98 98 ILE CG1 C 13 28.77 0.3 . 1 . . . . . 98 ILE CG1 . 27753 1 898 . 1 1 98 98 ILE CG2 C 13 17.37 0.3 . 1 . . . . . 98 ILE CG2 . 27753 1 899 . 1 1 98 98 ILE CD1 C 13 13.65 0.3 . 1 . . . . . 98 ILE CD1 . 27753 1 900 . 1 1 98 98 ILE N N 15 118.91 0.15 . 1 . . . . . 98 ILE N . 27753 1 901 . 1 1 99 99 GLU H H 1 7.84 0.02 . 1 . . . . . 99 GLU HN . 27753 1 902 . 1 1 99 99 GLU HA H 1 4.1 0.02 . 1 . . . . . 99 GLU HA . 27753 1 903 . 1 1 99 99 GLU HB2 H 1 2.08 0.02 . 1 . . . . . 99 GLU HB . 27753 1 904 . 1 1 99 99 GLU HB3 H 1 2.08 0.02 . 1 . . . . . 99 GLU HB . 27753 1 905 . 1 1 99 99 GLU HG2 H 1 2.3 0.02 . 1 . . . . . 99 GLU HG . 27753 1 906 . 1 1 99 99 GLU HG3 H 1 2.3 0.02 . 1 . . . . . 99 GLU HG . 27753 1 907 . 1 1 99 99 GLU CA C 13 58.21 0.3 . 1 . . . . . 99 GLU CA . 27753 1 908 . 1 1 99 99 GLU CB C 13 29.84 0.3 . 1 . . . . . 99 GLU CB . 27753 1 909 . 1 1 99 99 GLU CG C 13 36.36 0.3 . 1 . . . . . 99 GLU CG . 27753 1 910 . 1 1 99 99 GLU N N 15 120.11 0.15 . 1 . . . . . 99 GLU N . 27753 1 911 . 1 1 100 100 ALA H H 1 7.75 0.02 . 1 . . . . . 100 ALA HN . 27753 1 912 . 1 1 100 100 ALA HA H 1 4.27 0.02 . 1 . . . . . 100 ALA HA . 27753 1 913 . 1 1 100 100 ALA HB1 H 1 1.48 0.02 . 1 . . . . . 100 ALA HB . 27753 1 914 . 1 1 100 100 ALA HB2 H 1 1.48 0.02 . 1 . . . . . 100 ALA HB . 27753 1 915 . 1 1 100 100 ALA HB3 H 1 1.48 0.02 . 1 . . . . . 100 ALA HB . 27753 1 916 . 1 1 100 100 ALA CA C 13 53.42 0.3 . 1 . . . . . 100 ALA CA . 27753 1 917 . 1 1 100 100 ALA CB C 13 19.34 0.3 . 1 . . . . . 100 ALA CB . 27753 1 918 . 1 1 100 100 ALA N N 15 120.66 0.15 . 1 . . . . . 100 ALA N . 27753 1 919 . 1 1 101 101 GLU H H 1 8.26 0.02 . 1 . . . . . 101 GLU HN . 27753 1 920 . 1 1 101 101 GLU HA H 1 4.32 0.02 . 1 . . . . . 101 GLU HA . 27753 1 921 . 1 1 101 101 GLU HB2 H 1 2.01 0.02 . 1 . . . . . 101 GLU HB . 27753 1 922 . 1 1 101 101 GLU HB3 H 1 2.01 0.02 . 1 . . . . . 101 GLU HB . 27753 1 923 . 1 1 101 101 GLU HG2 H 1 2.28 0.02 . 1 . . . . . 101 GLU HG . 27753 1 924 . 1 1 101 101 GLU HG3 H 1 2.28 0.02 . 1 . . . . . 101 GLU HG . 27753 1 925 . 1 1 101 101 GLU CA C 13 56.84 0.3 . 1 . . . . . 101 GLU CA . 27753 1 926 . 1 1 101 101 GLU CB C 13 30.24 0.3 . 1 . . . . . 101 GLU CB . 27753 1 927 . 1 1 101 101 GLU CG C 13 36.26 0.3 . 1 . . . . . 101 GLU CG . 27753 1 928 . 1 1 101 101 GLU N N 15 115.75 0.15 . 1 . . . . . 101 GLU N . 27753 1 929 . 1 1 102 102 GLY H H 1 8.22 0.02 . 1 . . . . . 102 GLY HN . 27753 1 930 . 1 1 102 102 GLY HA2 H 1 4.08 0.02 . 1 . . . . . 102 GLY HA2 . 27753 1 931 . 1 1 102 102 GLY HA3 H 1 3.88 0.02 . 1 . . . . . 102 GLY HA3 . 27753 1 932 . 1 1 102 102 GLY CA C 13 45.73 0.3 . 1 . . . . . 102 GLY CA . 27753 1 933 . 1 1 102 102 GLY N N 15 109.72 0.15 . 1 . . . . . 102 GLY N . 27753 1 934 . 1 1 103 103 VAL H H 1 7.82 0.02 . 1 . . . . . 103 VAL HN . 27753 1 935 . 1 1 103 103 VAL HA H 1 4.17 0.02 . 1 . . . . . 103 VAL HA . 27753 1 936 . 1 1 103 103 VAL HB H 1 1.99 0.02 . 1 . . . . . 103 VAL HB . 27753 1 937 . 1 1 103 103 VAL HG11 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 938 . 1 1 103 103 VAL HG12 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 939 . 1 1 103 103 VAL HG13 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 940 . 1 1 103 103 VAL HG21 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 941 . 1 1 103 103 VAL HG22 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 942 . 1 1 103 103 VAL HG23 H 1 0.87 0.02 . 1 . . . . . 103 VAL HG . 27753 1 943 . 1 1 103 103 VAL CA C 13 62.12 0.3 . 1 . . . . . 103 VAL CA . 27753 1 944 . 1 1 103 103 VAL CB C 13 33.23 0.3 . 1 . . . . . 103 VAL CB . 27753 1 945 . 1 1 103 103 VAL CG1 C 13 21.05 0.3 . 1 . . . . . 103 VAL CG . 27753 1 946 . 1 1 103 103 VAL CG2 C 13 21.05 0.3 . 1 . . . . . 103 VAL CG . 27753 1 947 . 1 1 103 103 VAL N N 15 119.31 0.15 . 1 . . . . . 103 VAL N . 27753 1 948 . 1 1 104 104 VAL H H 1 7.93 0.02 . 1 . . . . . 104 VAL HN . 27753 1 949 . 1 1 104 104 VAL HA H 1 4.33 0.02 . 1 . . . . . 104 VAL HA . 27753 1 950 . 1 1 104 104 VAL HB H 1 1.93 0.02 . 1 . . . . . 104 VAL HB . 27753 1 951 . 1 1 104 104 VAL HG11 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 952 . 1 1 104 104 VAL HG12 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 953 . 1 1 104 104 VAL HG13 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 954 . 1 1 104 104 VAL HG21 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 955 . 1 1 104 104 VAL HG22 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 956 . 1 1 104 104 VAL HG23 H 1 0.81 0.02 . 1 . . . . . 104 VAL HG . 27753 1 957 . 1 1 104 104 VAL CA C 13 61.11 0.3 . 1 . . . . . 104 VAL CA . 27753 1 958 . 1 1 104 104 VAL CB C 13 33.63 0.3 . 1 . . . . . 104 VAL CB . 27753 1 959 . 1 1 104 104 VAL CG1 C 13 21.01 0.3 . 1 . . . . . 104 VAL CG . 27753 1 960 . 1 1 104 104 VAL CG2 C 13 21.01 0.3 . 1 . . . . . 104 VAL CG . 27753 1 961 . 1 1 104 104 VAL N N 15 123.53 0.15 . 1 . . . . . 104 VAL N . 27753 1 962 . 1 1 105 105 THR H H 1 8.14 0.02 . 1 . . . . . 105 THR HN . 27753 1 963 . 1 1 105 105 THR HG21 H 1 1.27 0.02 . 1 . . . . . 105 THR HG2 . 27753 1 964 . 1 1 105 105 THR HG22 H 1 1.27 0.02 . 1 . . . . . 105 THR HG2 . 27753 1 965 . 1 1 105 105 THR HG23 H 1 1.27 0.02 . 1 . . . . . 105 THR HG2 . 27753 1 966 . 1 1 105 105 THR CA C 13 60.47 0.3 . 1 . . . . . 105 THR CA . 27753 1 967 . 1 1 105 105 THR CB C 13 71.07 0.3 . 1 . . . . . 105 THR CB . 27753 1 968 . 1 1 105 105 THR CG2 C 13 21.93 0.3 . 1 . . . . . 105 THR CG2 . 27753 1 969 . 1 1 105 105 THR N N 15 113.96 0.15 . 1 . . . . . 105 THR N . 27753 1 970 . 1 1 106 106 SER H H 1 9.02 0.02 . 1 . . . . . 106 SER HN . 27753 1 971 . 1 1 106 106 SER HA H 1 4.05 0.02 . 1 . . . . . 106 SER HA . 27753 1 972 . 1 1 106 106 SER HB2 H 1 3.93 0.02 . 1 . . . . . 106 SER HB . 27753 1 973 . 1 1 106 106 SER HB3 H 1 3.93 0.02 . 1 . . . . . 106 SER HB . 27753 1 974 . 1 1 106 106 SER CA C 13 62.15 0.3 . 1 . . . . . 106 SER CA . 27753 1 975 . 1 1 106 106 SER N N 15 117.63 0.15 . 1 . . . . . 106 SER N . 27753 1 976 . 1 1 107 107 THR H H 1 7.88 0.02 . 1 . . . . . 107 THR HN . 27753 1 977 . 1 1 107 107 THR HA H 1 4.07 0.02 . 1 . . . . . 107 THR HA . 27753 1 978 . 1 1 107 107 THR HG21 H 1 1.26 0.02 . 1 . . . . . 107 THR HG2 . 27753 1 979 . 1 1 107 107 THR HG22 H 1 1.26 0.02 . 1 . . . . . 107 THR HG2 . 27753 1 980 . 1 1 107 107 THR HG23 H 1 1.26 0.02 . 1 . . . . . 107 THR HG2 . 27753 1 981 . 1 1 107 107 THR CA C 13 65.68 0.3 . 1 . . . . . 107 THR CA . 27753 1 982 . 1 1 107 107 THR CB C 13 68.68 0.3 . 1 . . . . . 107 THR CB . 27753 1 983 . 1 1 107 107 THR CG2 C 13 21.95 0.3 . 1 . . . . . 107 THR CG2 . 27753 1 984 . 1 1 107 107 THR N N 15 116.84 0.15 . 1 . . . . . 107 THR N . 27753 1 985 . 1 1 108 108 GLU H H 1 7.78 0.02 . 1 . . . . . 108 GLU HN . 27753 1 986 . 1 1 108 108 GLU HA H 1 4.2 0.02 . 1 . . . . . 108 GLU HA . 27753 1 987 . 1 1 108 108 GLU HB2 H 1 2.12 0.02 . 1 . . . . . 108 GLU HB . 27753 1 988 . 1 1 108 108 GLU HB3 H 1 2.12 0.02 . 1 . . . . . 108 GLU HB . 27753 1 989 . 1 1 108 108 GLU HG2 H 1 2.31 0.02 . 1 . . . . . 108 GLU HG . 27753 1 990 . 1 1 108 108 GLU HG3 H 1 2.31 0.02 . 1 . . . . . 108 GLU HG . 27753 1 991 . 1 1 108 108 GLU CA C 13 59.03 0.3 . 1 . . . . . 108 GLU CA . 27753 1 992 . 1 1 108 108 GLU CB C 13 29.6 0.3 . 1 . . . . . 108 GLU CB . 27753 1 993 . 1 1 108 108 GLU CG C 13 36.51 0.3 . 1 . . . . . 108 GLU CG . 27753 1 994 . 1 1 108 108 GLU N N 15 122.78 0.15 . 1 . . . . . 108 GLU N . 27753 1 995 . 1 1 109 109 PHE H H 1 8.43 0.02 . 1 . . . . . 109 PHE HN . 27753 1 996 . 1 1 109 109 PHE HA H 1 4.56 0.02 . 1 . . . . . 109 PHE HA . 27753 1 997 . 1 1 109 109 PHE HB2 H 1 3.25 0.02 . 1 . . . . . 109 PHE HB2 . 27753 1 998 . 1 1 109 109 PHE HB3 H 1 2.94 0.02 . 1 . . . . . 109 PHE HB3 . 27753 1 999 . 1 1 109 109 PHE CA C 13 60.05 0.3 . 1 . . . . . 109 PHE CA . 27753 1 1000 . 1 1 109 109 PHE CB C 13 39.21 0.3 . 1 . . . . . 109 PHE CB . 27753 1 1001 . 1 1 109 109 PHE N N 15 120.79 0.15 . 1 . . . . . 109 PHE N . 27753 1 1002 . 1 1 110 110 ALA H H 1 8.66 0.02 . 1 . . . . . 110 ALA HN . 27753 1 1003 . 1 1 110 110 ALA HA H 1 3.8 0.02 . 1 . . . . . 110 ALA HA . 27753 1 1004 . 1 1 110 110 ALA HB1 H 1 1.44 0.02 . 1 . . . . . 110 ALA HB . 27753 1 1005 . 1 1 110 110 ALA HB2 H 1 1.44 0.02 . 1 . . . . . 110 ALA HB . 27753 1 1006 . 1 1 110 110 ALA HB3 H 1 1.44 0.02 . 1 . . . . . 110 ALA HB . 27753 1 1007 . 1 1 110 110 ALA CA C 13 55.72 0.3 . 1 . . . . . 110 ALA CA . 27753 1 1008 . 1 1 110 110 ALA CB C 13 17.84 0.3 . 1 . . . . . 110 ALA CB . 27753 1 1009 . 1 1 110 110 ALA N N 15 120.35 0.15 . 1 . . . . . 110 ALA N . 27753 1 1010 . 1 1 111 111 SER H H 1 7.74 0.02 . 1 . . . . . 111 SER HN . 27753 1 1011 . 1 1 111 111 SER HA H 1 4.19 0.02 . 1 . . . . . 111 SER HA . 27753 1 1012 . 1 1 111 111 SER HB2 H 1 4.01 0.02 . 1 . . . . . 111 SER HB . 27753 1 1013 . 1 1 111 111 SER HB3 H 1 4.01 0.02 . 1 . . . . . 111 SER HB . 27753 1 1014 . 1 1 111 111 SER CA C 13 61.64 0.3 . 1 . . . . . 111 SER CA . 27753 1 1015 . 1 1 111 111 SER CB C 13 62.66 0.3 . 1 . . . . . 111 SER CB . 27753 1 1016 . 1 1 111 111 SER N N 15 113.37 0.15 . 1 . . . . . 111 SER N . 27753 1 1017 . 1 1 112 112 GLN H H 1 7.82 0.02 . 1 . . . . . 112 GLN HN . 27753 1 1018 . 1 1 112 112 GLN HA H 1 4.16 0.02 . 1 . . . . . 112 GLN HA . 27753 1 1019 . 1 1 112 112 GLN HB2 H 1 2.36 0.02 . 1 . . . . . 112 GLN HB . 27753 1 1020 . 1 1 112 112 GLN HB3 H 1 2.36 0.02 . 1 . . . . . 112 GLN HB . 27753 1 1021 . 1 1 112 112 GLN HG2 H 1 2.57 0.02 . 1 . . . . . 112 GLN HG . 27753 1 1022 . 1 1 112 112 GLN HG3 H 1 2.57 0.02 . 1 . . . . . 112 GLN HG . 27753 1 1023 . 1 1 112 112 GLN CA C 13 59.08 0.3 . 1 . . . . . 112 GLN CA . 27753 1 1024 . 1 1 112 112 GLN CB C 13 28.26 0.3 . 1 . . . . . 112 GLN CB . 27753 1 1025 . 1 1 112 112 GLN CG C 13 33.88 0.3 . 1 . . . . . 112 GLN CG . 27753 1 1026 . 1 1 112 112 GLN N N 15 121.26 0.15 . 1 . . . . . 112 GLN N . 27753 1 1027 . 1 1 113 113 LEU H H 1 8.15 0.02 . 1 . . . . . 113 LEU HN . 27753 1 1028 . 1 1 113 113 LEU HA H 1 3.94 0.02 . 1 . . . . . 113 LEU HA . 27753 1 1029 . 1 1 113 113 LEU HB2 H 1 2.02 0.02 . 1 . . . . . 113 LEU HB . 27753 1 1030 . 1 1 113 113 LEU HB3 H 1 2.02 0.02 . 1 . . . . . 113 LEU HB . 27753 1 1031 . 1 1 113 113 LEU HG H 1 1.23 0.02 . 1 . . . . . 113 LEU HG . 27753 1 1032 . 1 1 113 113 LEU HD11 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1033 . 1 1 113 113 LEU HD12 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1034 . 1 1 113 113 LEU HD13 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1035 . 1 1 113 113 LEU HD21 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1036 . 1 1 113 113 LEU HD22 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1037 . 1 1 113 113 LEU HD23 H 1 0.65 0.02 . 1 . . . . . 113 LEU HD . 27753 1 1038 . 1 1 113 113 LEU CA C 13 57.8 0.3 . 1 . . . . . 113 LEU CA . 27753 1 1039 . 1 1 113 113 LEU CB C 13 42.2 0.3 . 1 . . . . . 113 LEU CB . 27753 1 1040 . 1 1 113 113 LEU CG C 13 26 0.3 . 1 . . . . . 113 LEU CG . 27753 1 1041 . 1 1 113 113 LEU CD1 C 13 22.69 0.3 . 1 . . . . . 113 LEU CD . 27753 1 1042 . 1 1 113 113 LEU CD2 C 13 22.69 0.3 . 1 . . . . . 113 LEU CD . 27753 1 1043 . 1 1 113 113 LEU N N 15 118.78 0.15 . 1 . . . . . 113 LEU N . 27753 1 1044 . 1 1 114 114 GLN H H 1 8.05 0.02 . 1 . . . . . 114 GLN HN . 27753 1 1045 . 1 1 114 114 GLN HA H 1 4.03 0.02 . 1 . . . . . 114 GLN HA . 27753 1 1046 . 1 1 114 114 GLN HB2 H 1 2.15 0.02 . 1 . . . . . 114 GLN HB . 27753 1 1047 . 1 1 114 114 GLN HB3 H 1 2.15 0.02 . 1 . . . . . 114 GLN HB . 27753 1 1048 . 1 1 114 114 GLN HG2 H 1 2.35 0.02 . 1 . . . . . 114 GLN HG2 . 27753 1 1049 . 1 1 114 114 GLN HG3 H 1 2.29 0.02 . 1 . . . . . 114 GLN HG3 . 27753 1 1050 . 1 1 114 114 GLN CA C 13 59.68 0.3 . 1 . . . . . 114 GLN CA . 27753 1 1051 . 1 1 114 114 GLN CB C 13 30.09 0.3 . 1 . . . . . 114 GLN CB . 27753 1 1052 . 1 1 114 114 GLN CG C 13 34.36 0.3 . 1 . . . . . 114 GLN CG . 27753 1 1053 . 1 1 114 114 GLN N N 15 118.23 0.15 . 1 . . . . . 114 GLN N . 27753 1 1054 . 1 1 115 115 ASN H H 1 7.98 0.02 . 1 . . . . . 115 ASN HN . 27753 1 1055 . 1 1 115 115 ASN HA H 1 4.39 0.02 . 1 . . . . . 115 ASN HA . 27753 1 1056 . 1 1 115 115 ASN HB2 H 1 2.75 0.02 . 1 . . . . . 115 ASN HB . 27753 1 1057 . 1 1 115 115 ASN HB3 H 1 2.75 0.02 . 1 . . . . . 115 ASN HB . 27753 1 1058 . 1 1 115 115 ASN CA C 13 55.88 0.3 . 1 . . . . . 115 ASN CA . 27753 1 1059 . 1 1 115 115 ASN CB C 13 39.09 0.3 . 1 . . . . . 115 ASN CB . 27753 1 1060 . 1 1 115 115 ASN N N 15 116.3 0.15 . 1 . . . . . 115 ASN N . 27753 1 1061 . 1 1 116 116 ARG H H 1 8.31 0.02 . 1 . . . . . 116 ARG HN . 27753 1 1062 . 1 1 116 116 ARG HA H 1 3.96 0.02 . 1 . . . . . 116 ARG HA . 27753 1 1063 . 1 1 116 116 ARG HB2 H 1 1.3 0.02 . 1 . . . . . 116 ARG HB . 27753 1 1064 . 1 1 116 116 ARG HB3 H 1 1.3 0.02 . 1 . . . . . 116 ARG HB . 27753 1 1065 . 1 1 116 116 ARG HG2 H 1 1.03 0.02 . 2 . . . . . 116 ARG HG2 . 27753 1 1066 . 1 1 116 116 ARG HG3 H 1 0.88 0.02 . 2 . . . . . 116 ARG HG3 . 27753 1 1067 . 1 1 116 116 ARG HD2 H 1 2.92 0.02 . 2 . . . . . 116 ARG HD2 . 27753 1 1068 . 1 1 116 116 ARG HD3 H 1 2.75 0.02 . 2 . . . . . 116 ARG HD3 . 27753 1 1069 . 1 1 116 116 ARG CA C 13 58.25 0.3 . 1 . . . . . 116 ARG CA . 27753 1 1070 . 1 1 116 116 ARG CB C 13 30.83 0.3 . 1 . . . . . 116 ARG CB . 27753 1 1071 . 1 1 116 116 ARG CG C 13 27.45 0.3 . 1 . . . . . 116 ARG CG . 27753 1 1072 . 1 1 116 116 ARG CD C 13 43.43 0.3 . 1 . . . . . 116 ARG CD . 27753 1 1073 . 1 1 116 116 ARG N N 15 117.77 0.15 . 1 . . . . . 116 ARG N . 27753 1 1074 . 1 1 117 117 TYR H H 1 7.52 0.02 . 1 . . . . . 117 TYR HN . 27753 1 1075 . 1 1 117 117 TYR HA H 1 4.85 0.02 . 1 . . . . . 117 TYR HA . 27753 1 1076 . 1 1 117 117 TYR HB2 H 1 3.4 0.02 . 2 . . . . . 117 TYR HB2 . 27753 1 1077 . 1 1 117 117 TYR HB3 H 1 2.7 0.02 . 2 . . . . . 117 TYR HB3 . 27753 1 1078 . 1 1 117 117 TYR CA C 13 57.17 0.3 . 1 . . . . . 117 TYR CA . 27753 1 1079 . 1 1 117 117 TYR CB C 13 40.16 0.3 . 1 . . . . . 117 TYR CB . 27753 1 1080 . 1 1 117 117 TYR N N 15 112.25 0.15 . 1 . . . . . 117 TYR N . 27753 1 1081 . 1 1 118 118 GLY H H 1 7.79 0.02 . 1 . . . . . 118 GLY HN . 27753 1 1082 . 1 1 118 118 GLY HA2 H 1 3.99 0.02 . 1 . . . . . 118 GLY HA . 27753 1 1083 . 1 1 118 118 GLY HA3 H 1 3.99 0.02 . 1 . . . . . 118 GLY HA . 27753 1 1084 . 1 1 118 118 GLY CA C 13 46.79 0.3 . 1 . . . . . 118 GLY CA . 27753 1 1085 . 1 1 118 118 GLY N N 15 108.72 0.15 . 1 . . . . . 118 GLY N . 27753 1 1086 . 1 1 119 119 ILE H H 1 6.65 0.02 . 1 . . . . . 119 ILE HN . 27753 1 1087 . 1 1 119 119 ILE HA H 1 4.22 0.02 . 1 . . . . . 119 ILE HA . 27753 1 1088 . 1 1 119 119 ILE HB H 1 1.85 0.02 . 1 . . . . . 119 ILE HB . 27753 1 1089 . 1 1 119 119 ILE HG12 H 1 1.05 0.02 . 1 . . . . . 119 ILE HG1 . 27753 1 1090 . 1 1 119 119 ILE HG13 H 1 1.05 0.02 . 1 . . . . . 119 ILE HG1 . 27753 1 1091 . 1 1 119 119 ILE HG21 H 1 0.9 0.02 . 1 . . . . . 119 ILE HG2 . 27753 1 1092 . 1 1 119 119 ILE HG22 H 1 0.9 0.02 . 1 . . . . . 119 ILE HG2 . 27753 1 1093 . 1 1 119 119 ILE HG23 H 1 0.9 0.02 . 1 . . . . . 119 ILE HG2 . 27753 1 1094 . 1 1 119 119 ILE HD11 H 1 0.7 0.02 . 1 . . . . . 119 ILE HD1 . 27753 1 1095 . 1 1 119 119 ILE HD12 H 1 0.7 0.02 . 1 . . . . . 119 ILE HD1 . 27753 1 1096 . 1 1 119 119 ILE HD13 H 1 0.7 0.02 . 1 . . . . . 119 ILE HD1 . 27753 1 1097 . 1 1 119 119 ILE CA C 13 60.11 0.3 . 1 . . . . . 119 ILE CA . 27753 1 1098 . 1 1 119 119 ILE CB C 13 39.14 0.3 . 1 . . . . . 119 ILE CB . 27753 1 1099 . 1 1 119 119 ILE CG1 C 13 26.28 0.3 . 1 . . . . . 119 ILE CG1 . 27753 1 1100 . 1 1 119 119 ILE CG2 C 13 17.57 0.3 . 1 . . . . . 119 ILE CG2 . 27753 1 1101 . 1 1 119 119 ILE CD1 C 13 13.58 0.3 . 1 . . . . . 119 ILE CD1 . 27753 1 1102 . 1 1 119 119 ILE N N 15 113.17 0.15 . 1 . . . . . 119 ILE N . 27753 1 1103 . 1 1 120 120 ASP H H 1 8.34 0.02 . 1 . . . . . 120 ASP HN . 27753 1 1104 . 1 1 120 120 ASP HA H 1 4.49 0.02 . 1 . . . . . 120 ASP HA . 27753 1 1105 . 1 1 120 120 ASP HB2 H 1 2.93 0.02 . 2 . . . . . 120 ASP HB2 . 27753 1 1106 . 1 1 120 120 ASP HB3 H 1 2.66 0.02 . 2 . . . . . 120 ASP HB3 . 27753 1 1107 . 1 1 120 120 ASP CA C 13 54.06 0.3 . 1 . . . . . 120 ASP CA . 27753 1 1108 . 1 1 120 120 ASP CB C 13 42.46 0.3 . 1 . . . . . 120 ASP CB . 27753 1 1109 . 1 1 120 120 ASP N N 15 121.89 0.15 . 1 . . . . . 120 ASP N . 27753 1 1110 . 1 1 121 121 LYS H H 1 8.42 0.02 . 1 . . . . . 121 LYS HN . 27753 1 1111 . 1 1 121 121 LYS HA H 1 3.68 0.02 . 1 . . . . . 121 LYS HA . 27753 1 1112 . 1 1 121 121 LYS HB2 H 1 1.85 0.02 . 1 . . . . . 121 LYS HB . 27753 1 1113 . 1 1 121 121 LYS HB3 H 1 1.85 0.02 . 1 . . . . . 121 LYS HB . 27753 1 1114 . 1 1 121 121 LYS HG2 H 1 1.33 0.02 . 1 . . . . . 121 LYS HG . 27753 1 1115 . 1 1 121 121 LYS HG3 H 1 1.33 0.02 . 1 . . . . . 121 LYS HG . 27753 1 1116 . 1 1 121 121 LYS HD2 H 1 1.7 0.02 . 1 . . . . . 121 LYS HD . 27753 1 1117 . 1 1 121 121 LYS HD3 H 1 1.7 0.02 . 1 . . . . . 121 LYS HD . 27753 1 1118 . 1 1 121 121 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 121 LYS HE . 27753 1 1119 . 1 1 121 121 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 121 LYS HE . 27753 1 1120 . 1 1 121 121 LYS CA C 13 60.2 0.3 . 1 . . . . . 121 LYS CA . 27753 1 1121 . 1 1 121 121 LYS CB C 13 33.06 0.3 . 1 . . . . . 121 LYS CB . 27753 1 1122 . 1 1 121 121 LYS CG C 13 24.38 0.3 . 1 . . . . . 121 LYS CG . 27753 1 1123 . 1 1 121 121 LYS CD C 13 29.52 0.3 . 1 . . . . . 121 LYS CD . 27753 1 1124 . 1 1 121 121 LYS CE C 13 42.05 0.3 . 1 . . . . . 121 LYS CE . 27753 1 1125 . 1 1 121 121 LYS N N 15 121.35 0.15 . 1 . . . . . 121 LYS N . 27753 1 1126 . 1 1 122 122 GLN H H 1 8.29 0.02 . 1 . . . . . 122 GLN HN . 27753 1 1127 . 1 1 122 122 GLN HA H 1 4.12 0.02 . 1 . . . . . 122 GLN HA . 27753 1 1128 . 1 1 122 122 GLN HB2 H 1 2.12 0.02 . 1 . . . . . 122 GLN HB . 27753 1 1129 . 1 1 122 122 GLN HB3 H 1 2.12 0.02 . 1 . . . . . 122 GLN HB . 27753 1 1130 . 1 1 122 122 GLN HG2 H 1 2.4 0.02 . 1 . . . . . 122 GLN HG . 27753 1 1131 . 1 1 122 122 GLN HG3 H 1 2.4 0.02 . 1 . . . . . 122 GLN HG . 27753 1 1132 . 1 1 122 122 GLN CA C 13 59.25 0.3 . 1 . . . . . 122 GLN CA . 27753 1 1133 . 1 1 122 122 GLN CB C 13 28.32 0.3 . 1 . . . . . 122 GLN CB . 27753 1 1134 . 1 1 122 122 GLN CG C 13 34.46 0.3 . 1 . . . . . 122 GLN CG . 27753 1 1135 . 1 1 122 122 GLN N N 15 117.66 0.15 . 1 . . . . . 122 GLN N . 27753 1 1136 . 1 1 123 123 GLN H H 1 8.03 0.02 . 1 . . . . . 123 GLN HN . 27753 1 1137 . 1 1 123 123 GLN HA H 1 4.02 0.02 . 1 . . . . . 123 GLN HA . 27753 1 1138 . 1 1 123 123 GLN HB2 H 1 2.29 0.02 . 1 . . . . . 123 GLN HB . 27753 1 1139 . 1 1 123 123 GLN HB3 H 1 2.29 0.02 . 1 . . . . . 123 GLN HB . 27753 1 1140 . 1 1 123 123 GLN HG2 H 1 2.47 0.02 . 1 . . . . . 123 GLN HG . 27753 1 1141 . 1 1 123 123 GLN HG3 H 1 2.47 0.02 . 1 . . . . . 123 GLN HG . 27753 1 1142 . 1 1 123 123 GLN CA C 13 58.57 0.3 . 1 . . . . . 123 GLN CA . 27753 1 1143 . 1 1 123 123 GLN CB C 13 29.11 0.3 . 1 . . . . . 123 GLN CB . 27753 1 1144 . 1 1 123 123 GLN CG C 13 34.42 0.3 . 1 . . . . . 123 GLN CG . 27753 1 1145 . 1 1 123 123 GLN N N 15 119.12 0.15 . 1 . . . . . 123 GLN N . 27753 1 1146 . 1 1 124 124 ALA H H 1 8.61 0.02 . 1 . . . . . 124 ALA HN . 27753 1 1147 . 1 1 124 124 ALA HA H 1 3.83 0.02 . 1 . . . . . 124 ALA HA . 27753 1 1148 . 1 1 124 124 ALA HB1 H 1 1.49 0.02 . 1 . . . . . 124 ALA HB . 27753 1 1149 . 1 1 124 124 ALA HB2 H 1 1.49 0.02 . 1 . . . . . 124 ALA HB . 27753 1 1150 . 1 1 124 124 ALA HB3 H 1 1.49 0.02 . 1 . . . . . 124 ALA HB . 27753 1 1151 . 1 1 124 124 ALA CA C 13 55.46 0.3 . 1 . . . . . 124 ALA CA . 27753 1 1152 . 1 1 124 124 ALA CB C 13 18.94 0.3 . 1 . . . . . 124 ALA CB . 27753 1 1153 . 1 1 124 124 ALA N N 15 121.01 0.15 . 1 . . . . . 124 ALA N . 27753 1 1154 . 1 1 125 125 GLU H H 1 8.09 0.02 . 1 . . . . . 125 GLU HN . 27753 1 1155 . 1 1 125 125 GLU HA H 1 3.92 0.02 . 1 . . . . . 125 GLU HA . 27753 1 1156 . 1 1 125 125 GLU HB2 H 1 2.15 0.02 . 1 . . . . . 125 GLU HB . 27753 1 1157 . 1 1 125 125 GLU HB3 H 1 2.15 0.02 . 1 . . . . . 125 GLU HB . 27753 1 1158 . 1 1 125 125 GLU HG2 H 1 2.46 0.02 . 1 . . . . . 125 GLU HG . 27753 1 1159 . 1 1 125 125 GLU HG3 H 1 2.46 0.02 . 1 . . . . . 125 GLU HG . 27753 1 1160 . 1 1 125 125 GLU CA C 13 60.06 0.3 . 1 . . . . . 125 GLU CA . 27753 1 1161 . 1 1 125 125 GLU CB C 13 29.56 0.3 . 1 . . . . . 125 GLU CB . 27753 1 1162 . 1 1 125 125 GLU CG C 13 36.75 0.3 . 1 . . . . . 125 GLU CG . 27753 1 1163 . 1 1 125 125 GLU N N 15 117.23 0.15 . 1 . . . . . 125 GLU N . 27753 1 1164 . 1 1 126 126 ILE H H 1 7.59 0.02 . 1 . . . . . 126 ILE HN . 27753 1 1165 . 1 1 126 126 ILE HA H 1 4.22 0.02 . 1 . . . . . 126 ILE HA . 27753 1 1166 . 1 1 126 126 ILE HB H 1 1.62 0.02 . 1 . . . . . 126 ILE HB . 27753 1 1167 . 1 1 126 126 ILE HG12 H 1 1.26 0.02 . 2 . . . . . 126 ILE HG12 . 27753 1 1168 . 1 1 126 126 ILE HG13 H 1 0.9 0.02 . 2 . . . . . 126 ILE HG13 . 27753 1 1169 . 1 1 126 126 ILE CA C 13 64.9 0.3 . 1 . . . . . 126 ILE CA . 27753 1 1170 . 1 1 126 126 ILE CB C 13 38.31 0.3 . 1 . . . . . 126 ILE CB . 27753 1 1171 . 1 1 126 126 ILE CG2 C 13 17.4 0.3 . 1 . . . . . 126 ILE CG2 . 27753 1 1172 . 1 1 126 126 ILE CD1 C 13 13.36 0.3 . 1 . . . . . 126 ILE CD1 . 27753 1 1173 . 1 1 126 126 ILE N N 15 119.17 0.15 . 1 . . . . . 126 ILE N . 27753 1 1174 . 1 1 127 127 LEU H H 1 8.26 0.02 . 1 . . . . . 127 LEU HN . 27753 1 1175 . 1 1 127 127 LEU HA H 1 3.97 0.02 . 1 . . . . . 127 LEU HA . 27753 1 1176 . 1 1 127 127 LEU HB2 H 1 1.76 0.02 . 1 . . . . . 127 LEU HB . 27753 1 1177 . 1 1 127 127 LEU HB3 H 1 1.76 0.02 . 1 . . . . . 127 LEU HB . 27753 1 1178 . 1 1 127 127 LEU HG H 1 1.37 0.02 . 1 . . . . . 127 LEU HG . 27753 1 1179 . 1 1 127 127 LEU HD11 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1180 . 1 1 127 127 LEU HD12 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1181 . 1 1 127 127 LEU HD13 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1182 . 1 1 127 127 LEU HD21 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1183 . 1 1 127 127 LEU HD22 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1184 . 1 1 127 127 LEU HD23 H 1 0.82 0.02 . 1 . . . . . 127 LEU HD . 27753 1 1185 . 1 1 127 127 LEU CA C 13 57.81 0.3 . 1 . . . . . 127 LEU CA . 27753 1 1186 . 1 1 127 127 LEU CB C 13 42.57 0.3 . 1 . . . . . 127 LEU CB . 27753 1 1187 . 1 1 127 127 LEU CG C 13 27.1 0.3 . 1 . . . . . 127 LEU CG . 27753 1 1188 . 1 1 127 127 LEU CD1 C 13 25.38 0.3 . 2 . . . . . 127 LEU CD1 . 27753 1 1189 . 1 1 127 127 LEU CD2 C 13 24.44 0.3 . 2 . . . . . 127 LEU CD2 . 27753 1 1190 . 1 1 127 127 LEU N N 15 120.4 0.15 . 1 . . . . . 127 LEU N . 27753 1 1191 . 1 1 128 128 ALA H H 1 8.5 0.02 . 1 . . . . . 128 ALA HN . 27753 1 1192 . 1 1 128 128 ALA HA H 1 4.04 0.02 . 1 . . . . . 128 ALA HA . 27753 1 1193 . 1 1 128 128 ALA HB1 H 1 1.62 0.02 . 1 . . . . . 128 ALA HB . 27753 1 1194 . 1 1 128 128 ALA HB2 H 1 1.62 0.02 . 1 . . . . . 128 ALA HB . 27753 1 1195 . 1 1 128 128 ALA HB3 H 1 1.62 0.02 . 1 . . . . . 128 ALA HB . 27753 1 1196 . 1 1 128 128 ALA CA C 13 55.78 0.3 . 1 . . . . . 128 ALA CA . 27753 1 1197 . 1 1 128 128 ALA CB C 13 19.88 0.3 . 1 . . . . . 128 ALA CB . 27753 1 1198 . 1 1 128 128 ALA N N 15 120.35 0.15 . 1 . . . . . 128 ALA N . 27753 1 1199 . 1 1 129 129 VAL H H 1 8.05 0.02 . 1 . . . . . 129 VAL HN . 27753 1 1200 . 1 1 129 129 VAL HA H 1 3.66 0.02 . 1 . . . . . 129 VAL HA . 27753 1 1201 . 1 1 129 129 VAL HB H 1 2.13 0.02 . 1 . . . . . 129 VAL HB . 27753 1 1202 . 1 1 129 129 VAL HG11 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1203 . 1 1 129 129 VAL HG12 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1204 . 1 1 129 129 VAL HG13 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1205 . 1 1 129 129 VAL HG21 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1206 . 1 1 129 129 VAL HG22 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1207 . 1 1 129 129 VAL HG23 H 1 1.15 0.02 . 1 . . . . . 129 VAL HG . 27753 1 1208 . 1 1 129 129 VAL CA C 13 66.43 0.3 . 1 . . . . . 129 VAL CA . 27753 1 1209 . 1 1 129 129 VAL CB C 13 32.08 0.3 . 1 . . . . . 129 VAL CB . 27753 1 1210 . 1 1 129 129 VAL CG1 C 13 23.31 0.3 . 1 . . . . . 129 VAL CG . 27753 1 1211 . 1 1 129 129 VAL CG2 C 13 23.31 0.3 . 1 . . . . . 129 VAL CG . 27753 1 1212 . 1 1 129 129 VAL N N 15 116.29 0.15 . 1 . . . . . 129 VAL N . 27753 1 1213 . 1 1 130 130 ALA H H 1 7.92 0.02 . 1 . . . . . 130 ALA HN . 27753 1 1214 . 1 1 130 130 ALA HA H 1 4.14 0.02 . 1 . . . . . 130 ALA HA . 27753 1 1215 . 1 1 130 130 ALA HB1 H 1 1.46 0.02 . 1 . . . . . 130 ALA HB . 27753 1 1216 . 1 1 130 130 ALA HB2 H 1 1.46 0.02 . 1 . . . . . 130 ALA HB . 27753 1 1217 . 1 1 130 130 ALA HB3 H 1 1.46 0.02 . 1 . . . . . 130 ALA HB . 27753 1 1218 . 1 1 130 130 ALA CA C 13 54.82 0.3 . 1 . . . . . 130 ALA CA . 27753 1 1219 . 1 1 130 130 ALA CB C 13 18.4 0.3 . 1 . . . . . 130 ALA CB . 27753 1 1220 . 1 1 130 130 ALA N N 15 123.06 0.15 . 1 . . . . . 130 ALA N . 27753 1 1221 . 1 1 131 131 ALA H H 1 8.7 0.02 . 1 . . . . . 131 ALA HN . 27753 1 1222 . 1 1 131 131 ALA HA H 1 3.93 0.02 . 1 . . . . . 131 ALA HA . 27753 1 1223 . 1 1 131 131 ALA HB1 H 1 1.43 0.02 . 1 . . . . . 131 ALA HB . 27753 1 1224 . 1 1 131 131 ALA HB2 H 1 1.43 0.02 . 1 . . . . . 131 ALA HB . 27753 1 1225 . 1 1 131 131 ALA HB3 H 1 1.43 0.02 . 1 . . . . . 131 ALA HB . 27753 1 1226 . 1 1 131 131 ALA CA C 13 55.14 0.3 . 1 . . . . . 131 ALA CA . 27753 1 1227 . 1 1 131 131 ALA CB C 13 18.88 0.3 . 1 . . . . . 131 ALA CB . 27753 1 1228 . 1 1 131 131 ALA N N 15 120.08 0.15 . 1 . . . . . 131 ALA N . 27753 1 1229 . 1 1 132 132 LEU H H 1 8.27 0.02 . 1 . . . . . 132 LEU HN . 27753 1 1230 . 1 1 132 132 LEU HA H 1 4.01 0.02 . 1 . . . . . 132 LEU HA . 27753 1 1231 . 1 1 132 132 LEU HB2 H 1 1.81 0.02 . 2 . . . . . 132 LEU HB2 . 27753 1 1232 . 1 1 132 132 LEU HB3 H 1 1.65 0.02 . 2 . . . . . 132 LEU HB3 . 27753 1 1233 . 1 1 132 132 LEU HG H 1 1.55 0.02 . 1 . . . . . 132 LEU HG . 27753 1 1234 . 1 1 132 132 LEU HD11 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1235 . 1 1 132 132 LEU HD12 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1236 . 1 1 132 132 LEU HD13 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1237 . 1 1 132 132 LEU HD21 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1238 . 1 1 132 132 LEU HD22 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1239 . 1 1 132 132 LEU HD23 H 1 0.71 0.02 . 1 . . . . . 132 LEU HD . 27753 1 1240 . 1 1 132 132 LEU CA C 13 57.26 0.3 . 1 . . . . . 132 LEU CA . 27753 1 1241 . 1 1 132 132 LEU CB C 13 41.13 0.3 . 1 . . . . . 132 LEU CB . 27753 1 1242 . 1 1 132 132 LEU CG C 13 27.83 0.3 . 1 . . . . . 132 LEU CG . 27753 1 1243 . 1 1 132 132 LEU CD1 C 13 24.84 0.3 . 2 . . . . . 132 LEU CD1 . 27753 1 1244 . 1 1 132 132 LEU CD2 C 13 23.91 0.3 . 2 . . . . . 132 LEU CD2 . 27753 1 1245 . 1 1 132 132 LEU N N 15 116.17 0.15 . 1 . . . . . 132 LEU N . 27753 1 1246 . 1 1 133 133 GLY H H 1 8.15 0.02 . 1 . . . . . 133 GLY HN . 27753 1 1247 . 1 1 133 133 GLY HA2 H 1 3.88 0.02 . 1 . . . . . 133 GLY HA . 27753 1 1248 . 1 1 133 133 GLY HA3 H 1 3.88 0.02 . 1 . . . . . 133 GLY HA . 27753 1 1249 . 1 1 133 133 GLY CA C 13 46.65 0.3 . 1 . . . . . 133 GLY CA . 27753 1 1250 . 1 1 133 133 GLY N N 15 107.55 0.15 . 1 . . . . . 133 GLY N . 27753 1 1251 . 1 1 134 134 ALA H H 1 7.65 0.02 . 1 . . . . . 134 ALA HN . 27753 1 1252 . 1 1 134 134 ALA HA H 1 4.25 0.02 . 1 . . . . . 134 ALA HA . 27753 1 1253 . 1 1 134 134 ALA HB1 H 1 1.45 0.02 . 1 . . . . . 134 ALA HB . 27753 1 1254 . 1 1 134 134 ALA HB2 H 1 1.45 0.02 . 1 . . . . . 134 ALA HB . 27753 1 1255 . 1 1 134 134 ALA HB3 H 1 1.45 0.02 . 1 . . . . . 134 ALA HB . 27753 1 1256 . 1 1 134 134 ALA CA C 13 53.71 0.3 . 1 . . . . . 134 ALA CA . 27753 1 1257 . 1 1 134 134 ALA CB C 13 19.26 0.3 . 1 . . . . . 134 ALA CB . 27753 1 1258 . 1 1 134 134 ALA N N 15 122.32 0.15 . 1 . . . . . 134 ALA N . 27753 1 1259 . 1 1 135 135 VAL H H 1 7.54 0.02 . 1 . . . . . 135 VAL HN . 27753 1 1260 . 1 1 135 135 VAL HA H 1 4.1 0.02 . 1 . . . . . 135 VAL HA . 27753 1 1261 . 1 1 135 135 VAL HB H 1 2.24 0.02 . 1 . . . . . 135 VAL HB . 27753 1 1262 . 1 1 135 135 VAL HG11 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1263 . 1 1 135 135 VAL HG12 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1264 . 1 1 135 135 VAL HG13 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1265 . 1 1 135 135 VAL HG21 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1266 . 1 1 135 135 VAL HG22 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1267 . 1 1 135 135 VAL HG23 H 1 0.96 0.02 . 1 . . . . . 135 VAL HG . 27753 1 1268 . 1 1 135 135 VAL CA C 13 63.39 0.3 . 1 . . . . . 135 VAL CA . 27753 1 1269 . 1 1 135 135 VAL CB C 13 32.43 0.3 . 1 . . . . . 135 VAL CB . 27753 1 1270 . 1 1 135 135 VAL CG1 C 13 21.63 0.3 . 1 . . . . . 135 VAL CG . 27753 1 1271 . 1 1 135 135 VAL CG2 C 13 21.63 0.3 . 1 . . . . . 135 VAL CG . 27753 1 1272 . 1 1 135 135 VAL N N 15 112.99 0.15 . 1 . . . . . 135 VAL N . 27753 1 1273 . 1 1 136 136 THR H H 1 7.94 0.02 . 1 . . . . . 136 THR HN . 27753 1 1274 . 1 1 136 136 THR HA H 1 4.33 0.02 . 1 . . . . . 136 THR HA . 27753 1 1275 . 1 1 136 136 THR HG21 H 1 1.25 0.02 . 1 . . . . . 136 THR HG2 . 27753 1 1276 . 1 1 136 136 THR HG22 H 1 1.25 0.02 . 1 . . . . . 136 THR HG2 . 27753 1 1277 . 1 1 136 136 THR HG23 H 1 1.25 0.02 . 1 . . . . . 136 THR HG2 . 27753 1 1278 . 1 1 136 136 THR CA C 13 62.88 0.3 . 1 . . . . . 136 THR CA . 27753 1 1279 . 1 1 136 136 THR CB C 13 69.95 0.3 . 1 . . . . . 136 THR CB . 27753 1 1280 . 1 1 136 136 THR CG2 C 13 21.61 0.3 . 1 . . . . . 136 THR CG2 . 27753 1 1281 . 1 1 136 136 THR N N 15 112.92 0.15 . 1 . . . . . 136 THR N . 27753 1 1282 . 1 1 137 137 GLY H H 1 8.13 0.02 . 1 . . . . . 137 GLY HN . 27753 1 1283 . 1 1 137 137 GLY HA2 H 1 4.01 0.02 . 1 . . . . . 137 GLY HA . 27753 1 1284 . 1 1 137 137 GLY HA3 H 1 4.01 0.02 . 1 . . . . . 137 GLY HA . 27753 1 1285 . 1 1 137 137 GLY CA C 13 45.88 0.3 . 1 . . . . . 137 GLY CA . 27753 1 1286 . 1 1 137 137 GLY N N 15 110.36 0.15 . 1 . . . . . 137 GLY N . 27753 1 1287 . 1 1 138 138 GLY H H 1 8.2 0.02 . 1 . . . . . 138 GLY HN . 27753 1 1288 . 1 1 138 138 GLY HA2 H 1 3.96 0.02 . 1 . . . . . 138 GLY HA . 27753 1 1289 . 1 1 138 138 GLY HA3 H 1 3.96 0.02 . 1 . . . . . 138 GLY HA . 27753 1 1290 . 1 1 138 138 GLY CA C 13 45.52 0.3 . 1 . . . . . 138 GLY CA . 27753 1 1291 . 1 1 138 138 GLY N N 15 108.35 0.15 . 1 . . . . . 138 GLY N . 27753 1 1292 . 1 1 139 139 MET H H 1 8.17 0.02 . 1 . . . . . 139 MET HN . 27753 1 1293 . 1 1 139 139 MET HA H 1 4.47 0.02 . 1 . . . . . 139 MET HA . 27753 1 1294 . 1 1 139 139 MET HB2 H 1 2.12 0.02 . 1 . . . . . 139 MET HB . 27753 1 1295 . 1 1 139 139 MET HB3 H 1 2.12 0.02 . 1 . . . . . 139 MET HB . 27753 1 1296 . 1 1 139 139 MET HG2 H 1 2.58 0.02 . 1 . . . . . 139 MET HG . 27753 1 1297 . 1 1 139 139 MET HG3 H 1 2.58 0.02 . 1 . . . . . 139 MET HG . 27753 1 1298 . 1 1 139 139 MET CA C 13 55.75 0.3 . 1 . . . . . 139 MET CA . 27753 1 1299 . 1 1 139 139 MET CB C 13 32.98 0.3 . 1 . . . . . 139 MET CB . 27753 1 1300 . 1 1 139 139 MET CG C 13 32.25 0.3 . 1 . . . . . 139 MET CG . 27753 1 1301 . 1 1 139 139 MET N N 15 119.29 0.15 . 1 . . . . . 139 MET N . 27753 1 1302 . 1 1 140 140 GLY H H 1 8.4 0.02 . 1 . . . . . 140 GLY HN . 27753 1 1303 . 1 1 140 140 GLY CA C 13 45.51 0.3 . 1 . . . . . 140 GLY CA . 27753 1 1304 . 1 1 140 140 GLY N N 15 109.44 0.15 . 1 . . . . . 140 GLY N . 27753 1 1305 . 1 1 141 141 LYS HA H 1 4.38 0.02 . 1 . . . . . 141 LYS HA . 27753 1 1306 . 1 1 141 141 LYS HB2 H 1 1.86 0.02 . 1 . . . . . 141 LYS HB . 27753 1 1307 . 1 1 141 141 LYS HB3 H 1 1.86 0.02 . 1 . . . . . 141 LYS HB . 27753 1 1308 . 1 1 141 141 LYS HG2 H 1 1.42 0.02 . 1 . . . . . 141 LYS HG . 27753 1 1309 . 1 1 141 141 LYS HG3 H 1 1.42 0.02 . 1 . . . . . 141 LYS HG . 27753 1 1310 . 1 1 141 141 LYS HD2 H 1 1.69 0.02 . 1 . . . . . 141 LYS HD . 27753 1 1311 . 1 1 141 141 LYS HD3 H 1 1.69 0.02 . 1 . . . . . 141 LYS HD . 27753 1 1312 . 1 1 141 141 LYS HE2 H 1 2.98 0.02 . 1 . . . . . 141 LYS HE . 27753 1 1313 . 1 1 141 141 LYS HE3 H 1 2.98 0.02 . 1 . . . . . 141 LYS HE . 27753 1 1314 . 1 1 141 141 LYS CA C 13 56.3 0.3 . 1 . . . . . 141 LYS CA . 27753 1 1315 . 1 1 141 141 LYS CB C 13 33.09 0.3 . 1 . . . . . 141 LYS CB . 27753 1 1316 . 1 1 141 141 LYS CG C 13 24.62 0.3 . 1 . . . . . 141 LYS CG . 27753 1 1317 . 1 1 141 141 LYS CD C 13 29.07 0.3 . 1 . . . . . 141 LYS CD . 27753 1 1318 . 1 1 141 141 LYS CE C 13 42.14 0.3 . 1 . . . . . 141 LYS CE . 27753 1 1319 . 1 1 142 142 SER H H 1 8.38 0.02 . 1 . . . . . 142 SER HN . 27753 1 1320 . 1 1 142 142 SER HA H 1 4.47 0.02 . 1 . . . . . 142 SER HA . 27753 1 1321 . 1 1 142 142 SER HB2 H 1 3.89 0.02 . 1 . . . . . 142 SER HB . 27753 1 1322 . 1 1 142 142 SER HB3 H 1 3.89 0.02 . 1 . . . . . 142 SER HB . 27753 1 1323 . 1 1 142 142 SER CA C 13 58.6 0.3 . 1 . . . . . 142 SER CA . 27753 1 1324 . 1 1 142 142 SER CB C 13 63.9 0.3 . 1 . . . . . 142 SER CB . 27753 1 1325 . 1 1 142 142 SER N N 15 116.76 0.15 . 1 . . . . . 142 SER N . 27753 1 1326 . 1 1 143 143 GLY H H 1 8.44 0.02 . 1 . . . . . 143 GLY HN . 27753 1 1327 . 1 1 143 143 GLY HA2 H 1 4.04 0.02 . 1 . . . . . 143 GLY HA . 27753 1 1328 . 1 1 143 143 GLY HA3 H 1 4.04 0.02 . 1 . . . . . 143 GLY HA . 27753 1 1329 . 1 1 143 143 GLY CA C 13 45.5 0.3 . 1 . . . . . 143 GLY CA . 27753 1 1330 . 1 1 143 143 GLY N N 15 110.76 0.15 . 1 . . . . . 143 GLY N . 27753 1 1331 . 1 1 144 144 THR H H 1 8.07 0.02 . 1 . . . . . 144 THR HN . 27753 1 1332 . 1 1 144 144 THR HA H 1 4.4 0.02 . 1 . . . . . 144 THR HA . 27753 1 1333 . 1 1 144 144 THR HB H 1 4.25 0.02 . 1 . . . . . 144 THR HB . 27753 1 1334 . 1 1 144 144 THR HG21 H 1 1.19 0.02 . 1 . . . . . 144 THR HG2 . 27753 1 1335 . 1 1 144 144 THR HG22 H 1 1.19 0.02 . 1 . . . . . 144 THR HG2 . 27753 1 1336 . 1 1 144 144 THR HG23 H 1 1.19 0.02 . 1 . . . . . 144 THR HG2 . 27753 1 1337 . 1 1 144 144 THR CA C 13 61.88 0.3 . 1 . . . . . 144 THR CA . 27753 1 1338 . 1 1 144 144 THR CB C 13 69.92 0.3 . 1 . . . . . 144 THR CB . 27753 1 1339 . 1 1 144 144 THR CG2 C 13 21.57 0.3 . 1 . . . . . 144 THR CG2 . 27753 1 1340 . 1 1 144 144 THR N N 15 113.26 0.15 . 1 . . . . . 144 THR N . 27753 1 1341 . 1 1 145 145 SER H H 1 8.37 0.02 . 1 . . . . . 145 SER HN . 27753 1 1342 . 1 1 145 145 SER HA H 1 4.56 0.02 . 1 . . . . . 145 SER HA . 27753 1 1343 . 1 1 145 145 SER HB2 H 1 3.88 0.02 . 1 . . . . . 145 SER HB . 27753 1 1344 . 1 1 145 145 SER HB3 H 1 3.88 0.02 . 1 . . . . . 145 SER HB . 27753 1 1345 . 1 1 145 145 SER CA C 13 58.39 0.3 . 1 . . . . . 145 SER CA . 27753 1 1346 . 1 1 145 145 SER CB C 13 63.9 0.3 . 1 . . . . . 145 SER CB . 27753 1 1347 . 1 1 145 145 SER N N 15 118.12 0.15 . 1 . . . . . 145 SER N . 27753 1 1348 . 1 1 146 146 THR H H 1 8.23 0.02 . 1 . . . . . 146 THR HN . 27753 1 1349 . 1 1 146 146 THR HA H 1 4.36 0.02 . 1 . . . . . 146 THR HA . 27753 1 1350 . 1 1 146 146 THR HB H 1 4.21 0.02 . 1 . . . . . 146 THR HB . 27753 1 1351 . 1 1 146 146 THR HG21 H 1 1.19 0.02 . 1 . . . . . 146 THR HG2 . 27753 1 1352 . 1 1 146 146 THR HG22 H 1 1.19 0.02 . 1 . . . . . 146 THR HG2 . 27753 1 1353 . 1 1 146 146 THR HG23 H 1 1.19 0.02 . 1 . . . . . 146 THR HG2 . 27753 1 1354 . 1 1 146 146 THR CA C 13 62.08 0.3 . 1 . . . . . 146 THR CA . 27753 1 1355 . 1 1 146 146 THR CB C 13 69.67 0.3 . 1 . . . . . 146 THR CB . 27753 1 1356 . 1 1 146 146 THR CG2 C 13 21.65 0.3 . 1 . . . . . 146 THR CG2 . 27753 1 1357 . 1 1 146 146 THR N N 15 116.46 0.15 . 1 . . . . . 146 THR N . 27753 1 1358 . 1 1 147 147 VAL H H 1 8.12 0.02 . 1 . . . . . 147 VAL HN . 27753 1 1359 . 1 1 147 147 VAL HA H 1 4.17 0.02 . 1 . . . . . 147 VAL HA . 27753 1 1360 . 1 1 147 147 VAL HB H 1 2.08 0.02 . 1 . . . . . 147 VAL HB . 27753 1 1361 . 1 1 147 147 VAL HG11 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1362 . 1 1 147 147 VAL HG12 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1363 . 1 1 147 147 VAL HG13 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1364 . 1 1 147 147 VAL HG21 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1365 . 1 1 147 147 VAL HG22 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1366 . 1 1 147 147 VAL HG23 H 1 0.92 0.02 . 1 . . . . . 147 VAL HG . 27753 1 1367 . 1 1 147 147 VAL CA C 13 62.54 0.3 . 1 . . . . . 147 VAL CA . 27753 1 1368 . 1 1 147 147 VAL CB C 13 32.73 0.3 . 1 . . . . . 147 VAL CB . 27753 1 1369 . 1 1 147 147 VAL CG1 C 13 20.96 0.3 . 1 . . . . . 147 VAL CG . 27753 1 1370 . 1 1 147 147 VAL CG2 C 13 20.96 0.3 . 1 . . . . . 147 VAL CG . 27753 1 1371 . 1 1 147 147 VAL N N 15 122.29 0.15 . 1 . . . . . 147 VAL N . 27753 1 1372 . 1 1 148 148 THR H H 1 8.16 0.02 . 1 . . . . . 148 THR HN . 27753 1 1373 . 1 1 148 148 THR HA H 1 4.31 0.02 . 1 . . . . . 148 THR HA . 27753 1 1374 . 1 1 148 148 THR HB H 1 4.17 0.02 . 1 . . . . . 148 THR HB . 27753 1 1375 . 1 1 148 148 THR HG21 H 1 1.18 0.02 . 1 . . . . . 148 THR HG2 . 27753 1 1376 . 1 1 148 148 THR HG22 H 1 1.18 0.02 . 1 . . . . . 148 THR HG2 . 27753 1 1377 . 1 1 148 148 THR HG23 H 1 1.18 0.02 . 1 . . . . . 148 THR HG2 . 27753 1 1378 . 1 1 148 148 THR CA C 13 62.04 0.3 . 1 . . . . . 148 THR CA . 27753 1 1379 . 1 1 148 148 THR CB C 13 69.7 0.3 . 1 . . . . . 148 THR CB . 27753 1 1380 . 1 1 148 148 THR CG2 C 13 21.69 0.3 . 1 . . . . . 148 THR CG2 . 27753 1 1381 . 1 1 148 148 THR N N 15 118.23 0.15 . 1 . . . . . 148 THR N . 27753 1 1382 . 1 1 149 149 LYS H H 1 8.26 0.02 . 1 . . . . . 149 LYS HN . 27753 1 1383 . 1 1 149 149 LYS HA H 1 4.28 0.02 . 1 . . . . . 149 LYS HA . 27753 1 1384 . 1 1 149 149 LYS HB2 H 1 2.22 0.02 . 1 . . . . . 149 LYS HB . 27753 1 1385 . 1 1 149 149 LYS HB3 H 1 2.22 0.02 . 1 . . . . . 149 LYS HB . 27753 1 1386 . 1 1 149 149 LYS HG2 H 1 1.68 0.02 . 1 . . . . . 149 LYS HG . 27753 1 1387 . 1 1 149 149 LYS HG3 H 1 1.68 0.02 . 1 . . . . . 149 LYS HG . 27753 1 1388 . 1 1 149 149 LYS HD2 H 1 1.76 0.02 . 1 . . . . . 149 LYS HD . 27753 1 1389 . 1 1 149 149 LYS HD3 H 1 1.76 0.02 . 1 . . . . . 149 LYS HD . 27753 1 1390 . 1 1 149 149 LYS HE2 H 1 2.96 0.02 . 1 . . . . . 149 LYS HE . 27753 1 1391 . 1 1 149 149 LYS HE3 H 1 2.96 0.02 . 1 . . . . . 149 LYS HE . 27753 1 1392 . 1 1 149 149 LYS CA C 13 56.47 0.3 . 1 . . . . . 149 LYS CA . 27753 1 1393 . 1 1 149 149 LYS CB C 13 33.12 0.3 . 1 . . . . . 149 LYS CB . 27753 1 1394 . 1 1 149 149 LYS CG C 13 24.64 0.3 . 1 . . . . . 149 LYS CG . 27753 1 1395 . 1 1 149 149 LYS CD C 13 29.1 0.3 . 1 . . . . . 149 LYS CD . 27753 1 1396 . 1 1 149 149 LYS CE C 13 42.06 0.3 . 1 . . . . . 149 LYS CE . 27753 1 1397 . 1 1 149 149 LYS N N 15 123.67 0.15 . 1 . . . . . 149 LYS N . 27753 1 1398 . 1 1 150 150 ASN H H 1 8.42 0.02 . 1 . . . . . 150 ASN HN . 27753 1 1399 . 1 1 150 150 ASN HA H 1 4.65 0.02 . 1 . . . . . 150 ASN HA . 27753 1 1400 . 1 1 150 150 ASN HB2 H 1 2.77 0.02 . 1 . . . . . 150 ASN HB . 27753 1 1401 . 1 1 150 150 ASN HB3 H 1 2.77 0.02 . 1 . . . . . 150 ASN HB . 27753 1 1402 . 1 1 150 150 ASN CA C 13 53.44 0.3 . 1 . . . . . 150 ASN CA . 27753 1 1403 . 1 1 150 150 ASN CB C 13 38.75 0.3 . 1 . . . . . 150 ASN CB . 27753 1 1404 . 1 1 150 150 ASN N N 15 119.76 0.15 . 1 . . . . . 150 ASN N . 27753 1 stop_ save_