data_7201 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7201 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for Bacillus subtilis YqbF ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-06-29 _Entry.Accession_date 2006-06-29 _Entry.Last_release_date 2006-08-16 _Entry.Original_release_date 2006-08-16 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Theresa Ramelot . A. . 7201 2 Michael Kennedy . A. . 7201 3 John Cort . R. . 7201 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7201 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 477 7201 '15N chemical shifts' 121 7201 '1H chemical shifts' 767 7201 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2006-08-16 2006-06-29 original author . 7201 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2HJQ 'BMRB Entry Tracking System' 7201 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7201 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR structure of YqfB from Bacillus sbutilis' _Citation.Status submitted _Citation.Type 'BMRB only' _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Theresa Ramelot . A. . 7201 1 2 Michael Kennedy . A. . 7201 1 3 John Cort . R. . 7201 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7201 _Assembly.ID 1 _Assembly.Name YqbF _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 12900 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 YqbF 1 $YqfB . . no native no no . . . 7201 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_YqfB _Entity.Sf_category entity _Entity.Sf_framecode YqfB _Entity.Entry_ID 7201 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name YqfB _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 ; MFTAKLIKGKTYNVMGITFR AGVSQTVPKKLYEYLNENPY FILTQELNNQKDDPINYTES ELKGMNKAEHESIISNLGRN PSDFKNADERIAYILKQIDN KGELEHHHHHH ; _Entity.Polymer_seq_one_letter_code ; MFTAKLIKGKTYNVMGITFR AGVSQTVPKKLYEYLNENPY FILTQELNNQKDDPINYTES ELKGMNKAEHESIISNLGRN PSDFKNADERIAYILKQIDN KGELEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'C-term: LEHHHHHH' _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 111 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2HJQ . "Nmr Structure Of Bacillus Subtilis Protein Yqbf, Northeast Structural Genomics Target Sr449" . . . . . 100.00 111 100.00 100.00 4.59e-75 . . . . 7201 1 2 no DBJ BAA06939 . "ORF77 [Bacillus subtilis]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 3 no DBJ BAA12401 . "YqbF [Bacillus subtilis]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 4 no DBJ BAM58678 . "hypothetical protein BEST7003_2477 [Bacillus subtilis BEST7003]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 5 no EMBL CAB14554 . "hypothetical protein; skin element [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 6 no EMBL CCU57216 . "hypothetical protein BSUBE1_0585 [Bacillus subtilis E1]" . . . . . 92.79 103 98.06 99.03 7.99e-67 . . . . 7201 1 7 no EMBL CEI57837 . "hypothetical protein BS49_28590 [Bacillus subtilis]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 8 no EMBL CEJ78259 . "hypothetical protein BS34A_28590 [Bacillus sp.]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 9 no GB AGG62013 . "skin element YqbF [Bacillus subtilis subsp. subtilis 6051-HGW]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 10 no GB AHA78498 . "Uncharacterized protein yqbF [Bacillus subtilis PY79]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 11 no GB AIC41068 . "hypothetical protein BSUA_02791 [Bacillus subtilis subsp. subtilis str. JH642 substr. AG174]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 12 no GB AIC45300 . "yqbF [Bacillus subtilis subsp. subtilis str. AG1839]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 13 no GB AIY93937 . "hypothetical protein QU35_14235 [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 14 no REF NP_390490 . "hypothetical protein BSU26130 [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 15 no REF WP_003229923 . "hypothetical protein [Bacillus subtilis]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 16 no REF WP_032725189 . "hypothetical protein [Bacillus subtilis]" . . . . . 92.79 103 98.06 99.03 7.99e-67 . . . . 7201 1 17 no REF YP_007534596 . "skin element YqbF [Bacillus subtilis subsp. subtilis 6051-HGW]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 18 no REF YP_008830707 . "Uncharacterized protein yqbF [Bacillus subtilis PY79]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 19 no SP P45922 . "RecName: Full=Uncharacterized protein YqbF [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 92.79 103 100.00 100.00 2.90e-68 . . . . 7201 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 7201 1 2 . PHE . 7201 1 3 . THR . 7201 1 4 . ALA . 7201 1 5 . LYS . 7201 1 6 . LEU . 7201 1 7 . ILE . 7201 1 8 . LYS . 7201 1 9 . GLY . 7201 1 10 . LYS . 7201 1 11 . THR . 7201 1 12 . TYR . 7201 1 13 . ASN . 7201 1 14 . VAL . 7201 1 15 . MET . 7201 1 16 . GLY . 7201 1 17 . ILE . 7201 1 18 . THR . 7201 1 19 . PHE . 7201 1 20 . ARG . 7201 1 21 . ALA . 7201 1 22 . GLY . 7201 1 23 . VAL . 7201 1 24 . SER . 7201 1 25 . GLN . 7201 1 26 . THR . 7201 1 27 . VAL . 7201 1 28 . PRO . 7201 1 29 . LYS . 7201 1 30 . LYS . 7201 1 31 . LEU . 7201 1 32 . TYR . 7201 1 33 . GLU . 7201 1 34 . TYR . 7201 1 35 . LEU . 7201 1 36 . ASN . 7201 1 37 . GLU . 7201 1 38 . ASN . 7201 1 39 . PRO . 7201 1 40 . TYR . 7201 1 41 . PHE . 7201 1 42 . ILE . 7201 1 43 . LEU . 7201 1 44 . THR . 7201 1 45 . GLN . 7201 1 46 . GLU . 7201 1 47 . LEU . 7201 1 48 . ASN . 7201 1 49 . ASN . 7201 1 50 . GLN . 7201 1 51 . LYS . 7201 1 52 . ASP . 7201 1 53 . ASP . 7201 1 54 . PRO . 7201 1 55 . ILE . 7201 1 56 . ASN . 7201 1 57 . TYR . 7201 1 58 . THR . 7201 1 59 . GLU . 7201 1 60 . SER . 7201 1 61 . GLU . 7201 1 62 . LEU . 7201 1 63 . LYS . 7201 1 64 . GLY . 7201 1 65 . MET . 7201 1 66 . ASN . 7201 1 67 . LYS . 7201 1 68 . ALA . 7201 1 69 . GLU . 7201 1 70 . HIS . 7201 1 71 . GLU . 7201 1 72 . SER . 7201 1 73 . ILE . 7201 1 74 . ILE . 7201 1 75 . SER . 7201 1 76 . ASN . 7201 1 77 . LEU . 7201 1 78 . GLY . 7201 1 79 . ARG . 7201 1 80 . ASN . 7201 1 81 . PRO . 7201 1 82 . SER . 7201 1 83 . ASP . 7201 1 84 . PHE . 7201 1 85 . LYS . 7201 1 86 . ASN . 7201 1 87 . ALA . 7201 1 88 . ASP . 7201 1 89 . GLU . 7201 1 90 . ARG . 7201 1 91 . ILE . 7201 1 92 . ALA . 7201 1 93 . TYR . 7201 1 94 . ILE . 7201 1 95 . LEU . 7201 1 96 . LYS . 7201 1 97 . GLN . 7201 1 98 . ILE . 7201 1 99 . ASP . 7201 1 100 . ASN . 7201 1 101 . LYS . 7201 1 102 . GLY . 7201 1 103 . GLU . 7201 1 104 . LEU . 7201 1 105 . GLU . 7201 1 106 . HIS . 7201 1 107 . HIS . 7201 1 108 . HIS . 7201 1 109 . HIS . 7201 1 110 . HIS . 7201 1 111 . HIS . 7201 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 7201 1 . PHE 2 2 7201 1 . THR 3 3 7201 1 . ALA 4 4 7201 1 . LYS 5 5 7201 1 . LEU 6 6 7201 1 . ILE 7 7 7201 1 . LYS 8 8 7201 1 . GLY 9 9 7201 1 . LYS 10 10 7201 1 . THR 11 11 7201 1 . TYR 12 12 7201 1 . ASN 13 13 7201 1 . VAL 14 14 7201 1 . MET 15 15 7201 1 . GLY 16 16 7201 1 . ILE 17 17 7201 1 . THR 18 18 7201 1 . PHE 19 19 7201 1 . ARG 20 20 7201 1 . ALA 21 21 7201 1 . GLY 22 22 7201 1 . VAL 23 23 7201 1 . SER 24 24 7201 1 . GLN 25 25 7201 1 . THR 26 26 7201 1 . VAL 27 27 7201 1 . PRO 28 28 7201 1 . LYS 29 29 7201 1 . LYS 30 30 7201 1 . LEU 31 31 7201 1 . TYR 32 32 7201 1 . GLU 33 33 7201 1 . TYR 34 34 7201 1 . LEU 35 35 7201 1 . ASN 36 36 7201 1 . GLU 37 37 7201 1 . ASN 38 38 7201 1 . PRO 39 39 7201 1 . TYR 40 40 7201 1 . PHE 41 41 7201 1 . ILE 42 42 7201 1 . LEU 43 43 7201 1 . THR 44 44 7201 1 . GLN 45 45 7201 1 . GLU 46 46 7201 1 . LEU 47 47 7201 1 . ASN 48 48 7201 1 . ASN 49 49 7201 1 . GLN 50 50 7201 1 . LYS 51 51 7201 1 . ASP 52 52 7201 1 . ASP 53 53 7201 1 . PRO 54 54 7201 1 . ILE 55 55 7201 1 . ASN 56 56 7201 1 . TYR 57 57 7201 1 . THR 58 58 7201 1 . GLU 59 59 7201 1 . SER 60 60 7201 1 . GLU 61 61 7201 1 . LEU 62 62 7201 1 . LYS 63 63 7201 1 . GLY 64 64 7201 1 . MET 65 65 7201 1 . ASN 66 66 7201 1 . LYS 67 67 7201 1 . ALA 68 68 7201 1 . GLU 69 69 7201 1 . HIS 70 70 7201 1 . GLU 71 71 7201 1 . SER 72 72 7201 1 . ILE 73 73 7201 1 . ILE 74 74 7201 1 . SER 75 75 7201 1 . ASN 76 76 7201 1 . LEU 77 77 7201 1 . GLY 78 78 7201 1 . ARG 79 79 7201 1 . ASN 80 80 7201 1 . PRO 81 81 7201 1 . SER 82 82 7201 1 . ASP 83 83 7201 1 . PHE 84 84 7201 1 . LYS 85 85 7201 1 . ASN 86 86 7201 1 . ALA 87 87 7201 1 . ASP 88 88 7201 1 . GLU 89 89 7201 1 . ARG 90 90 7201 1 . ILE 91 91 7201 1 . ALA 92 92 7201 1 . TYR 93 93 7201 1 . ILE 94 94 7201 1 . LEU 95 95 7201 1 . LYS 96 96 7201 1 . GLN 97 97 7201 1 . ILE 98 98 7201 1 . ASP 99 99 7201 1 . ASN 100 100 7201 1 . LYS 101 101 7201 1 . GLY 102 102 7201 1 . GLU 103 103 7201 1 . LEU 104 104 7201 1 . GLU 105 105 7201 1 . HIS 106 106 7201 1 . HIS 107 107 7201 1 . HIS 108 108 7201 1 . HIS 109 109 7201 1 . HIS 110 110 7201 1 . HIS 111 111 7201 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 7201 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $YqfB . 1423 . no . 'Bacillus subtilis' . . Eubacteria . Bacillus subtilis . . . . . . . . . . . . . . . . . . . . . 7201 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 7201 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $YqfB . 'recombinant technology' . 'E. coli' 'BL21 (DE3) pMGK' . . . . . . . . . . . . . . . . plasmid . . PET21 . . . . . . 7201 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7201 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 YqfB '[U-100% 13C; U-100% 15N]' . . 1 $YqfB . . 1.3 . . mM . . . . 7201 1 2 NH4Oac . . . . . . . 20 . . mM . . . . 7201 1 3 NaCL . . . . . . . 100 . . mM . . . . 7201 1 4 DTT . . . . . . . 10 . . mM . . . . 7201 1 5 CaCl2 . . . . . . . 5 . . mM . . . . 7201 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7201 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 10 mM 7201 1 pH 5.5 .1 pH 7201 1 temperature 298 1 K 7201 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz _NMR_spectrometer.Entry_ID 7201 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_750MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 750MHz _NMR_spectrometer.Entry_ID 7201 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 7201 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 600MHz Varian Inova . 600 . . . 7201 1 2 750MHz Varian Inova . 750 . . . 7201 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 7201 _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 '1H15N HSQC' no 1 $NMR_spec_expt_1 . . . . . . . . 1 $sample_1 isotropic . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7201 1 stop_ save_ save_NMR_spec_expt_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt_1 _NMR_spec_expt.Entry_ID 7201 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name unknown _NMR_spec_expt.Type unknown _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details 'experiment information not available' save_ save_NMR_spec_expt_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt_2 _NMR_spec_expt.Entry_ID 7201 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name unknown _NMR_spec_expt.Type unknown _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $750MHz _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details 'experiment information not available' save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7201 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 7201 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.000000000 . . . 1 $entry_citation . . 1 $entry_citation 7201 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 7201 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7201 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '1H15N HSQC' 1 $sample_1 isotropic 7201 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.14 0.02 . 1 . . . . 1 MET HA . 7201 1 2 . 1 1 1 1 MET HE1 H 1 1.89 0.02 . 1 . . . . 1 MET HE . 7201 1 3 . 1 1 1 1 MET HE2 H 1 1.89 0.02 . 1 . . . . 1 MET HE . 7201 1 4 . 1 1 1 1 MET HE3 H 1 1.89 0.02 . 1 . . . . 1 MET HE . 7201 1 5 . 1 1 1 1 MET C C 13 173.6 0.2 . 1 . . . . 1 MET C . 7201 1 6 . 1 1 1 1 MET CA C 13 61.2 0.2 . 1 . . . . 1 MET CA . 7201 1 7 . 1 1 1 1 MET CB C 13 34.4 0.2 . 1 . . . . 1 MET CB . 7201 1 8 . 1 1 1 1 MET CE C 13 16.9 0.2 . 1 . . . . 1 MET CE . 7201 1 9 . 1 1 2 2 PHE H H 1 8.74 0.02 . 1 . . . . 2 PHE H . 7201 1 10 . 1 1 2 2 PHE HA H 1 4.98 0.02 . 1 . . . . 2 PHE HA . 7201 1 11 . 1 1 2 2 PHE HB2 H 1 2.72 0.02 . 2 . . . . 2 PHE HB2 . 7201 1 12 . 1 1 2 2 PHE HB3 H 1 3.27 0.02 . 2 . . . . 2 PHE HB3 . 7201 1 13 . 1 1 2 2 PHE HD1 H 1 6.49 0.02 . 3 . . . . 2 PHE HD1 . 7201 1 14 . 1 1 2 2 PHE HD2 H 1 6.44 0.02 . 3 . . . . 2 PHE HD2 . 7201 1 15 . 1 1 2 2 PHE HE1 H 1 6.99 0.02 . 1 . . . . 2 PHE HE1 . 7201 1 16 . 1 1 2 2 PHE HE2 H 1 6.99 0.02 . 1 . . . . 2 PHE HE2 . 7201 1 17 . 1 1 2 2 PHE C C 13 175.4 0.2 . 1 . . . . 2 PHE C . 7201 1 18 . 1 1 2 2 PHE CA C 13 57.0 0.2 . 1 . . . . 2 PHE CA . 7201 1 19 . 1 1 2 2 PHE CB C 13 40.3 0.2 . 1 . . . . 2 PHE CB . 7201 1 20 . 1 1 2 2 PHE CD1 C 13 131.6 0.02 . 3 . . . . 2 PHE CD1 . 7201 1 21 . 1 1 2 2 PHE CD2 C 13 131.7 0.02 . 3 . . . . 2 PHE CD2 . 7201 1 22 . 1 1 2 2 PHE CE1 C 13 130.5 0.02 . 1 . . . . 2 PHE CE1 . 7201 1 23 . 1 1 2 2 PHE CE2 C 13 130.5 0.02 . 1 . . . . 2 PHE CE2 . 7201 1 24 . 1 1 2 2 PHE N N 15 126.5 0.2 . 1 . . . . 2 PHE N . 7201 1 25 . 1 1 3 3 THR H H 1 9.07 0.02 . 1 . . . . 3 THR H . 7201 1 26 . 1 1 3 3 THR HA H 1 5.43 0.02 . 1 . . . . 3 THR HA . 7201 1 27 . 1 1 3 3 THR HB H 1 4.06 0.02 . 2 . . . . 3 THR HB . 7201 1 28 . 1 1 3 3 THR HG21 H 1 1.09 0.02 . 1 . . . . 3 THR HG2 . 7201 1 29 . 1 1 3 3 THR HG22 H 1 1.09 0.02 . 1 . . . . 3 THR HG2 . 7201 1 30 . 1 1 3 3 THR HG23 H 1 1.09 0.02 . 1 . . . . 3 THR HG2 . 7201 1 31 . 1 1 3 3 THR C C 13 172.5 0.2 . 1 . . . . 3 THR C . 7201 1 32 . 1 1 3 3 THR CA C 13 60.7 0.2 . 1 . . . . 3 THR CA . 7201 1 33 . 1 1 3 3 THR CB C 13 71.9 0.2 . 1 . . . . 3 THR CB . 7201 1 34 . 1 1 3 3 THR CG2 C 13 21.4 0.2 . 1 . . . . 3 THR CG2 . 7201 1 35 . 1 1 3 3 THR N N 15 114.7 0.2 . 1 . . . . 3 THR N . 7201 1 36 . 1 1 4 4 ALA H H 1 9.06 0.02 . 1 . . . . 4 ALA H . 7201 1 37 . 1 1 4 4 ALA HA H 1 5.34 0.02 . 1 . . . . 4 ALA HA . 7201 1 38 . 1 1 4 4 ALA HB1 H 1 1.17 0.02 . 1 . . . . 4 ALA HB . 7201 1 39 . 1 1 4 4 ALA HB2 H 1 1.17 0.02 . 1 . . . . 4 ALA HB . 7201 1 40 . 1 1 4 4 ALA HB3 H 1 1.17 0.02 . 1 . . . . 4 ALA HB . 7201 1 41 . 1 1 4 4 ALA C C 13 175.4 0.2 . 1 . . . . 4 ALA C . 7201 1 42 . 1 1 4 4 ALA CA C 13 50.9 0.2 . 1 . . . . 4 ALA CA . 7201 1 43 . 1 1 4 4 ALA CB C 13 24.5 0.2 . 1 . . . . 4 ALA CB . 7201 1 44 . 1 1 4 4 ALA N N 15 123.5 0.2 . 1 . . . . 4 ALA N . 7201 1 45 . 1 1 5 5 LYS H H 1 8.48 0.02 . 1 . . . . 5 LYS H . 7201 1 46 . 1 1 5 5 LYS HA H 1 4.75 0.02 . 1 . . . . 5 LYS HA . 7201 1 47 . 1 1 5 5 LYS HB2 H 1 1.58 0.02 . 2 . . . . 5 LYS HB2 . 7201 1 48 . 1 1 5 5 LYS HB3 H 1 1.80 0.02 . 2 . . . . 5 LYS HB3 . 7201 1 49 . 1 1 5 5 LYS HG2 H 1 1.07 0.02 . 1 . . . . 5 LYS HG2 . 7201 1 50 . 1 1 5 5 LYS HG3 H 1 1.07 0.02 . 1 . . . . 5 LYS HG3 . 7201 1 51 . 1 1 5 5 LYS HD2 H 1 1.58 0.02 . 1 . . . . 5 LYS HD2 . 7201 1 52 . 1 1 5 5 LYS HD3 H 1 1.58 0.02 . 1 . . . . 5 LYS HD3 . 7201 1 53 . 1 1 5 5 LYS HE2 H 1 2.80 0.02 . 1 . . . . 5 LYS HE2 . 7201 1 54 . 1 1 5 5 LYS HE3 H 1 2.80 0.02 . 1 . . . . 5 LYS HE3 . 7201 1 55 . 1 1 5 5 LYS C C 13 173.9 0.2 . 1 . . . . 5 LYS C . 7201 1 56 . 1 1 5 5 LYS CA C 13 55.0 0.2 . 1 . . . . 5 LYS CA . 7201 1 57 . 1 1 5 5 LYS CB C 13 36.3 0.2 . 1 . . . . 5 LYS CB . 7201 1 58 . 1 1 5 5 LYS CG C 13 24.5 0.2 . 1 . . . . 5 LYS CG . 7201 1 59 . 1 1 5 5 LYS CD C 13 29.5 0.2 . 1 . . . . 5 LYS CD . 7201 1 60 . 1 1 5 5 LYS CE C 13 41.5 0.2 . 1 . . . . 5 LYS CE . 7201 1 61 . 1 1 5 5 LYS N N 15 121.0 0.2 . 1 . . . . 5 LYS N . 7201 1 62 . 1 1 6 6 LEU H H 1 9.68 0.02 . 1 . . . . 6 LEU H . 7201 1 63 . 1 1 6 6 LEU HA H 1 3.72 0.02 . 1 . . . . 6 LEU HA . 7201 1 64 . 1 1 6 6 LEU HB2 H 1 1.51 0.02 . 1 . . . . 6 LEU HB2 . 7201 1 65 . 1 1 6 6 LEU HB3 H 1 1.51 0.02 . 1 . . . . 6 LEU HB3 . 7201 1 66 . 1 1 6 6 LEU HG H 1 0.47 0.02 . 1 . . . . 6 LEU HG . 7201 1 67 . 1 1 6 6 LEU HD11 H 1 0.38 0.02 . 2 . . . . 6 LEU HD1 . 7201 1 68 . 1 1 6 6 LEU HD12 H 1 0.38 0.02 . 2 . . . . 6 LEU HD1 . 7201 1 69 . 1 1 6 6 LEU HD13 H 1 0.38 0.02 . 2 . . . . 6 LEU HD1 . 7201 1 70 . 1 1 6 6 LEU HD21 H 1 0.38 0.02 . 2 . . . . 6 LEU HD2 . 7201 1 71 . 1 1 6 6 LEU HD22 H 1 0.38 0.02 . 2 . . . . 6 LEU HD2 . 7201 1 72 . 1 1 6 6 LEU HD23 H 1 0.38 0.02 . 2 . . . . 6 LEU HD2 . 7201 1 73 . 1 1 6 6 LEU C C 13 177.1 0.2 . 1 . . . . 6 LEU C . 7201 1 74 . 1 1 6 6 LEU CA C 13 54.9 0.2 . 1 . . . . 6 LEU CA . 7201 1 75 . 1 1 6 6 LEU CB C 13 42.9 0.2 . 1 . . . . 6 LEU CB . 7201 1 76 . 1 1 6 6 LEU CG C 13 26.0 0.2 . 1 . . . . 6 LEU CG . 7201 1 77 . 1 1 6 6 LEU CD1 C 13 23.6 0.02 . 1 . . . . 6 LEU CD1 . 7201 1 78 . 1 1 6 6 LEU CD2 C 13 23.6 0.02 . 1 . . . . 6 LEU CD2 . 7201 1 79 . 1 1 6 6 LEU N N 15 131.1 0.2 . 1 . . . . 6 LEU N . 7201 1 80 . 1 1 7 7 ILE H H 1 8.64 0.02 . 1 . . . . 7 ILE H . 7201 1 81 . 1 1 7 7 ILE HA H 1 4.61 0.02 . 1 . . . . 7 ILE HA . 7201 1 82 . 1 1 7 7 ILE HB H 1 2.11 0.02 . 1 . . . . 7 ILE HB . 7201 1 83 . 1 1 7 7 ILE HG12 H 1 0.96 0.02 . 1 . . . . 7 ILE HG12 . 7201 1 84 . 1 1 7 7 ILE HG13 H 1 0.96 0.02 . 1 . . . . 7 ILE HG13 . 7201 1 85 . 1 1 7 7 ILE HG21 H 1 0.81 0.02 . 1 . . . . 7 ILE HG2 . 7201 1 86 . 1 1 7 7 ILE HG22 H 1 0.81 0.02 . 1 . . . . 7 ILE HG2 . 7201 1 87 . 1 1 7 7 ILE HG23 H 1 0.81 0.02 . 1 . . . . 7 ILE HG2 . 7201 1 88 . 1 1 7 7 ILE HD11 H 1 0.71 0.02 . 1 . . . . 7 ILE HD1 . 7201 1 89 . 1 1 7 7 ILE HD12 H 1 0.71 0.02 . 1 . . . . 7 ILE HD1 . 7201 1 90 . 1 1 7 7 ILE HD13 H 1 0.71 0.02 . 1 . . . . 7 ILE HD1 . 7201 1 91 . 1 1 7 7 ILE C C 13 175.3 0.2 . 1 . . . . 7 ILE C . 7201 1 92 . 1 1 7 7 ILE CA C 13 60.5 0.2 . 1 . . . . 7 ILE CA . 7201 1 93 . 1 1 7 7 ILE CB C 13 39.5 0.2 . 1 . . . . 7 ILE CB . 7201 1 94 . 1 1 7 7 ILE CG1 C 13 27.0 0.2 . 1 . . . . 7 ILE CG1 . 7201 1 95 . 1 1 7 7 ILE CG2 C 13 19.3 0.2 . 1 . . . . 7 ILE CG2 . 7201 1 96 . 1 1 7 7 ILE CD1 C 13 14.4 0.2 . 1 . . . . 7 ILE CD1 . 7201 1 97 . 1 1 7 7 ILE N N 15 119.6 0.2 . 1 . . . . 7 ILE N . 7201 1 98 . 1 1 8 8 LYS H H 1 6.83 0.02 . 1 . . . . 8 LYS H . 7201 1 99 . 1 1 8 8 LYS HA H 1 4.50 0.02 . 1 . . . . 8 LYS HA . 7201 1 100 . 1 1 8 8 LYS HB2 H 1 1.37 0.02 . 2 . . . . 8 LYS HB2 . 7201 1 101 . 1 1 8 8 LYS HB3 H 1 1.29 0.02 . 2 . . . . 8 LYS HB3 . 7201 1 102 . 1 1 8 8 LYS HG2 H 1 1.13 0.02 . 2 . . . . 8 LYS HG2 . 7201 1 103 . 1 1 8 8 LYS HG3 H 1 1.03 0.02 . 2 . . . . 8 LYS HG3 . 7201 1 104 . 1 1 8 8 LYS HD2 H 1 1.20 0.02 . 2 . . . . 8 LYS HD2 . 7201 1 105 . 1 1 8 8 LYS HD3 H 1 1.08 0.02 . 2 . . . . 8 LYS HD3 . 7201 1 106 . 1 1 8 8 LYS HE2 H 1 2.68 0.02 . 1 . . . . 8 LYS HE2 . 7201 1 107 . 1 1 8 8 LYS HE3 H 1 2.68 0.02 . 1 . . . . 8 LYS HE3 . 7201 1 108 . 1 1 8 8 LYS C C 13 174.8 0.2 . 1 . . . . 8 LYS C . 7201 1 109 . 1 1 8 8 LYS CA C 13 55.6 0.2 . 1 . . . . 8 LYS CA . 7201 1 110 . 1 1 8 8 LYS CB C 13 35.6 0.2 . 1 . . . . 8 LYS CB . 7201 1 111 . 1 1 8 8 LYS CG C 13 24.6 0.2 . 1 . . . . 8 LYS CG . 7201 1 112 . 1 1 8 8 LYS CD C 13 28.5 0.2 . 1 . . . . 8 LYS CD . 7201 1 113 . 1 1 8 8 LYS CE C 13 41.9 0.2 . 1 . . . . 8 LYS CE . 7201 1 114 . 1 1 8 8 LYS N N 15 121.5 0.2 . 1 . . . . 8 LYS N . 7201 1 115 . 1 1 9 9 GLY H H 1 8.27 0.02 . 1 . . . . 9 GLY H . 7201 1 116 . 1 1 9 9 GLY HA2 H 1 4.28 0.02 . 2 . . . . 9 GLY HA2 . 7201 1 117 . 1 1 9 9 GLY HA3 H 1 3.78 0.02 . 2 . . . . 9 GLY HA3 . 7201 1 118 . 1 1 9 9 GLY CA C 13 44.2 0.2 . 1 . . . . 9 GLY CA . 7201 1 119 . 1 1 9 9 GLY N N 15 110.2 0.2 . 1 . . . . 9 GLY N . 7201 1 120 . 1 1 10 10 LYS H H 1 8.56 0.02 . 1 . . . . 10 LYS H . 7201 1 121 . 1 1 10 10 LYS HA H 1 4.42 0.02 . 1 . . . . 10 LYS HA . 7201 1 122 . 1 1 10 10 LYS HB2 H 1 1.91 0.02 . 1 . . . . 10 LYS HB2 . 7201 1 123 . 1 1 10 10 LYS HB3 H 1 1.91 0.02 . 1 . . . . 10 LYS HB3 . 7201 1 124 . 1 1 10 10 LYS HG2 H 1 1.48 0.02 . 1 . . . . 10 LYS HG2 . 7201 1 125 . 1 1 10 10 LYS HG3 H 1 1.48 0.02 . 1 . . . . 10 LYS HG3 . 7201 1 126 . 1 1 10 10 LYS HD2 H 1 1.71 0.02 . 1 . . . . 10 LYS HD2 . 7201 1 127 . 1 1 10 10 LYS HD3 H 1 1.71 0.02 . 1 . . . . 10 LYS HD3 . 7201 1 128 . 1 1 10 10 LYS HE2 H 1 3.00 0.02 . 1 . . . . 10 LYS HE2 . 7201 1 129 . 1 1 10 10 LYS HE3 H 1 3.00 0.02 . 1 . . . . 10 LYS HE3 . 7201 1 130 . 1 1 10 10 LYS C C 13 177.8 0.2 . 1 . . . . 10 LYS C . 7201 1 131 . 1 1 10 10 LYS CA C 13 58.4 0.2 . 1 . . . . 10 LYS CA . 7201 1 132 . 1 1 10 10 LYS CB C 13 34.4 0.2 . 1 . . . . 10 LYS CB . 7201 1 133 . 1 1 10 10 LYS CG C 13 25.0 0.2 . 1 . . . . 10 LYS CG . 7201 1 134 . 1 1 10 10 LYS CD C 13 28.7 0.2 . 1 . . . . 10 LYS CD . 7201 1 135 . 1 1 10 10 LYS CE C 13 42.2 0.2 . 1 . . . . 10 LYS CE . 7201 1 136 . 1 1 10 10 LYS N N 15 117.5 0.2 . 1 . . . . 10 LYS N . 7201 1 137 . 1 1 11 11 THR H H 1 7.75 0.02 . 1 . . . . 11 THR H . 7201 1 138 . 1 1 11 11 THR HA H 1 5.40 0.02 . 1 . . . . 11 THR HA . 7201 1 139 . 1 1 11 11 THR HB H 1 4.15 0.02 . 2 . . . . 11 THR HB . 7201 1 140 . 1 1 11 11 THR HG21 H 1 1.14 0.02 . 1 . . . . 11 THR HG2 . 7201 1 141 . 1 1 11 11 THR HG22 H 1 1.14 0.02 . 1 . . . . 11 THR HG2 . 7201 1 142 . 1 1 11 11 THR HG23 H 1 1.14 0.02 . 1 . . . . 11 THR HG2 . 7201 1 143 . 1 1 11 11 THR C C 13 173.7 0.2 . 1 . . . . 11 THR C . 7201 1 144 . 1 1 11 11 THR CA C 13 59.7 0.2 . 1 . . . . 11 THR CA . 7201 1 145 . 1 1 11 11 THR CB C 13 72.9 0.2 . 1 . . . . 11 THR CB . 7201 1 146 . 1 1 11 11 THR CG2 C 13 21.8 0.2 . 1 . . . . 11 THR CG2 . 7201 1 147 . 1 1 11 11 THR N N 15 109.9 0.2 . 1 . . . . 11 THR N . 7201 1 148 . 1 1 12 12 TYR H H 1 8.58 0.02 . 1 . . . . 12 TYR H . 7201 1 149 . 1 1 12 12 TYR HA H 1 4.60 0.02 . 1 . . . . 12 TYR HA . 7201 1 150 . 1 1 12 12 TYR HB2 H 1 3.02 0.02 . 2 . . . . 12 TYR HB2 . 7201 1 151 . 1 1 12 12 TYR HB3 H 1 3.07 0.02 . 2 . . . . 12 TYR HB3 . 7201 1 152 . 1 1 12 12 TYR HD1 H 1 7.07 0.02 . 1 . . . . 12 TYR HD1 . 7201 1 153 . 1 1 12 12 TYR HD2 H 1 7.07 0.02 . 1 . . . . 12 TYR HD2 . 7201 1 154 . 1 1 12 12 TYR HE1 H 1 6.52 0.02 . 1 . . . . 12 TYR HE1 . 7201 1 155 . 1 1 12 12 TYR HE2 H 1 6.52 0.02 . 1 . . . . 12 TYR HE2 . 7201 1 156 . 1 1 12 12 TYR C C 13 173.8 0.2 . 1 . . . . 12 TYR C . 7201 1 157 . 1 1 12 12 TYR CA C 13 58.7 0.2 . 1 . . . . 12 TYR CA . 7201 1 158 . 1 1 12 12 TYR CB C 13 44.1 0.2 . 1 . . . . 12 TYR CB . 7201 1 159 . 1 1 12 12 TYR CD1 C 13 133.5 0.02 . 1 . . . . 12 TYR CD1 . 7201 1 160 . 1 1 12 12 TYR CD2 C 13 133.5 0.02 . 1 . . . . 12 TYR CD2 . 7201 1 161 . 1 1 12 12 TYR CE1 C 13 118.1 0.02 . 1 . . . . 12 TYR CE1 . 7201 1 162 . 1 1 12 12 TYR CE2 C 13 118.1 0.02 . 1 . . . . 12 TYR CE2 . 7201 1 163 . 1 1 12 12 TYR N N 15 123.5 0.2 . 1 . . . . 12 TYR N . 7201 1 164 . 1 1 13 13 ASN H H 1 8.60 0.02 . 1 . . . . 13 ASN H . 7201 1 165 . 1 1 13 13 ASN HA H 1 6.04 0.02 . 1 . . . . 13 ASN HA . 7201 1 166 . 1 1 13 13 ASN HB2 H 1 2.62 0.02 . 1 . . . . 13 ASN HB2 . 7201 1 167 . 1 1 13 13 ASN HB3 H 1 2.62 0.02 . 1 . . . . 13 ASN HB3 . 7201 1 168 . 1 1 13 13 ASN HD21 H 1 6.66 0.02 . 2 . . . . 13 ASN HD21 . 7201 1 169 . 1 1 13 13 ASN HD22 H 1 7.33 0.02 . 2 . . . . 13 ASN HD22 . 7201 1 170 . 1 1 13 13 ASN C C 13 173.8 0.2 . 1 . . . . 13 ASN C . 7201 1 171 . 1 1 13 13 ASN CA C 13 52.4 0.2 . 1 . . . . 13 ASN CA . 7201 1 172 . 1 1 13 13 ASN CB C 13 41.0 0.2 . 1 . . . . 13 ASN CB . 7201 1 173 . 1 1 13 13 ASN N N 15 128.2 0.2 . 1 . . . . 13 ASN N . 7201 1 174 . 1 1 13 13 ASN ND2 N 15 112.9 0.2 . 1 . . . . 13 ASN ND2 . 7201 1 175 . 1 1 14 14 VAL H H 1 9.15 0.02 . 1 . . . . 14 VAL H . 7201 1 176 . 1 1 14 14 VAL HA H 1 4.40 0.02 . 1 . . . . 14 VAL HA . 7201 1 177 . 1 1 14 14 VAL HB H 1 2.47 0.02 . 1 . . . . 14 VAL HB . 7201 1 178 . 1 1 14 14 VAL HG11 H 1 1.16 0.02 . 1 . . . . 14 VAL HG1 . 7201 1 179 . 1 1 14 14 VAL HG12 H 1 1.16 0.02 . 1 . . . . 14 VAL HG1 . 7201 1 180 . 1 1 14 14 VAL HG13 H 1 1.16 0.02 . 1 . . . . 14 VAL HG1 . 7201 1 181 . 1 1 14 14 VAL HG21 H 1 1.16 0.02 . 1 . . . . 14 VAL HG2 . 7201 1 182 . 1 1 14 14 VAL HG22 H 1 1.16 0.02 . 1 . . . . 14 VAL HG2 . 7201 1 183 . 1 1 14 14 VAL HG23 H 1 1.16 0.02 . 1 . . . . 14 VAL HG2 . 7201 1 184 . 1 1 14 14 VAL C C 13 173.2 0.2 . 1 . . . . 14 VAL C . 7201 1 185 . 1 1 14 14 VAL CA C 13 61.2 0.2 . 1 . . . . 14 VAL CA . 7201 1 186 . 1 1 14 14 VAL CB C 13 33.8 0.2 . 1 . . . . 14 VAL CB . 7201 1 187 . 1 1 14 14 VAL CG1 C 13 20.4 0.02 . 1 . . . . 14 VAL CG1 . 7201 1 188 . 1 1 14 14 VAL CG2 C 13 21.7 0.02 . 1 . . . . 14 VAL CG2 . 7201 1 189 . 1 1 14 14 VAL N N 15 123.8 0.2 . 1 . . . . 14 VAL N . 7201 1 190 . 1 1 15 15 MET H H 1 9.14 0.02 . 1 . . . . 15 MET H . 7201 1 191 . 1 1 15 15 MET HA H 1 3.82 0.02 . 1 . . . . 15 MET HA . 7201 1 192 . 1 1 15 15 MET HB2 H 1 1.86 0.02 . 1 . . . . 15 MET HB2 . 7201 1 193 . 1 1 15 15 MET HB3 H 1 1.86 0.02 . 1 . . . . 15 MET HB3 . 7201 1 194 . 1 1 15 15 MET HG2 H 1 2.28 0.02 . 2 . . . . 15 MET HG2 . 7201 1 195 . 1 1 15 15 MET HG3 H 1 2.41 0.02 . 2 . . . . 15 MET HG3 . 7201 1 196 . 1 1 15 15 MET HE1 H 1 1.62 0.02 . 1 . . . . 15 MET HE . 7201 1 197 . 1 1 15 15 MET HE2 H 1 1.62 0.02 . 1 . . . . 15 MET HE . 7201 1 198 . 1 1 15 15 MET HE3 H 1 1.62 0.02 . 1 . . . . 15 MET HE . 7201 1 199 . 1 1 15 15 MET C C 13 175.1 0.2 . 1 . . . . 15 MET C . 7201 1 200 . 1 1 15 15 MET CA C 13 56.9 0.2 . 1 . . . . 15 MET CA . 7201 1 201 . 1 1 15 15 MET CB C 13 31.2 0.2 . 1 . . . . 15 MET CB . 7201 1 202 . 1 1 15 15 MET CG C 13 33.6 0.2 . 1 . . . . 15 MET CG . 7201 1 203 . 1 1 15 15 MET CE C 13 17.1 0.2 . 1 . . . . 15 MET CE . 7201 1 204 . 1 1 15 15 MET N N 15 123.5 0.2 . 1 . . . . 15 MET N . 7201 1 205 . 1 1 16 16 GLY H H 1 8.41 0.02 . 1 . . . . 16 GLY H . 7201 1 206 . 1 1 16 16 GLY HA2 H 1 3.62 0.02 . 2 . . . . 16 GLY HA2 . 7201 1 207 . 1 1 16 16 GLY HA3 H 1 4.13 0.02 . 2 . . . . 16 GLY HA3 . 7201 1 208 . 1 1 16 16 GLY C C 13 174.0 0.2 . 1 . . . . 16 GLY C . 7201 1 209 . 1 1 16 16 GLY CA C 13 45.4 0.2 . 1 . . . . 16 GLY CA . 7201 1 210 . 1 1 16 16 GLY N N 15 103.2 0.2 . 1 . . . . 16 GLY N . 7201 1 211 . 1 1 17 17 ILE H H 1 8.19 0.02 . 1 . . . . 17 ILE H . 7201 1 212 . 1 1 17 17 ILE HA H 1 4.15 0.02 . 1 . . . . 17 ILE HA . 7201 1 213 . 1 1 17 17 ILE HB H 1 1.98 0.02 . 1 . . . . 17 ILE HB . 7201 1 214 . 1 1 17 17 ILE HG12 H 1 1.09 0.02 . 2 . . . . 17 ILE HG12 . 7201 1 215 . 1 1 17 17 ILE HG13 H 1 1.39 0.02 . 2 . . . . 17 ILE HG13 . 7201 1 216 . 1 1 17 17 ILE HG21 H 1 0.18 0.02 . 1 . . . . 17 ILE HG2 . 7201 1 217 . 1 1 17 17 ILE HG22 H 1 0.18 0.02 . 1 . . . . 17 ILE HG2 . 7201 1 218 . 1 1 17 17 ILE HG23 H 1 0.18 0.02 . 1 . . . . 17 ILE HG2 . 7201 1 219 . 1 1 17 17 ILE HD11 H 1 0.78 0.02 . 1 . . . . 17 ILE HD1 . 7201 1 220 . 1 1 17 17 ILE HD12 H 1 0.78 0.02 . 1 . . . . 17 ILE HD1 . 7201 1 221 . 1 1 17 17 ILE HD13 H 1 0.78 0.02 . 1 . . . . 17 ILE HD1 . 7201 1 222 . 1 1 17 17 ILE C C 13 175.0 0.2 . 1 . . . . 17 ILE C . 7201 1 223 . 1 1 17 17 ILE CA C 13 59.9 0.2 . 1 . . . . 17 ILE CA . 7201 1 224 . 1 1 17 17 ILE CB C 13 39.1 0.2 . 1 . . . . 17 ILE CB . 7201 1 225 . 1 1 17 17 ILE CG1 C 13 27.2 0.2 . 1 . . . . 17 ILE CG1 . 7201 1 226 . 1 1 17 17 ILE CG2 C 13 17.0 0.2 . 1 . . . . 17 ILE CG2 . 7201 1 227 . 1 1 17 17 ILE CD1 C 13 12.1 0.2 . 1 . . . . 17 ILE CD1 . 7201 1 228 . 1 1 17 17 ILE N N 15 124.4 0.2 . 1 . . . . 17 ILE N . 7201 1 229 . 1 1 18 18 THR H H 1 8.48 0.02 . 1 . . . . 18 THR H . 7201 1 230 . 1 1 18 18 THR HA H 1 4.88 0.02 . 1 . . . . 18 THR HA . 7201 1 231 . 1 1 18 18 THR HB H 1 3.94 0.02 . 2 . . . . 18 THR HB . 7201 1 232 . 1 1 18 18 THR HG21 H 1 1.16 0.02 . 1 . . . . 18 THR HG2 . 7201 1 233 . 1 1 18 18 THR HG22 H 1 1.16 0.02 . 1 . . . . 18 THR HG2 . 7201 1 234 . 1 1 18 18 THR HG23 H 1 1.16 0.02 . 1 . . . . 18 THR HG2 . 7201 1 235 . 1 1 18 18 THR C C 13 174.2 0.2 . 1 . . . . 18 THR C . 7201 1 236 . 1 1 18 18 THR CA C 13 62.3 0.2 . 1 . . . . 18 THR CA . 7201 1 237 . 1 1 18 18 THR CB C 13 69.6 0.2 . 1 . . . . 18 THR CB . 7201 1 238 . 1 1 18 18 THR CG2 C 13 21.7 0.2 . 1 . . . . 18 THR CG2 . 7201 1 239 . 1 1 18 18 THR N N 15 122.4 0.2 . 1 . . . . 18 THR N . 7201 1 240 . 1 1 19 19 PHE H H 1 9.54 0.02 . 1 . . . . 19 PHE H . 7201 1 241 . 1 1 19 19 PHE HA H 1 4.73 0.02 . 1 . . . . 19 PHE HA . 7201 1 242 . 1 1 19 19 PHE HB2 H 1 3.47 0.02 . 2 . . . . 19 PHE HB2 . 7201 1 243 . 1 1 19 19 PHE HB3 H 1 3.17 0.02 . 2 . . . . 19 PHE HB3 . 7201 1 244 . 1 1 19 19 PHE HD1 H 1 7.65 0.02 . 1 . . . . 19 PHE HD1 . 7201 1 245 . 1 1 19 19 PHE HD2 H 1 7.65 0.02 . 1 . . . . 19 PHE HD2 . 7201 1 246 . 1 1 19 19 PHE HE1 H 1 7.17 0.02 . 1 . . . . 19 PHE HE1 . 7201 1 247 . 1 1 19 19 PHE HE2 H 1 7.17 0.02 . 1 . . . . 19 PHE HE2 . 7201 1 248 . 1 1 19 19 PHE HZ H 1 6.93 0.02 . 1 . . . . 19 PHE HZ . 7201 1 249 . 1 1 19 19 PHE C C 13 175.1 0.2 . 1 . . . . 19 PHE C . 7201 1 250 . 1 1 19 19 PHE CA C 13 57.9 0.2 . 1 . . . . 19 PHE CA . 7201 1 251 . 1 1 19 19 PHE CB C 13 40.9 0.2 . 1 . . . . 19 PHE CB . 7201 1 252 . 1 1 19 19 PHE CD1 C 13 132.3 0.02 . 1 . . . . 19 PHE CD1 . 7201 1 253 . 1 1 19 19 PHE CD2 C 13 132.3 0.02 . 1 . . . . 19 PHE CD2 . 7201 1 254 . 1 1 19 19 PHE CE1 C 13 130.9 0.02 . 1 . . . . 19 PHE CE1 . 7201 1 255 . 1 1 19 19 PHE CE2 C 13 130.9 0.02 . 1 . . . . 19 PHE CE2 . 7201 1 256 . 1 1 19 19 PHE CZ C 13 129 0.2 . 1 . . . . 19 PHE CZ . 7201 1 257 . 1 1 19 19 PHE N N 15 127.8 0.2 . 1 . . . . 19 PHE N . 7201 1 258 . 1 1 20 20 ARG H H 1 9.00 0.02 . 1 . . . . 20 ARG H . 7201 1 259 . 1 1 20 20 ARG HA H 1 4.98 0.02 . 1 . . . . 20 ARG HA . 7201 1 260 . 1 1 20 20 ARG HB2 H 1 1.70 0.02 . 2 . . . . 20 ARG HB2 . 7201 1 261 . 1 1 20 20 ARG HB3 H 1 1.97 0.02 . 2 . . . . 20 ARG HB3 . 7201 1 262 . 1 1 20 20 ARG HG2 H 1 1.67 0.02 . 1 . . . . 20 ARG HG2 . 7201 1 263 . 1 1 20 20 ARG HG3 H 1 1.67 0.02 . 1 . . . . 20 ARG HG3 . 7201 1 264 . 1 1 20 20 ARG HD2 H 1 3.27 0.02 . 1 . . . . 20 ARG HD2 . 7201 1 265 . 1 1 20 20 ARG HD3 H 1 3.27 0.02 . 1 . . . . 20 ARG HD3 . 7201 1 266 . 1 1 20 20 ARG HE H 1 7.19 0.02 . 1 . . . . 20 ARG HE . 7201 1 267 . 1 1 20 20 ARG C C 13 177.3 0.2 . 1 . . . . 20 ARG C . 7201 1 268 . 1 1 20 20 ARG CA C 13 54.4 0.2 . 1 . . . . 20 ARG CA . 7201 1 269 . 1 1 20 20 ARG CB C 13 32.3 0.2 . 1 . . . . 20 ARG CB . 7201 1 270 . 1 1 20 20 ARG CG C 13 27.6 0.2 . 1 . . . . 20 ARG CG . 7201 1 271 . 1 1 20 20 ARG CD C 13 43.2 0.2 . 1 . . . . 20 ARG CD . 7201 1 272 . 1 1 20 20 ARG N N 15 119.9 0.2 . 1 . . . . 20 ARG N . 7201 1 273 . 1 1 20 20 ARG NE N 15 85.3 0.2 . 1 . . . . 20 ARG NE . 7201 1 274 . 1 1 21 21 ALA H H 1 8.05 0.02 . 1 . . . . 21 ALA H . 7201 1 275 . 1 1 21 21 ALA HA H 1 3.85 0.02 . 1 . . . . 21 ALA HA . 7201 1 276 . 1 1 21 21 ALA HB1 H 1 1.43 0.02 . 1 . . . . 21 ALA HB . 7201 1 277 . 1 1 21 21 ALA HB2 H 1 1.43 0.02 . 1 . . . . 21 ALA HB . 7201 1 278 . 1 1 21 21 ALA HB3 H 1 1.43 0.02 . 1 . . . . 21 ALA HB . 7201 1 279 . 1 1 21 21 ALA C C 13 178.6 0.2 . 1 . . . . 21 ALA C . 7201 1 280 . 1 1 21 21 ALA CA C 13 54.0 0.2 . 1 . . . . 21 ALA CA . 7201 1 281 . 1 1 21 21 ALA CB C 13 18.1 0.2 . 1 . . . . 21 ALA CB . 7201 1 282 . 1 1 21 21 ALA N N 15 127.2 0.2 . 1 . . . . 21 ALA N . 7201 1 283 . 1 1 22 22 GLY H H 1 8.90 0.02 . 1 . . . . 22 GLY H . 7201 1 284 . 1 1 22 22 GLY HA2 H 1 3.62 0.02 . 2 . . . . 22 GLY HA2 . 7201 1 285 . 1 1 22 22 GLY HA3 H 1 4.26 0.02 . 2 . . . . 22 GLY HA3 . 7201 1 286 . 1 1 22 22 GLY C C 13 173.5 0.2 . 1 . . . . 22 GLY C . 7201 1 287 . 1 1 22 22 GLY CA C 13 46.1 0.2 . 1 . . . . 22 GLY CA . 7201 1 288 . 1 1 22 22 GLY N N 15 108.3 0.2 . 1 . . . . 22 GLY N . 7201 1 289 . 1 1 23 23 VAL H H 1 7.62 0.02 . 1 . . . . 23 VAL H . 7201 1 290 . 1 1 23 23 VAL HA H 1 4.39 0.02 . 1 . . . . 23 VAL HA . 7201 1 291 . 1 1 23 23 VAL HB H 1 2.24 0.02 . 1 . . . . 23 VAL HB . 7201 1 292 . 1 1 23 23 VAL HG11 H 1 1.01 0.02 . 1 . . . . 23 VAL HG1 . 7201 1 293 . 1 1 23 23 VAL HG12 H 1 1.01 0.02 . 1 . . . . 23 VAL HG1 . 7201 1 294 . 1 1 23 23 VAL HG13 H 1 1.01 0.02 . 1 . . . . 23 VAL HG1 . 7201 1 295 . 1 1 23 23 VAL HG21 H 1 0.91 0.02 . 1 . . . . 23 VAL HG2 . 7201 1 296 . 1 1 23 23 VAL HG22 H 1 0.91 0.02 . 1 . . . . 23 VAL HG2 . 7201 1 297 . 1 1 23 23 VAL HG23 H 1 0.91 0.02 . 1 . . . . 23 VAL HG2 . 7201 1 298 . 1 1 23 23 VAL C C 13 176.5 0.2 . 1 . . . . 23 VAL C . 7201 1 299 . 1 1 23 23 VAL CA C 13 61.7 0.2 . 1 . . . . 23 VAL CA . 7201 1 300 . 1 1 23 23 VAL CB C 13 32.4 0.2 . 1 . . . . 23 VAL CB . 7201 1 301 . 1 1 23 23 VAL CG1 C 13 21.1 0.02 . 1 . . . . 23 VAL CG1 . 7201 1 302 . 1 1 23 23 VAL CG2 C 13 20.8 0.02 . 1 . . . . 23 VAL CG2 . 7201 1 303 . 1 1 23 23 VAL N N 15 121.2 0.2 . 1 . . . . 23 VAL N . 7201 1 304 . 1 1 24 24 SER H H 1 9.12 0.02 . 1 . . . . 24 SER H . 7201 1 305 . 1 1 24 24 SER HA H 1 4.67 0.02 . 1 . . . . 24 SER HA . 7201 1 306 . 1 1 24 24 SER HB2 H 1 3.80 0.02 . 2 . . . . 24 SER HB2 . 7201 1 307 . 1 1 24 24 SER HB3 H 1 3.83 0.02 . 2 . . . . 24 SER HB3 . 7201 1 308 . 1 1 24 24 SER C C 13 173.6 0.2 . 1 . . . . 24 SER C . 7201 1 309 . 1 1 24 24 SER CA C 13 59.5 0.2 . 1 . . . . 24 SER CA . 7201 1 310 . 1 1 24 24 SER CB C 13 63.3 0.2 . 1 . . . . 24 SER CB . 7201 1 311 . 1 1 24 24 SER N N 15 126.5 0.2 . 1 . . . . 24 SER N . 7201 1 312 . 1 1 25 25 GLN H H 1 8.93 0.02 . 1 . . . . 25 GLN H . 7201 1 313 . 1 1 25 25 GLN HA H 1 4.91 0.02 . 1 . . . . 25 GLN HA . 7201 1 314 . 1 1 25 25 GLN HB2 H 1 2.07 0.02 . 1 . . . . 25 GLN HB2 . 7201 1 315 . 1 1 25 25 GLN HB3 H 1 2.07 0.02 . 1 . . . . 25 GLN HB3 . 7201 1 316 . 1 1 25 25 GLN HG2 H 1 2.38 0.02 . 1 . . . . 25 GLN HG2 . 7201 1 317 . 1 1 25 25 GLN HG3 H 1 2.38 0.02 . 1 . . . . 25 GLN HG3 . 7201 1 318 . 1 1 25 25 GLN HE21 H 1 6.28 0.02 . 2 . . . . 25 GLN HE21 . 7201 1 319 . 1 1 25 25 GLN HE22 H 1 7.45 0.02 . 2 . . . . 25 GLN HE22 . 7201 1 320 . 1 1 25 25 GLN C C 13 175.2 0.2 . 1 . . . . 25 GLN C . 7201 1 321 . 1 1 25 25 GLN CA C 13 54.8 0.2 . 1 . . . . 25 GLN CA . 7201 1 322 . 1 1 25 25 GLN CB C 13 32.8 0.2 . 1 . . . . 25 GLN CB . 7201 1 323 . 1 1 25 25 GLN CG C 13 34.2 0.2 . 1 . . . . 25 GLN CG . 7201 1 324 . 1 1 25 25 GLN N N 15 122.9 0.2 . 1 . . . . 25 GLN N . 7201 1 325 . 1 1 25 25 GLN NE2 N 15 112.2 0.2 . 1 . . . . 25 GLN NE2 . 7201 1 326 . 1 1 26 26 THR H H 1 8.68 0.02 . 1 . . . . 26 THR H . 7201 1 327 . 1 1 26 26 THR HA H 1 5.04 0.02 . 1 . . . . 26 THR HA . 7201 1 328 . 1 1 26 26 THR HB H 1 4.20 0.02 . 2 . . . . 26 THR HB . 7201 1 329 . 1 1 26 26 THR HG21 H 1 1.32 0.02 . 1 . . . . 26 THR HG2 . 7201 1 330 . 1 1 26 26 THR HG22 H 1 1.32 0.02 . 1 . . . . 26 THR HG2 . 7201 1 331 . 1 1 26 26 THR HG23 H 1 1.32 0.02 . 1 . . . . 26 THR HG2 . 7201 1 332 . 1 1 26 26 THR C C 13 175.3 0.2 . 1 . . . . 26 THR C . 7201 1 333 . 1 1 26 26 THR CA C 13 62.6 0.2 . 1 . . . . 26 THR CA . 7201 1 334 . 1 1 26 26 THR CB C 13 69.3 0.2 . 1 . . . . 26 THR CB . 7201 1 335 . 1 1 26 26 THR CG2 C 13 22.8 0.2 . 1 . . . . 26 THR CG2 . 7201 1 336 . 1 1 26 26 THR N N 15 119.9 0.2 . 1 . . . . 26 THR N . 7201 1 337 . 1 1 27 27 VAL H H 1 8.83 0.02 . 1 . . . . 27 VAL H . 7201 1 338 . 1 1 27 27 VAL HA H 1 5.16 0.02 . 1 . . . . 27 VAL HA . 7201 1 339 . 1 1 27 27 VAL HB H 1 2.28 0.02 . 1 . . . . 27 VAL HB . 7201 1 340 . 1 1 27 27 VAL HG11 H 1 1.21 0.02 . 1 . . . . 27 VAL HG1 . 7201 1 341 . 1 1 27 27 VAL HG12 H 1 1.21 0.02 . 1 . . . . 27 VAL HG1 . 7201 1 342 . 1 1 27 27 VAL HG13 H 1 1.21 0.02 . 1 . . . . 27 VAL HG1 . 7201 1 343 . 1 1 27 27 VAL HG21 H 1 0.81 0.02 . 1 . . . . 27 VAL HG2 . 7201 1 344 . 1 1 27 27 VAL HG22 H 1 0.81 0.02 . 1 . . . . 27 VAL HG2 . 7201 1 345 . 1 1 27 27 VAL HG23 H 1 0.81 0.02 . 1 . . . . 27 VAL HG2 . 7201 1 346 . 1 1 27 27 VAL CA C 13 57.2 0.2 . 1 . . . . 27 VAL CA . 7201 1 347 . 1 1 27 27 VAL CB C 13 34.3 0.2 . 1 . . . . 27 VAL CB . 7201 1 348 . 1 1 27 27 VAL CG1 C 13 23.7 0.02 . 1 . . . . 27 VAL CG1 . 7201 1 349 . 1 1 27 27 VAL CG2 C 13 18.6 0.02 . 1 . . . . 27 VAL CG2 . 7201 1 350 . 1 1 27 27 VAL N N 15 117.5 0.2 . 1 . . . . 27 VAL N . 7201 1 351 . 1 1 28 28 PRO HA H 1 4.80 0.02 . 1 . . . . 28 PRO HA . 7201 1 352 . 1 1 28 28 PRO HB2 H 1 2.02 0.02 . 2 . . . . 28 PRO HB2 . 7201 1 353 . 1 1 28 28 PRO HB3 H 1 2.54 0.02 . 2 . . . . 28 PRO HB3 . 7201 1 354 . 1 1 28 28 PRO HG2 H 1 2.01 0.02 . 2 . . . . 28 PRO HG2 . 7201 1 355 . 1 1 28 28 PRO HG3 H 1 2.17 0.02 . 2 . . . . 28 PRO HG3 . 7201 1 356 . 1 1 28 28 PRO HD2 H 1 3.57 0.02 . 2 . . . . 28 PRO HD2 . 7201 1 357 . 1 1 28 28 PRO HD3 H 1 3.95 0.02 . 2 . . . . 28 PRO HD3 . 7201 1 358 . 1 1 28 28 PRO C C 13 177.4 0.2 . 1 . . . . 28 PRO C . 7201 1 359 . 1 1 28 28 PRO CA C 13 61.7 0.2 . 1 . . . . 28 PRO CA . 7201 1 360 . 1 1 28 28 PRO CB C 13 32.5 0.2 . 1 . . . . 28 PRO CB . 7201 1 361 . 1 1 28 28 PRO CG C 13 27.5 0.2 . 1 . . . . 28 PRO CG . 7201 1 362 . 1 1 29 29 LYS H H 1 8.91 0.02 . 1 . . . . 29 LYS H . 7201 1 363 . 1 1 29 29 LYS HA H 1 2.98 0.02 . 1 . . . . 29 LYS HA . 7201 1 364 . 1 1 29 29 LYS HB2 H 1 1.68 0.02 . 1 . . . . 29 LYS HB2 . 7201 1 365 . 1 1 29 29 LYS HB3 H 1 1.68 0.02 . 1 . . . . 29 LYS HB3 . 7201 1 366 . 1 1 29 29 LYS HG2 H 1 0.74 0.02 . 2 . . . . 29 LYS HG2 . 7201 1 367 . 1 1 29 29 LYS HG3 H 1 1.13 0.02 . 2 . . . . 29 LYS HG3 . 7201 1 368 . 1 1 29 29 LYS HD2 H 1 1.69 0.02 . 1 . . . . 29 LYS HD2 . 7201 1 369 . 1 1 29 29 LYS HD3 H 1 1.69 0.02 . 1 . . . . 29 LYS HD3 . 7201 1 370 . 1 1 29 29 LYS HE2 H 1 2.97 0.02 . 1 . . . . 29 LYS HE2 . 7201 1 371 . 1 1 29 29 LYS HE3 H 1 2.97 0.02 . 1 . . . . 29 LYS HE3 . 7201 1 372 . 1 1 29 29 LYS C C 13 177.5 0.2 . 1 . . . . 29 LYS C . 7201 1 373 . 1 1 29 29 LYS CA C 13 60.1 0.2 . 1 . . . . 29 LYS CA . 7201 1 374 . 1 1 29 29 LYS CB C 13 32.7 0.2 . 1 . . . . 29 LYS CB . 7201 1 375 . 1 1 29 29 LYS CG C 13 24.5 0.2 . 1 . . . . 29 LYS CG . 7201 1 376 . 1 1 29 29 LYS CD C 13 29.5 0.2 . 1 . . . . 29 LYS CD . 7201 1 377 . 1 1 29 29 LYS CE C 13 42.1 0.2 . 1 . . . . 29 LYS CE . 7201 1 378 . 1 1 29 29 LYS N N 15 124.6 0.2 . 1 . . . . 29 LYS N . 7201 1 379 . 1 1 30 30 LYS H H 1 8.61 0.02 . 1 . . . . 30 LYS H . 7201 1 380 . 1 1 30 30 LYS HA H 1 4.09 0.02 . 1 . . . . 30 LYS HA . 7201 1 381 . 1 1 30 30 LYS HB2 H 1 1.86 0.02 . 1 . . . . 30 LYS HB2 . 7201 1 382 . 1 1 30 30 LYS HB3 H 1 1.86 0.02 . 1 . . . . 30 LYS HB3 . 7201 1 383 . 1 1 30 30 LYS HG2 H 1 1.39 0.02 . 1 . . . . 30 LYS HG2 . 7201 1 384 . 1 1 30 30 LYS HG3 H 1 1.39 0.02 . 1 . . . . 30 LYS HG3 . 7201 1 385 . 1 1 30 30 LYS HD2 H 1 1.70 0.02 . 1 . . . . 30 LYS HD2 . 7201 1 386 . 1 1 30 30 LYS HD3 H 1 1.70 0.02 . 1 . . . . 30 LYS HD3 . 7201 1 387 . 1 1 30 30 LYS HE2 H 1 2.98 0.02 . 1 . . . . 30 LYS HE2 . 7201 1 388 . 1 1 30 30 LYS HE3 H 1 2.98 0.02 . 1 . . . . 30 LYS HE3 . 7201 1 389 . 1 1 30 30 LYS C C 13 178.7 0.2 . 1 . . . . 30 LYS C . 7201 1 390 . 1 1 30 30 LYS CA C 13 59.1 0.2 . 1 . . . . 30 LYS CA . 7201 1 391 . 1 1 30 30 LYS CB C 13 32.3 0.2 . 1 . . . . 30 LYS CB . 7201 1 392 . 1 1 30 30 LYS CG C 13 24.7 0.2 . 1 . . . . 30 LYS CG . 7201 1 393 . 1 1 30 30 LYS CD C 13 29.0 0.2 . 1 . . . . 30 LYS CD . 7201 1 394 . 1 1 30 30 LYS CE C 13 41.9 0.2 . 1 . . . . 30 LYS CE . 7201 1 395 . 1 1 30 30 LYS N N 15 114.5 0.2 . 1 . . . . 30 LYS N . 7201 1 396 . 1 1 31 31 LEU H H 1 7.03 0.02 . 1 . . . . 31 LEU H . 7201 1 397 . 1 1 31 31 LEU HA H 1 4.31 0.02 . 1 . . . . 31 LEU HA . 7201 1 398 . 1 1 31 31 LEU HB2 H 1 1.70 0.02 . 1 . . . . 31 LEU HB2 . 7201 1 399 . 1 1 31 31 LEU HB3 H 1 1.70 0.02 . 1 . . . . 31 LEU HB3 . 7201 1 400 . 1 1 31 31 LEU HG H 1 1.70 0.02 . 1 . . . . 31 LEU HG . 7201 1 401 . 1 1 31 31 LEU HD11 H 1 1.05 0.02 . 1 . . . . 31 LEU HD1 . 7201 1 402 . 1 1 31 31 LEU HD12 H 1 1.05 0.02 . 1 . . . . 31 LEU HD1 . 7201 1 403 . 1 1 31 31 LEU HD13 H 1 1.05 0.02 . 1 . . . . 31 LEU HD1 . 7201 1 404 . 1 1 31 31 LEU HD21 H 1 1.05 0.02 . 1 . . . . 31 LEU HD2 . 7201 1 405 . 1 1 31 31 LEU HD22 H 1 1.05 0.02 . 1 . . . . 31 LEU HD2 . 7201 1 406 . 1 1 31 31 LEU HD23 H 1 1.05 0.02 . 1 . . . . 31 LEU HD2 . 7201 1 407 . 1 1 31 31 LEU C C 13 177.1 0.2 . 1 . . . . 31 LEU C . 7201 1 408 . 1 1 31 31 LEU CA C 13 56.9 0.2 . 1 . . . . 31 LEU CA . 7201 1 409 . 1 1 31 31 LEU CB C 13 42.3 0.2 . 1 . . . . 31 LEU CB . 7201 1 410 . 1 1 31 31 LEU CG C 13 28.3 0.2 . 1 . . . . 31 LEU CG . 7201 1 411 . 1 1 31 31 LEU CD1 C 13 26.0 0.02 . 1 . . . . 31 LEU CD1 . 7201 1 412 . 1 1 31 31 LEU CD2 C 13 24.5 0.02 . 1 . . . . 31 LEU CD2 . 7201 1 413 . 1 1 31 31 LEU N N 15 120.5 0.2 . 1 . . . . 31 LEU N . 7201 1 414 . 1 1 32 32 TYR H H 1 7.73 0.02 . 1 . . . . 32 TYR H . 7201 1 415 . 1 1 32 32 TYR HA H 1 3.63 0.02 . 1 . . . . 32 TYR HA . 7201 1 416 . 1 1 32 32 TYR HB2 H 1 2.83 0.02 . 2 . . . . 32 TYR HB2 . 7201 1 417 . 1 1 32 32 TYR HB3 H 1 2.48 0.02 . 2 . . . . 32 TYR HB3 . 7201 1 418 . 1 1 32 32 TYR HD1 H 1 6.65 0.02 . 3 . . . . 32 TYR HD1 . 7201 1 419 . 1 1 32 32 TYR HD2 H 1 6.68 0.02 . 3 . . . . 32 TYR HD2 . 7201 1 420 . 1 1 32 32 TYR HE1 H 1 6.81 0.02 . 1 . . . . 32 TYR HE1 . 7201 1 421 . 1 1 32 32 TYR HE2 H 1 6.81 0.02 . 1 . . . . 32 TYR HE2 . 7201 1 422 . 1 1 32 32 TYR C C 13 177.1 0.2 . 1 . . . . 32 TYR C . 7201 1 423 . 1 1 32 32 TYR CA C 13 62.0 0.2 . 1 . . . . 32 TYR CA . 7201 1 424 . 1 1 32 32 TYR CB C 13 38.3 0.2 . 1 . . . . 32 TYR CB . 7201 1 425 . 1 1 32 32 TYR CD1 C 13 133.4 0.02 . 3 . . . . 32 TYR CD1 . 7201 1 426 . 1 1 32 32 TYR CD2 C 13 133.5 0.02 . 3 . . . . 32 TYR CD2 . 7201 1 427 . 1 1 32 32 TYR CE1 C 13 119.3 0.02 . 1 . . . . 32 TYR CE1 . 7201 1 428 . 1 1 32 32 TYR CE2 C 13 119.3 0.02 . 1 . . . . 32 TYR CE2 . 7201 1 429 . 1 1 32 32 TYR N N 15 120.9 0.2 . 1 . . . . 32 TYR N . 7201 1 430 . 1 1 33 33 GLU H H 1 8.36 0.02 . 1 . . . . 33 GLU H . 7201 1 431 . 1 1 33 33 GLU HA H 1 3.75 0.02 . 1 . . . . 33 GLU HA . 7201 1 432 . 1 1 33 33 GLU HB2 H 1 1.96 0.02 . 2 . . . . 33 GLU HB2 . 7201 1 433 . 1 1 33 33 GLU HB3 H 1 2.07 0.02 . 2 . . . . 33 GLU HB3 . 7201 1 434 . 1 1 33 33 GLU HG2 H 1 2.21 0.02 . 2 . . . . 33 GLU HG2 . 7201 1 435 . 1 1 33 33 GLU HG3 H 1 2.46 0.02 . 2 . . . . 33 GLU HG3 . 7201 1 436 . 1 1 33 33 GLU C C 13 179.3 0.2 . 1 . . . . 33 GLU C . 7201 1 437 . 1 1 33 33 GLU CA C 13 59.1 0.2 . 1 . . . . 33 GLU CA . 7201 1 438 . 1 1 33 33 GLU CB C 13 29.4 0.2 . 1 . . . . 33 GLU CB . 7201 1 439 . 1 1 33 33 GLU CG C 13 37.0 0.2 . 1 . . . . 33 GLU CG . 7201 1 440 . 1 1 33 33 GLU N N 15 115.2 0.2 . 1 . . . . 33 GLU N . 7201 1 441 . 1 1 34 34 TYR H H 1 7.59 0.02 . 1 . . . . 34 TYR H . 7201 1 442 . 1 1 34 34 TYR HA H 1 4.17 0.02 . 1 . . . . 34 TYR HA . 7201 1 443 . 1 1 34 34 TYR HB2 H 1 3.11 0.02 . 2 . . . . 34 TYR HB2 . 7201 1 444 . 1 1 34 34 TYR HB3 H 1 3.27 0.02 . 2 . . . . 34 TYR HB3 . 7201 1 445 . 1 1 34 34 TYR HD1 H 1 6.86 0.02 . 3 . . . . 34 TYR HD1 . 7201 1 446 . 1 1 34 34 TYR HD2 H 1 6.94 0.02 . 3 . . . . 34 TYR HD2 . 7201 1 447 . 1 1 34 34 TYR HE1 H 1 6.72 0.02 . 3 . . . . 34 TYR HE1 . 7201 1 448 . 1 1 34 34 TYR HE2 H 1 6.80 0.02 . 3 . . . . 34 TYR HE2 . 7201 1 449 . 1 1 34 34 TYR C C 13 177.1 0.2 . 1 . . . . 34 TYR C . 7201 1 450 . 1 1 34 34 TYR CA C 13 60.8 0.2 . 1 . . . . 34 TYR CA . 7201 1 451 . 1 1 34 34 TYR CB C 13 39.1 0.2 . 1 . . . . 34 TYR CB . 7201 1 452 . 1 1 34 34 TYR CD1 C 13 133.2 0.02 . 3 . . . . 34 TYR CD1 . 7201 1 453 . 1 1 34 34 TYR CD2 C 13 133.0 0.02 . 3 . . . . 34 TYR CD2 . 7201 1 454 . 1 1 34 34 TYR CE1 C 13 118.6 0.02 . 3 . . . . 34 TYR CE1 . 7201 1 455 . 1 1 34 34 TYR CE2 C 13 118.3 0.02 . 3 . . . . 34 TYR CE2 . 7201 1 456 . 1 1 34 34 TYR N N 15 120.9 0.2 . 1 . . . . 34 TYR N . 7201 1 457 . 1 1 35 35 LEU H H 1 7.60 0.02 . 1 . . . . 35 LEU H . 7201 1 458 . 1 1 35 35 LEU HA H 1 3.95 0.02 . 1 . . . . 35 LEU HA . 7201 1 459 . 1 1 35 35 LEU HB2 H 1 1.02 0.02 . 1 . . . . 35 LEU HB2 . 7201 1 460 . 1 1 35 35 LEU HB3 H 1 1.02 0.02 . 1 . . . . 35 LEU HB3 . 7201 1 461 . 1 1 35 35 LEU HG H 1 1.61 0.02 . 1 . . . . 35 LEU HG . 7201 1 462 . 1 1 35 35 LEU HD11 H 1 -0.37 0.02 . 1 . . . . 35 LEU HD1 . 7201 1 463 . 1 1 35 35 LEU HD12 H 1 -0.37 0.02 . 1 . . . . 35 LEU HD1 . 7201 1 464 . 1 1 35 35 LEU HD13 H 1 -0.37 0.02 . 1 . . . . 35 LEU HD1 . 7201 1 465 . 1 1 35 35 LEU HD21 H 1 0.22 0.02 . 1 . . . . 35 LEU HD2 . 7201 1 466 . 1 1 35 35 LEU HD22 H 1 0.22 0.02 . 1 . . . . 35 LEU HD2 . 7201 1 467 . 1 1 35 35 LEU HD23 H 1 0.22 0.02 . 1 . . . . 35 LEU HD2 . 7201 1 468 . 1 1 35 35 LEU C C 13 176.1 0.2 . 1 . . . . 35 LEU C . 7201 1 469 . 1 1 35 35 LEU CA C 13 54.3 0.2 . 1 . . . . 35 LEU CA . 7201 1 470 . 1 1 35 35 LEU CB C 13 42.7 0.2 . 1 . . . . 35 LEU CB . 7201 1 471 . 1 1 35 35 LEU CG C 13 25.7 0.2 . 1 . . . . 35 LEU CG . 7201 1 472 . 1 1 35 35 LEU CD1 C 13 24.4 0.02 . 1 . . . . 35 LEU CD1 . 7201 1 473 . 1 1 35 35 LEU CD2 C 13 21.9 0.02 . 1 . . . . 35 LEU CD2 . 7201 1 474 . 1 1 35 35 LEU N N 15 115.7 0.2 . 1 . . . . 35 LEU N . 7201 1 475 . 1 1 36 36 ASN H H 1 7.07 0.02 . 1 . . . . 36 ASN H . 7201 1 476 . 1 1 36 36 ASN HA H 1 3.98 0.02 . 1 . . . . 36 ASN HA . 7201 1 477 . 1 1 36 36 ASN HB2 H 1 2.50 0.02 . 2 . . . . 36 ASN HB2 . 7201 1 478 . 1 1 36 36 ASN HB3 H 1 2.84 0.02 . 2 . . . . 36 ASN HB3 . 7201 1 479 . 1 1 36 36 ASN HD21 H 1 6.60 0.02 . 2 . . . . 36 ASN HD21 . 7201 1 480 . 1 1 36 36 ASN HD22 H 1 7.29 0.02 . 2 . . . . 36 ASN HD22 . 7201 1 481 . 1 1 36 36 ASN C C 13 175.6 0.2 . 1 . . . . 36 ASN C . 7201 1 482 . 1 1 36 36 ASN CA C 13 56.4 0.2 . 1 . . . . 36 ASN CA . 7201 1 483 . 1 1 36 36 ASN CB C 13 39.1 0.2 . 1 . . . . 36 ASN CB . 7201 1 484 . 1 1 36 36 ASN N N 15 119.5 0.2 . 1 . . . . 36 ASN N . 7201 1 485 . 1 1 36 36 ASN ND2 N 15 112 0.2 . 1 . . . . 36 ASN ND2 . 7201 1 486 . 1 1 37 37 GLU H H 1 8.47 0.02 . 1 . . . . 37 GLU H . 7201 1 487 . 1 1 37 37 GLU HA H 1 3.97 0.02 . 1 . . . . 37 GLU HA . 7201 1 488 . 1 1 37 37 GLU HB2 H 1 2.00 0.02 . 2 . . . . 37 GLU HB2 . 7201 1 489 . 1 1 37 37 GLU HB3 H 1 2.20 0.02 . 2 . . . . 37 GLU HB3 . 7201 1 490 . 1 1 37 37 GLU HG2 H 1 2.23 0.02 . 1 . . . . 37 GLU HG2 . 7201 1 491 . 1 1 37 37 GLU HG3 H 1 2.23 0.02 . 1 . . . . 37 GLU HG3 . 7201 1 492 . 1 1 37 37 GLU C C 13 175.0 0.2 . 1 . . . . 37 GLU C . 7201 1 493 . 1 1 37 37 GLU CA C 13 57.1 0.2 . 1 . . . . 37 GLU CA . 7201 1 494 . 1 1 37 37 GLU CB C 13 28.0 0.2 . 1 . . . . 37 GLU CB . 7201 1 495 . 1 1 37 37 GLU CG C 13 36.6 0.2 . 1 . . . . 37 GLU CG . 7201 1 496 . 1 1 37 37 GLU N N 15 117.6 0.2 . 1 . . . . 37 GLU N . 7201 1 497 . 1 1 38 38 ASN H H 1 8.00 0.02 . 1 . . . . 38 ASN H . 7201 1 498 . 1 1 38 38 ASN HA H 1 4.89 0.02 . 1 . . . . 38 ASN HA . 7201 1 499 . 1 1 38 38 ASN HB2 H 1 2.56 0.02 . 2 . . . . 38 ASN HB2 . 7201 1 500 . 1 1 38 38 ASN HB3 H 1 3.05 0.02 . 2 . . . . 38 ASN HB3 . 7201 1 501 . 1 1 38 38 ASN HD21 H 1 6.39 0.02 . 2 . . . . 38 ASN HD21 . 7201 1 502 . 1 1 38 38 ASN HD22 H 1 7.48 0.02 . 2 . . . . 38 ASN HD22 . 7201 1 503 . 1 1 38 38 ASN CA C 13 51.2 0.2 . 1 . . . . 38 ASN CA . 7201 1 504 . 1 1 38 38 ASN CB C 13 39.7 0.2 . 1 . . . . 38 ASN CB . 7201 1 505 . 1 1 38 38 ASN N N 15 121.8 0.2 . 1 . . . . 38 ASN N . 7201 1 506 . 1 1 38 38 ASN ND2 N 15 110.4 0.2 . 1 . . . . 38 ASN ND2 . 7201 1 507 . 1 1 39 39 PRO HA H 1 4.55 0.02 . 1 . . . . 39 PRO HA . 7201 1 508 . 1 1 39 39 PRO HB2 H 1 1.91 0.02 . 2 . . . . 39 PRO HB2 . 7201 1 509 . 1 1 39 39 PRO HB3 H 1 2.23 0.02 . 2 . . . . 39 PRO HB3 . 7201 1 510 . 1 1 39 39 PRO HG2 H 1 1.64 0.02 . 2 . . . . 39 PRO HG2 . 7201 1 511 . 1 1 39 39 PRO HG3 H 1 2.04 0.02 . 2 . . . . 39 PRO HG3 . 7201 1 512 . 1 1 39 39 PRO HD2 H 1 3.77 0.02 . 2 . . . . 39 PRO HD2 . 7201 1 513 . 1 1 39 39 PRO HD3 H 1 4.05 0.02 . 2 . . . . 39 PRO HD3 . 7201 1 514 . 1 1 39 39 PRO C C 13 177.0 0.2 . 1 . . . . 39 PRO C . 7201 1 515 . 1 1 39 39 PRO CA C 13 63.9 0.2 . 1 . . . . 39 PRO CA . 7201 1 516 . 1 1 39 39 PRO CB C 13 32.0 0.2 . 1 . . . . 39 PRO CB . 7201 1 517 . 1 1 39 39 PRO CG C 13 26.8 0.2 . 1 . . . . 39 PRO CG . 7201 1 518 . 1 1 39 39 PRO CD C 13 50.9 0.2 . 1 . . . . 39 PRO CD . 7201 1 519 . 1 1 40 40 TYR H H 1 8.68 0.02 . 1 . . . . 40 TYR H . 7201 1 520 . 1 1 40 40 TYR HA H 1 4.09 0.02 . 1 . . . . 40 TYR HA . 7201 1 521 . 1 1 40 40 TYR HB2 H 1 2.56 0.02 . 2 . . . . 40 TYR HB2 . 7201 1 522 . 1 1 40 40 TYR HB3 H 1 2.68 0.02 . 2 . . . . 40 TYR HB3 . 7201 1 523 . 1 1 40 40 TYR HD1 H 1 7.12 0.02 . 1 . . . . 40 TYR HD1 . 7201 1 524 . 1 1 40 40 TYR HD2 H 1 7.12 0.02 . 1 . . . . 40 TYR HD2 . 7201 1 525 . 1 1 40 40 TYR HE1 H 1 6.86 0.02 . 1 . . . . 40 TYR HE1 . 7201 1 526 . 1 1 40 40 TYR HE2 H 1 6.86 0.02 . 1 . . . . 40 TYR HE2 . 7201 1 527 . 1 1 40 40 TYR C C 13 173.9 0.2 . 1 . . . . 40 TYR C . 7201 1 528 . 1 1 40 40 TYR CA C 13 58.5 0.2 . 1 . . . . 40 TYR CA . 7201 1 529 . 1 1 40 40 TYR CB C 13 36.6 0.2 . 1 . . . . 40 TYR CB . 7201 1 530 . 1 1 40 40 TYR CG C 13 36.6 0.2 . 1 . . . . 40 TYR CG . 7201 1 531 . 1 1 40 40 TYR CD1 C 13 132.7 0.02 . 1 . . . . 40 TYR CD1 . 7201 1 532 . 1 1 40 40 TYR CD2 C 13 132.7 0.02 . 1 . . . . 40 TYR CD2 . 7201 1 533 . 1 1 40 40 TYR CE1 C 13 118.0 0.02 . 1 . . . . 40 TYR CE1 . 7201 1 534 . 1 1 40 40 TYR CE2 C 13 118.0 0.02 . 1 . . . . 40 TYR CE2 . 7201 1 535 . 1 1 40 40 TYR N N 15 118.8 0.2 . 1 . . . . 40 TYR N . 7201 1 536 . 1 1 41 41 PHE H H 1 7.55 0.02 . 1 . . . . 41 PHE H . 7201 1 537 . 1 1 41 41 PHE HA H 1 5.31 0.02 . 1 . . . . 41 PHE HA . 7201 1 538 . 1 1 41 41 PHE HB2 H 1 2.56 0.02 . 1 . . . . 41 PHE HB2 . 7201 1 539 . 1 1 41 41 PHE HB3 H 1 2.56 0.02 . 1 . . . . 41 PHE HB3 . 7201 1 540 . 1 1 41 41 PHE HD1 H 1 5.69 0.02 . 3 . . . . 41 PHE HD1 . 7201 1 541 . 1 1 41 41 PHE HD2 H 1 6.44 0.02 . 3 . . . . 41 PHE HD2 . 7201 1 542 . 1 1 41 41 PHE HE1 H 1 7.04 0.02 . 1 . . . . 41 PHE HE1 . 7201 1 543 . 1 1 41 41 PHE HE2 H 1 7.04 0.02 . 1 . . . . 41 PHE HE2 . 7201 1 544 . 1 1 41 41 PHE C C 13 175.6 0.2 . 1 . . . . 41 PHE C . 7201 1 545 . 1 1 41 41 PHE CA C 13 57.0 0.2 . 1 . . . . 41 PHE CA . 7201 1 546 . 1 1 41 41 PHE CB C 13 44.6 0.2 . 1 . . . . 41 PHE CB . 7201 1 547 . 1 1 41 41 PHE CD1 C 13 130.6 0.02 . 3 . . . . 41 PHE CD1 . 7201 1 548 . 1 1 41 41 PHE CD2 C 13 131.0 0.02 . 3 . . . . 41 PHE CD2 . 7201 1 549 . 1 1 41 41 PHE CE1 C 13 130.8 0.02 . 1 . . . . 41 PHE CE1 . 7201 1 550 . 1 1 41 41 PHE CE2 C 13 130.8 0.02 . 1 . . . . 41 PHE CE2 . 7201 1 551 . 1 1 41 41 PHE N N 15 115.2 0.2 . 1 . . . . 41 PHE N . 7201 1 552 . 1 1 42 42 ILE H H 1 8.79 0.02 . 1 . . . . 42 ILE H . 7201 1 553 . 1 1 42 42 ILE HA H 1 4.47 0.02 . 1 . . . . 42 ILE HA . 7201 1 554 . 1 1 42 42 ILE HB H 1 1.67 0.02 . 1 . . . . 42 ILE HB . 7201 1 555 . 1 1 42 42 ILE HG12 H 1 1.19 0.02 . 1 . . . . 42 ILE HG12 . 7201 1 556 . 1 1 42 42 ILE HG13 H 1 1.19 0.02 . 1 . . . . 42 ILE HG13 . 7201 1 557 . 1 1 42 42 ILE HG21 H 1 0.91 0.02 . 1 . . . . 42 ILE HG2 . 7201 1 558 . 1 1 42 42 ILE HG22 H 1 0.91 0.02 . 1 . . . . 42 ILE HG2 . 7201 1 559 . 1 1 42 42 ILE HG23 H 1 0.91 0.02 . 1 . . . . 42 ILE HG2 . 7201 1 560 . 1 1 42 42 ILE HD11 H 1 0.91 0.02 . 1 . . . . 42 ILE HD1 . 7201 1 561 . 1 1 42 42 ILE HD12 H 1 0.91 0.02 . 1 . . . . 42 ILE HD1 . 7201 1 562 . 1 1 42 42 ILE HD13 H 1 0.91 0.02 . 1 . . . . 42 ILE HD1 . 7201 1 563 . 1 1 42 42 ILE C C 13 175.6 0.2 . 1 . . . . 42 ILE C . 7201 1 564 . 1 1 42 42 ILE CA C 13 60.6 0.2 . 1 . . . . 42 ILE CA . 7201 1 565 . 1 1 42 42 ILE CB C 13 40.4 0.2 . 1 . . . . 42 ILE CB . 7201 1 566 . 1 1 42 42 ILE CG1 C 13 27.6 0.2 . 1 . . . . 42 ILE CG1 . 7201 1 567 . 1 1 42 42 ILE CG2 C 13 17.0 0.2 . 1 . . . . 42 ILE CG2 . 7201 1 568 . 1 1 42 42 ILE CD1 C 13 12.9 0.2 . 1 . . . . 42 ILE CD1 . 7201 1 569 . 1 1 42 42 ILE N N 15 117.9 0.2 . 1 . . . . 42 ILE N . 7201 1 570 . 1 1 43 43 LEU H H 1 8.87 0.02 . 1 . . . . 43 LEU H . 7201 1 571 . 1 1 43 43 LEU HA H 1 5.49 0.02 . 1 . . . . 43 LEU HA . 7201 1 572 . 1 1 43 43 LEU HB2 H 1 1.68 0.02 . 1 . . . . 43 LEU HB2 . 7201 1 573 . 1 1 43 43 LEU HB3 H 1 1.68 0.02 . 1 . . . . 43 LEU HB3 . 7201 1 574 . 1 1 43 43 LEU HG H 1 1.57 0.02 . 1 . . . . 43 LEU HG . 7201 1 575 . 1 1 43 43 LEU HD11 H 1 0.46 0.02 . 1 . . . . 43 LEU HD1 . 7201 1 576 . 1 1 43 43 LEU HD12 H 1 0.46 0.02 . 1 . . . . 43 LEU HD1 . 7201 1 577 . 1 1 43 43 LEU HD13 H 1 0.46 0.02 . 1 . . . . 43 LEU HD1 . 7201 1 578 . 1 1 43 43 LEU HD21 H 1 0.67 0.02 . 1 . . . . 43 LEU HD2 . 7201 1 579 . 1 1 43 43 LEU HD22 H 1 0.67 0.02 . 1 . . . . 43 LEU HD2 . 7201 1 580 . 1 1 43 43 LEU HD23 H 1 0.67 0.02 . 1 . . . . 43 LEU HD2 . 7201 1 581 . 1 1 43 43 LEU CA C 13 53.5 0.2 . 1 . . . . 43 LEU CA . 7201 1 582 . 1 1 43 43 LEU CB C 13 43.5 0.2 . 1 . . . . 43 LEU CB . 7201 1 583 . 1 1 43 43 LEU CG C 13 27.1 0.2 . 1 . . . . 43 LEU CG . 7201 1 584 . 1 1 43 43 LEU CD1 C 13 25.3 0.02 . 1 . . . . 43 LEU CD1 . 7201 1 585 . 1 1 43 43 LEU CD2 C 13 24.3 0.02 . 1 . . . . 43 LEU CD2 . 7201 1 586 . 1 1 43 43 LEU N N 15 131.0 0.2 . 1 . . . . 43 LEU N . 7201 1 587 . 1 1 44 44 THR H H 1 8.91 0.02 . 1 . . . . 44 THR H . 7201 1 588 . 1 1 44 44 THR HA H 1 4.85 0.02 . 1 . . . . 44 THR HA . 7201 1 589 . 1 1 44 44 THR HB H 1 4.10 0.02 . 2 . . . . 44 THR HB . 7201 1 590 . 1 1 44 44 THR HG21 H 1 1.14 0.02 . 1 . . . . 44 THR HG2 . 7201 1 591 . 1 1 44 44 THR HG22 H 1 1.14 0.02 . 1 . . . . 44 THR HG2 . 7201 1 592 . 1 1 44 44 THR HG23 H 1 1.14 0.02 . 1 . . . . 44 THR HG2 . 7201 1 593 . 1 1 44 44 THR C C 13 172.2 0.2 . 1 . . . . 44 THR C . 7201 1 594 . 1 1 44 44 THR CA C 13 60.9 0.2 . 1 . . . . 44 THR CA . 7201 1 595 . 1 1 44 44 THR CB C 13 72.1 0.2 . 1 . . . . 44 THR CB . 7201 1 596 . 1 1 44 44 THR CG2 C 13 21.7 0.2 . 1 . . . . 44 THR CG2 . 7201 1 597 . 1 1 44 44 THR N N 15 114.4 0.2 . 1 . . . . 44 THR N . 7201 1 598 . 1 1 45 45 GLN H H 1 8.42 0.02 . 1 . . . . 45 GLN H . 7201 1 599 . 1 1 45 45 GLN HA H 1 4.94 0.02 . 1 . . . . 45 GLN HA . 7201 1 600 . 1 1 45 45 GLN HB2 H 1 1.75 0.02 . 2 . . . . 45 GLN HB2 . 7201 1 601 . 1 1 45 45 GLN HB3 H 1 1.95 0.02 . 2 . . . . 45 GLN HB3 . 7201 1 602 . 1 1 45 45 GLN HG2 H 1 2.13 0.02 . 1 . . . . 45 GLN HG2 . 7201 1 603 . 1 1 45 45 GLN HG3 H 1 2.13 0.02 . 1 . . . . 45 GLN HG3 . 7201 1 604 . 1 1 45 45 GLN HE21 H 1 6.87 0.02 . 2 . . . . 45 GLN HE21 . 7201 1 605 . 1 1 45 45 GLN HE22 H 1 7.07 0.02 . 2 . . . . 45 GLN HE22 . 7201 1 606 . 1 1 45 45 GLN C C 13 174.7 0.2 . 1 . . . . 45 GLN C . 7201 1 607 . 1 1 45 45 GLN CA C 13 54.2 0.2 . 1 . . . . 45 GLN CA . 7201 1 608 . 1 1 45 45 GLN CB C 13 31.3 0.2 . 1 . . . . 45 GLN CB . 7201 1 609 . 1 1 45 45 GLN CG C 13 33.6 0.2 . 1 . . . . 45 GLN CG . 7201 1 610 . 1 1 45 45 GLN N N 15 119.9 0.2 . 1 . . . . 45 GLN N . 7201 1 611 . 1 1 45 45 GLN NE2 N 15 110.3 0.2 . 1 . . . . 45 GLN NE2 . 7201 1 612 . 1 1 46 46 GLU H H 1 8.51 0.02 . 1 . . . . 46 GLU H . 7201 1 613 . 1 1 46 46 GLU HA H 1 4.55 0.02 . 1 . . . . 46 GLU HA . 7201 1 614 . 1 1 46 46 GLU HB2 H 1 1.71 0.02 . 2 . . . . 46 GLU HB2 . 7201 1 615 . 1 1 46 46 GLU HB3 H 1 1.97 0.02 . 2 . . . . 46 GLU HB3 . 7201 1 616 . 1 1 46 46 GLU HG2 H 1 2.10 0.02 . 1 . . . . 46 GLU HG2 . 7201 1 617 . 1 1 46 46 GLU HG3 H 1 2.10 0.02 . 1 . . . . 46 GLU HG3 . 7201 1 618 . 1 1 46 46 GLU C C 13 175.3 0.2 . 1 . . . . 46 GLU C . 7201 1 619 . 1 1 46 46 GLU CA C 13 54.8 0.2 . 1 . . . . 46 GLU CA . 7201 1 620 . 1 1 46 46 GLU CB C 13 32.2 0.2 . 1 . . . . 46 GLU CB . 7201 1 621 . 1 1 46 46 GLU CG C 13 35.6 0.2 . 1 . . . . 46 GLU CG . 7201 1 622 . 1 1 46 46 GLU N N 15 122.7 0.2 . 1 . . . . 46 GLU N . 7201 1 623 . 1 1 47 47 LEU H H 1 8.54 0.02 . 1 . . . . 47 LEU H . 7201 1 624 . 1 1 47 47 LEU HA H 1 4.29 0.02 . 1 . . . . 47 LEU HA . 7201 1 625 . 1 1 47 47 LEU HB2 H 1 1.60 0.02 . 1 . . . . 47 LEU HB2 . 7201 1 626 . 1 1 47 47 LEU HB3 H 1 1.60 0.02 . 1 . . . . 47 LEU HB3 . 7201 1 627 . 1 1 47 47 LEU HD11 H 1 0.89 0.02 . 1 . . . . 47 LEU HD1 . 7201 1 628 . 1 1 47 47 LEU HD12 H 1 0.89 0.02 . 1 . . . . 47 LEU HD1 . 7201 1 629 . 1 1 47 47 LEU HD13 H 1 0.89 0.02 . 1 . . . . 47 LEU HD1 . 7201 1 630 . 1 1 47 47 LEU HD21 H 1 0.83 0.02 . 1 . . . . 47 LEU HD2 . 7201 1 631 . 1 1 47 47 LEU HD22 H 1 0.83 0.02 . 1 . . . . 47 LEU HD2 . 7201 1 632 . 1 1 47 47 LEU HD23 H 1 0.83 0.02 . 1 . . . . 47 LEU HD2 . 7201 1 633 . 1 1 47 47 LEU C C 13 176.9 0.2 . 1 . . . . 47 LEU C . 7201 1 634 . 1 1 47 47 LEU CA C 13 55.6 0.2 . 1 . . . . 47 LEU CA . 7201 1 635 . 1 1 47 47 LEU CB C 13 42.3 0.2 . 1 . . . . 47 LEU CB . 7201 1 636 . 1 1 47 47 LEU CG C 13 27.2 0.2 . 1 . . . . 47 LEU CG . 7201 1 637 . 1 1 47 47 LEU CD1 C 13 25.1 0.02 . 1 . . . . 47 LEU CD1 . 7201 1 638 . 1 1 47 47 LEU CD2 C 13 23.6 0.02 . 1 . . . . 47 LEU CD2 . 7201 1 639 . 1 1 47 47 LEU N N 15 123.6 0.2 . 1 . . . . 47 LEU N . 7201 1 640 . 1 1 48 48 ASN H H 1 8.39 0.02 . 1 . . . . 48 ASN H . 7201 1 641 . 1 1 48 48 ASN HA H 1 4.63 0.02 . 1 . . . . 48 ASN HA . 7201 1 642 . 1 1 48 48 ASN HB2 H 1 2.70 0.02 . 2 . . . . 48 ASN HB2 . 7201 1 643 . 1 1 48 48 ASN HB3 H 1 2.80 0.02 . 2 . . . . 48 ASN HB3 . 7201 1 644 . 1 1 48 48 ASN HD21 H 1 6.90 0.02 . 2 . . . . 48 ASN HD21 . 7201 1 645 . 1 1 48 48 ASN HD22 H 1 7.58 0.02 . 2 . . . . 48 ASN HD22 . 7201 1 646 . 1 1 48 48 ASN C C 13 174.8 0.2 . 1 . . . . 48 ASN C . 7201 1 647 . 1 1 48 48 ASN CA C 13 53.2 0.2 . 1 . . . . 48 ASN CA . 7201 1 648 . 1 1 48 48 ASN CB C 13 38.9 0.2 . 1 . . . . 48 ASN CB . 7201 1 649 . 1 1 48 48 ASN N N 15 118.3 0.2 . 1 . . . . 48 ASN N . 7201 1 650 . 1 1 48 48 ASN ND2 N 15 113 0.2 . 1 . . . . 48 ASN ND2 . 7201 1 651 . 1 1 49 49 ASN H H 1 8.45 0.02 . 1 . . . . 49 ASN H . 7201 1 652 . 1 1 49 49 ASN HA H 1 4.68 0.02 . 1 . . . . 49 ASN HA . 7201 1 653 . 1 1 49 49 ASN HB2 H 1 2.70 0.02 . 2 . . . . 49 ASN HB2 . 7201 1 654 . 1 1 49 49 ASN HB3 H 1 2.80 0.02 . 2 . . . . 49 ASN HB3 . 7201 1 655 . 1 1 49 49 ASN HD21 H 1 6.85 0.02 . 2 . . . . 49 ASN HD21 . 7201 1 656 . 1 1 49 49 ASN HD22 H 1 7.57 0.02 . 2 . . . . 49 ASN HD22 . 7201 1 657 . 1 1 49 49 ASN C C 13 175.1 0.2 . 1 . . . . 49 ASN C . 7201 1 658 . 1 1 49 49 ASN CA C 13 53.3 0.2 . 1 . . . . 49 ASN CA . 7201 1 659 . 1 1 49 49 ASN CB C 13 38.8 0.2 . 1 . . . . 49 ASN CB . 7201 1 660 . 1 1 49 49 ASN N N 15 119.4 0.2 . 1 . . . . 49 ASN N . 7201 1 661 . 1 1 49 49 ASN ND2 N 15 112.7 0.2 . 1 . . . . 49 ASN ND2 . 7201 1 662 . 1 1 50 50 GLN H H 1 8.33 0.02 . 1 . . . . 50 GLN H . 7201 1 663 . 1 1 50 50 GLN HA H 1 4.28 0.02 . 1 . . . . 50 GLN HA . 7201 1 664 . 1 1 50 50 GLN HB2 H 1 1.98 0.02 . 2 . . . . 50 GLN HB2 . 7201 1 665 . 1 1 50 50 GLN HB3 H 1 2.11 0.02 . 2 . . . . 50 GLN HB3 . 7201 1 666 . 1 1 50 50 GLN HG2 H 1 2.35 0.02 . 1 . . . . 50 GLN HG2 . 7201 1 667 . 1 1 50 50 GLN HG3 H 1 2.35 0.02 . 1 . . . . 50 GLN HG3 . 7201 1 668 . 1 1 50 50 GLN HE21 H 1 6.82 0.02 . 2 . . . . 50 GLN HE21 . 7201 1 669 . 1 1 50 50 GLN HE22 H 1 7.22 0.02 . 2 . . . . 50 GLN HE22 . 7201 1 670 . 1 1 50 50 GLN C C 13 175.9 0.2 . 1 . . . . 50 GLN C . 7201 1 671 . 1 1 50 50 GLN CA C 13 56.1 0.2 . 1 . . . . 50 GLN CA . 7201 1 672 . 1 1 50 50 GLN CB C 13 29.3 0.2 . 1 . . . . 50 GLN CB . 7201 1 673 . 1 1 50 50 GLN CG C 13 33.7 0.2 . 1 . . . . 50 GLN CG . 7201 1 674 . 1 1 50 50 GLN N N 15 120.6 0.2 . 1 . . . . 50 GLN N . 7201 1 675 . 1 1 50 50 GLN NE2 N 15 111.9 0.2 . 1 . . . . 50 GLN NE2 . 7201 1 676 . 1 1 51 51 LYS H H 1 8.28 0.02 . 1 . . . . 51 LYS H . 7201 1 677 . 1 1 51 51 LYS HA H 1 4.28 0.02 . 1 . . . . 51 LYS HA . 7201 1 678 . 1 1 51 51 LYS HB2 H 1 1.74 0.02 . 2 . . . . 51 LYS HB2 . 7201 1 679 . 1 1 51 51 LYS HB3 H 1 1.81 0.02 . 2 . . . . 51 LYS HB3 . 7201 1 680 . 1 1 51 51 LYS HG2 H 1 1.41 0.02 . 1 . . . . 51 LYS HG2 . 7201 1 681 . 1 1 51 51 LYS HG3 H 1 1.41 0.02 . 1 . . . . 51 LYS HG3 . 7201 1 682 . 1 1 51 51 LYS HD2 H 1 1.66 0.02 . 1 . . . . 51 LYS HD2 . 7201 1 683 . 1 1 51 51 LYS HD3 H 1 1.66 0.02 . 1 . . . . 51 LYS HD3 . 7201 1 684 . 1 1 51 51 LYS HE2 H 1 3.00 0.02 . 1 . . . . 51 LYS HE2 . 7201 1 685 . 1 1 51 51 LYS HE3 H 1 3.00 0.02 . 1 . . . . 51 LYS HE3 . 7201 1 686 . 1 1 51 51 LYS CA C 13 56.6 0.2 . 1 . . . . 51 LYS CA . 7201 1 687 . 1 1 51 51 LYS CB C 13 32.9 0.2 . 1 . . . . 51 LYS CB . 7201 1 688 . 1 1 51 51 LYS CG C 13 24.4 0.2 . 1 . . . . 51 LYS CG . 7201 1 689 . 1 1 51 51 LYS CD C 13 28.9 0.2 . 1 . . . . 51 LYS CD . 7201 1 690 . 1 1 51 51 LYS CE C 13 42.1 0.2 . 1 . . . . 51 LYS CE . 7201 1 691 . 1 1 51 51 LYS N N 15 121.9 0.2 . 1 . . . . 51 LYS N . 7201 1 692 . 1 1 52 52 ASP H H 1 8.26 0.02 . 1 . . . . 52 ASP H . 7201 1 693 . 1 1 52 52 ASP HA H 1 4.61 0.02 . 1 . . . . 52 ASP HA . 7201 1 694 . 1 1 52 52 ASP HB2 H 1 2.68 0.02 . 2 . . . . 52 ASP HB2 . 7201 1 695 . 1 1 52 52 ASP HB3 H 1 2.56 0.02 . 2 . . . . 52 ASP HB3 . 7201 1 696 . 1 1 52 52 ASP C C 13 175.5 0.2 . 1 . . . . 52 ASP C . 7201 1 697 . 1 1 52 52 ASP CA C 13 54.2 0.2 . 1 . . . . 52 ASP CA . 7201 1 698 . 1 1 52 52 ASP CB C 13 41.2 0.2 . 1 . . . . 52 ASP CB . 7201 1 699 . 1 1 52 52 ASP N N 15 120.9 0.2 . 1 . . . . 52 ASP N . 7201 1 700 . 1 1 53 53 ASP H H 1 8.08 0.02 . 1 . . . . 53 ASP H . 7201 1 701 . 1 1 53 53 ASP HA H 1 4.84 0.02 . 1 . . . . 53 ASP HA . 7201 1 702 . 1 1 53 53 ASP HB2 H 1 2.47 0.02 . 2 . . . . 53 ASP HB2 . 7201 1 703 . 1 1 53 53 ASP HB3 H 1 2.68 0.02 . 2 . . . . 53 ASP HB3 . 7201 1 704 . 1 1 53 53 ASP CA C 13 52.6 0.2 . 1 . . . . 53 ASP CA . 7201 1 705 . 1 1 53 53 ASP CB C 13 40.9 0.2 . 1 . . . . 53 ASP CB . 7201 1 706 . 1 1 53 53 ASP CG C 13 27.5 0.2 . 1 . . . . 53 ASP CG . 7201 1 707 . 1 1 53 53 ASP N N 15 121.8 0.2 . 1 . . . . 53 ASP N . 7201 1 708 . 1 1 54 54 PRO HA H 1 4.37 0.02 . 1 . . . . 54 PRO HA . 7201 1 709 . 1 1 54 54 PRO HB2 H 1 1.83 0.02 . 2 . . . . 54 PRO HB2 . 7201 1 710 . 1 1 54 54 PRO HB3 H 1 2.21 0.02 . 2 . . . . 54 PRO HB3 . 7201 1 711 . 1 1 54 54 PRO HG2 H 1 1.98 0.02 . 1 . . . . 54 PRO HG2 . 7201 1 712 . 1 1 54 54 PRO HG3 H 1 1.98 0.02 . 1 . . . . 54 PRO HG3 . 7201 1 713 . 1 1 54 54 PRO HD2 H 1 3.68 0.02 . 2 . . . . 54 PRO HD2 . 7201 1 714 . 1 1 54 54 PRO HD3 H 1 3.77 0.02 . 2 . . . . 54 PRO HD3 . 7201 1 715 . 1 1 54 54 PRO C C 13 176.5 0.2 . 1 . . . . 54 PRO C . 7201 1 716 . 1 1 54 54 PRO CA C 13 63.0 0.2 . 1 . . . . 54 PRO CA . 7201 1 717 . 1 1 54 54 PRO CB C 13 32.1 0.2 . 1 . . . . 54 PRO CB . 7201 1 718 . 1 1 54 54 PRO CG C 13 26.8 0.2 . 1 . . . . 54 PRO CG . 7201 1 719 . 1 1 54 54 PRO CD C 13 50.7 0.2 . 1 . . . . 54 PRO CD . 7201 1 720 . 1 1 55 55 ILE H H 1 8.14 0.02 . 1 . . . . 55 ILE H . 7201 1 721 . 1 1 55 55 ILE HA H 1 3.96 0.02 . 1 . . . . 55 ILE HA . 7201 1 722 . 1 1 55 55 ILE HB H 1 1.74 0.02 . 1 . . . . 55 ILE HB . 7201 1 723 . 1 1 55 55 ILE HG12 H 1 1.11 0.02 . 2 . . . . 55 ILE HG12 . 7201 1 724 . 1 1 55 55 ILE HG13 H 1 1.45 0.02 . 2 . . . . 55 ILE HG13 . 7201 1 725 . 1 1 55 55 ILE HG21 H 1 0.84 0.02 . 1 . . . . 55 ILE HG2 . 7201 1 726 . 1 1 55 55 ILE HG22 H 1 0.84 0.02 . 1 . . . . 55 ILE HG2 . 7201 1 727 . 1 1 55 55 ILE HG23 H 1 0.84 0.02 . 1 . . . . 55 ILE HG2 . 7201 1 728 . 1 1 55 55 ILE HD11 H 1 0.84 0.02 . 1 . . . . 55 ILE HD1 . 7201 1 729 . 1 1 55 55 ILE HD12 H 1 0.84 0.02 . 1 . . . . 55 ILE HD1 . 7201 1 730 . 1 1 55 55 ILE HD13 H 1 0.84 0.02 . 1 . . . . 55 ILE HD1 . 7201 1 731 . 1 1 55 55 ILE C C 13 175.1 0.2 . 1 . . . . 55 ILE C . 7201 1 732 . 1 1 55 55 ILE CA C 13 61.0 0.2 . 1 . . . . 55 ILE CA . 7201 1 733 . 1 1 55 55 ILE CB C 13 38.4 0.2 . 1 . . . . 55 ILE CB . 7201 1 734 . 1 1 55 55 ILE CG1 C 13 26.9 0.2 . 1 . . . . 55 ILE CG1 . 7201 1 735 . 1 1 55 55 ILE CG2 C 13 17.2 0.2 . 1 . . . . 55 ILE CG2 . 7201 1 736 . 1 1 55 55 ILE CD1 C 13 14.4 0.2 . 1 . . . . 55 ILE CD1 . 7201 1 737 . 1 1 55 55 ILE N N 15 119.9 0.2 . 1 . . . . 55 ILE N . 7201 1 738 . 1 1 56 56 ASN H H 1 7.90 0.02 . 1 . . . . 56 ASN H . 7201 1 739 . 1 1 56 56 ASN HA H 1 4.69 0.02 . 1 . . . . 56 ASN HA . 7201 1 740 . 1 1 56 56 ASN HB2 H 1 2.52 0.02 . 2 . . . . 56 ASN HB2 . 7201 1 741 . 1 1 56 56 ASN HB3 H 1 2.62 0.02 . 2 . . . . 56 ASN HB3 . 7201 1 742 . 1 1 56 56 ASN HD21 H 1 6.74 0.02 . 2 . . . . 56 ASN HD21 . 7201 1 743 . 1 1 56 56 ASN HD22 H 1 7.47 0.02 . 2 . . . . 56 ASN HD22 . 7201 1 744 . 1 1 56 56 ASN C C 13 173.9 0.2 . 1 . . . . 56 ASN C . 7201 1 745 . 1 1 56 56 ASN CA C 13 52.7 0.2 . 1 . . . . 56 ASN CA . 7201 1 746 . 1 1 56 56 ASN CB C 13 39.4 0.2 . 1 . . . . 56 ASN CB . 7201 1 747 . 1 1 56 56 ASN N N 15 122.0 0.2 . 1 . . . . 56 ASN N . 7201 1 748 . 1 1 56 56 ASN ND2 N 15 112.1 0.2 . 1 . . . . 56 ASN ND2 . 7201 1 749 . 1 1 57 57 TYR H H 1 7.06 0.02 . 1 . . . . 57 TYR H . 7201 1 750 . 1 1 57 57 TYR HA H 1 4.85 0.02 . 1 . . . . 57 TYR HA . 7201 1 751 . 1 1 57 57 TYR HB2 H 1 2.38 0.02 . 2 . . . . 57 TYR HB2 . 7201 1 752 . 1 1 57 57 TYR HB3 H 1 3.09 0.02 . 2 . . . . 57 TYR HB3 . 7201 1 753 . 1 1 57 57 TYR HD1 H 1 6.97 0.02 . 1 . . . . 57 TYR HD1 . 7201 1 754 . 1 1 57 57 TYR HD2 H 1 6.97 0.02 . 1 . . . . 57 TYR HD2 . 7201 1 755 . 1 1 57 57 TYR HE1 H 1 6.84 0.02 . 1 . . . . 57 TYR HE1 . 7201 1 756 . 1 1 57 57 TYR HE2 H 1 6.84 0.02 . 1 . . . . 57 TYR HE2 . 7201 1 757 . 1 1 57 57 TYR C C 13 175.3 0.2 . 1 . . . . 57 TYR C . 7201 1 758 . 1 1 57 57 TYR CA C 13 57.6 0.2 . 1 . . . . 57 TYR CA . 7201 1 759 . 1 1 57 57 TYR CB C 13 41.7 0.2 . 1 . . . . 57 TYR CB . 7201 1 760 . 1 1 57 57 TYR CD1 C 13 132.8 0.02 . 1 . . . . 57 TYR CD1 . 7201 1 761 . 1 1 57 57 TYR CD2 C 13 132.8 0.02 . 1 . . . . 57 TYR CD2 . 7201 1 762 . 1 1 57 57 TYR CE1 C 13 119.3 0.02 . 1 . . . . 57 TYR CE1 . 7201 1 763 . 1 1 57 57 TYR CE2 C 13 119.3 0.02 . 1 . . . . 57 TYR CE2 . 7201 1 764 . 1 1 57 57 TYR N N 15 119.3 0.2 . 1 . . . . 57 TYR N . 7201 1 765 . 1 1 58 58 THR H H 1 8.53 0.02 . 1 . . . . 58 THR H . 7201 1 766 . 1 1 58 58 THR HA H 1 4.57 0.02 . 1 . . . . 58 THR HA . 7201 1 767 . 1 1 58 58 THR HG21 H 1 1.30 0.02 . 1 . . . . 58 THR HG2 . 7201 1 768 . 1 1 58 58 THR HG22 H 1 1.30 0.02 . 1 . . . . 58 THR HG2 . 7201 1 769 . 1 1 58 58 THR HG23 H 1 1.30 0.02 . 1 . . . . 58 THR HG2 . 7201 1 770 . 1 1 58 58 THR C C 13 175.5 0.2 . 1 . . . . 58 THR C . 7201 1 771 . 1 1 58 58 THR CA C 13 59.8 0.2 . 1 . . . . 58 THR CA . 7201 1 772 . 1 1 58 58 THR CB C 13 71.6 0.2 . 1 . . . . 58 THR CB . 7201 1 773 . 1 1 58 58 THR CG2 C 13 21.8 0.2 . 1 . . . . 58 THR CG2 . 7201 1 774 . 1 1 58 58 THR N N 15 110.3 0.2 . 1 . . . . 58 THR N . 7201 1 775 . 1 1 59 59 GLU H H 1 9.19 0.02 . 1 . . . . 59 GLU H . 7201 1 776 . 1 1 59 59 GLU HA H 1 3.76 0.02 . 1 . . . . 59 GLU HA . 7201 1 777 . 1 1 59 59 GLU HB2 H 1 1.98 0.02 . 2 . . . . 59 GLU HB2 . 7201 1 778 . 1 1 59 59 GLU HB3 H 1 2.11 0.02 . 2 . . . . 59 GLU HB3 . 7201 1 779 . 1 1 59 59 GLU HG2 H 1 2.24 0.02 . 1 . . . . 59 GLU HG2 . 7201 1 780 . 1 1 59 59 GLU HG3 H 1 2.24 0.02 . 1 . . . . 59 GLU HG3 . 7201 1 781 . 1 1 59 59 GLU C C 13 177.9 0.2 . 1 . . . . 59 GLU C . 7201 1 782 . 1 1 59 59 GLU CA C 13 60.8 0.2 . 1 . . . . 59 GLU CA . 7201 1 783 . 1 1 59 59 GLU CB C 13 29.4 0.2 . 1 . . . . 59 GLU CB . 7201 1 784 . 1 1 59 59 GLU CG C 13 36.1 0.2 . 1 . . . . 59 GLU CG . 7201 1 785 . 1 1 59 59 GLU N N 15 122.1 0.2 . 1 . . . . 59 GLU N . 7201 1 786 . 1 1 60 60 SER H H 1 8.48 0.02 . 1 . . . . 60 SER H . 7201 1 787 . 1 1 60 60 SER HA H 1 4.06 0.02 . 1 . . . . 60 SER HA . 7201 1 788 . 1 1 60 60 SER HB2 H 1 3.87 0.02 . 1 . . . . 60 SER HB2 . 7201 1 789 . 1 1 60 60 SER HB3 H 1 3.87 0.02 . 1 . . . . 60 SER HB3 . 7201 1 790 . 1 1 60 60 SER HG H 1 4.30 0.02 . 1 . . . . 60 SER HG . 7201 1 791 . 1 1 60 60 SER C C 13 177.5 0.2 . 1 . . . . 60 SER C . 7201 1 792 . 1 1 60 60 SER CA C 13 61.8 0.2 . 1 . . . . 60 SER CA . 7201 1 793 . 1 1 60 60 SER CB C 13 62.3 0.2 . 1 . . . . 60 SER CB . 7201 1 794 . 1 1 60 60 SER N N 15 112.3 0.2 . 1 . . . . 60 SER N . 7201 1 795 . 1 1 61 61 GLU H H 1 7.70 0.02 . 1 . . . . 61 GLU H . 7201 1 796 . 1 1 61 61 GLU HA H 1 4.04 0.02 . 1 . . . . 61 GLU HA . 7201 1 797 . 1 1 61 61 GLU HB2 H 1 2.06 0.02 . 1 . . . . 61 GLU HB2 . 7201 1 798 . 1 1 61 61 GLU HB3 H 1 2.06 0.02 . 1 . . . . 61 GLU HB3 . 7201 1 799 . 1 1 61 61 GLU HG2 H 1 2.24 0.02 . 2 . . . . 61 GLU HG2 . 7201 1 800 . 1 1 61 61 GLU HG3 H 1 2.45 0.02 . 2 . . . . 61 GLU HG3 . 7201 1 801 . 1 1 61 61 GLU C C 13 180.0 0.2 . 1 . . . . 61 GLU C . 7201 1 802 . 1 1 61 61 GLU CA C 13 59.0 0.2 . 1 . . . . 61 GLU CA . 7201 1 803 . 1 1 61 61 GLU CB C 13 30.0 0.2 . 1 . . . . 61 GLU CB . 7201 1 804 . 1 1 61 61 GLU CG C 13 37.0 0.2 . 1 . . . . 61 GLU CG . 7201 1 805 . 1 1 61 61 GLU N N 15 122.1 0.2 . 1 . . . . 61 GLU N . 7201 1 806 . 1 1 62 62 LEU H H 1 8.26 0.02 . 1 . . . . 62 LEU H . 7201 1 807 . 1 1 62 62 LEU HA H 1 4.27 0.02 . 1 . . . . 62 LEU HA . 7201 1 808 . 1 1 62 62 LEU HB2 H 1 1.23 0.02 . 2 . . . . 62 LEU HB2 . 7201 1 809 . 1 1 62 62 LEU HB3 H 1 2.02 0.02 . 2 . . . . 62 LEU HB3 . 7201 1 810 . 1 1 62 62 LEU HG H 1 1.80 0.02 . 1 . . . . 62 LEU HG . 7201 1 811 . 1 1 62 62 LEU HD11 H 1 0.76 0.02 . 1 . . . . 62 LEU HD1 . 7201 1 812 . 1 1 62 62 LEU HD12 H 1 0.76 0.02 . 1 . . . . 62 LEU HD1 . 7201 1 813 . 1 1 62 62 LEU HD13 H 1 0.76 0.02 . 1 . . . . 62 LEU HD1 . 7201 1 814 . 1 1 62 62 LEU HD21 H 1 0.67 0.02 . 1 . . . . 62 LEU HD2 . 7201 1 815 . 1 1 62 62 LEU HD22 H 1 0.67 0.02 . 1 . . . . 62 LEU HD2 . 7201 1 816 . 1 1 62 62 LEU HD23 H 1 0.67 0.02 . 1 . . . . 62 LEU HD2 . 7201 1 817 . 1 1 62 62 LEU C C 13 167.7 0.2 . 1 . . . . 62 LEU C . 7201 1 818 . 1 1 62 62 LEU CA C 13 57.8 0.2 . 1 . . . . 62 LEU CA . 7201 1 819 . 1 1 62 62 LEU CB C 13 43.0 0.2 . 1 . . . . 62 LEU CB . 7201 1 820 . 1 1 62 62 LEU CG C 13 27.7 0.2 . 1 . . . . 62 LEU CG . 7201 1 821 . 1 1 62 62 LEU CD1 C 13 27.1 0.02 . 1 . . . . 62 LEU CD1 . 7201 1 822 . 1 1 62 62 LEU CD2 C 13 23.7 0.02 . 1 . . . . 62 LEU CD2 . 7201 1 823 . 1 1 62 62 LEU N N 15 119.3 0.2 . 1 . . . . 62 LEU N . 7201 1 824 . 1 1 63 63 LYS H H 1 8.56 0.02 . 1 . . . . 63 LYS H . 7201 1 825 . 1 1 63 63 LYS HA H 1 4.15 0.02 . 1 . . . . 63 LYS HA . 7201 1 826 . 1 1 63 63 LYS HB2 H 1 1.90 0.02 . 1 . . . . 63 LYS HB2 . 7201 1 827 . 1 1 63 63 LYS HB3 H 1 1.90 0.02 . 1 . . . . 63 LYS HB3 . 7201 1 828 . 1 1 63 63 LYS HG2 H 1 1.47 0.02 . 2 . . . . 63 LYS HG2 . 7201 1 829 . 1 1 63 63 LYS HG3 H 1 1.67 0.02 . 2 . . . . 63 LYS HG3 . 7201 1 830 . 1 1 63 63 LYS HD2 H 1 1.68 0.02 . 1 . . . . 63 LYS HD2 . 7201 1 831 . 1 1 63 63 LYS HD3 H 1 1.68 0.02 . 1 . . . . 63 LYS HD3 . 7201 1 832 . 1 1 63 63 LYS HE2 H 1 2.94 0.02 . 1 . . . . 63 LYS HE2 . 7201 1 833 . 1 1 63 63 LYS HE3 H 1 2.94 0.02 . 1 . . . . 63 LYS HE3 . 7201 1 834 . 1 1 63 63 LYS C C 13 177.6 0.2 . 1 . . . . 63 LYS C . 7201 1 835 . 1 1 63 63 LYS CA C 13 59.2 0.2 . 1 . . . . 63 LYS CA . 7201 1 836 . 1 1 63 63 LYS CB C 13 32.4 0.2 . 1 . . . . 63 LYS CB . 7201 1 837 . 1 1 63 63 LYS CG C 13 26.3 0.2 . 1 . . . . 63 LYS CG . 7201 1 838 . 1 1 63 63 LYS CD C 13 29.2 0.2 . 1 . . . . 63 LYS CD . 7201 1 839 . 1 1 63 63 LYS CE C 13 41.9 0.2 . 1 . . . . 63 LYS CE . 7201 1 840 . 1 1 63 63 LYS N N 15 120.0 0.2 . 1 . . . . 63 LYS N . 7201 1 841 . 1 1 64 64 GLY H H 1 7.36 0.02 . 1 . . . . 64 GLY H . 7201 1 842 . 1 1 64 64 GLY HA2 H 1 3.75 0.02 . 2 . . . . 64 GLY HA2 . 7201 1 843 . 1 1 64 64 GLY HA3 H 1 4.29 0.02 . 2 . . . . 64 GLY HA3 . 7201 1 844 . 1 1 64 64 GLY C C 13 173.9 0.2 . 1 . . . . 64 GLY C . 7201 1 845 . 1 1 64 64 GLY CA C 13 45.0 0.2 . 1 . . . . 64 GLY CA . 7201 1 846 . 1 1 64 64 GLY N N 15 104.3 0.2 . 1 . . . . 64 GLY N . 7201 1 847 . 1 1 65 65 MET H H 1 7.07 0.02 . 1 . . . . 65 MET H . 7201 1 848 . 1 1 65 65 MET HA H 1 4.41 0.02 . 1 . . . . 65 MET HA . 7201 1 849 . 1 1 65 65 MET HB2 H 1 1.76 0.02 . 2 . . . . 65 MET HB2 . 7201 1 850 . 1 1 65 65 MET HB3 H 1 1.91 0.02 . 2 . . . . 65 MET HB3 . 7201 1 851 . 1 1 65 65 MET HG2 H 1 2.49 0.02 . 2 . . . . 65 MET HG2 . 7201 1 852 . 1 1 65 65 MET HG3 H 1 2.80 0.02 . 2 . . . . 65 MET HG3 . 7201 1 853 . 1 1 65 65 MET HE1 H 1 1.56 0.02 . 1 . . . . 65 MET HE . 7201 1 854 . 1 1 65 65 MET HE2 H 1 1.56 0.02 . 1 . . . . 65 MET HE . 7201 1 855 . 1 1 65 65 MET HE3 H 1 1.56 0.02 . 1 . . . . 65 MET HE . 7201 1 856 . 1 1 65 65 MET C C 13 174.7 0.2 . 1 . . . . 65 MET C . 7201 1 857 . 1 1 65 65 MET CA C 13 55.6 0.2 . 1 . . . . 65 MET CA . 7201 1 858 . 1 1 65 65 MET CB C 13 35.1 0.2 . 1 . . . . 65 MET CB . 7201 1 859 . 1 1 65 65 MET CG C 13 32.9 0.2 . 1 . . . . 65 MET CG . 7201 1 860 . 1 1 65 65 MET CE C 13 17.9 0.2 . 1 . . . . 65 MET CE . 7201 1 861 . 1 1 65 65 MET N N 15 120.1 0.2 . 1 . . . . 65 MET N . 7201 1 862 . 1 1 66 66 ASN H H 1 8.61 0.02 . 1 . . . . 66 ASN H . 7201 1 863 . 1 1 66 66 ASN HA H 1 4.57 0.02 . 1 . . . . 66 ASN HA . 7201 1 864 . 1 1 66 66 ASN HB2 H 1 2.78 0.02 . 2 . . . . 66 ASN HB2 . 7201 1 865 . 1 1 66 66 ASN HB3 H 1 3.09 0.02 . 2 . . . . 66 ASN HB3 . 7201 1 866 . 1 1 66 66 ASN HD21 H 1 6.69 0.02 . 2 . . . . 66 ASN HD21 . 7201 1 867 . 1 1 66 66 ASN HD22 H 1 7.38 0.02 . 2 . . . . 66 ASN HD22 . 7201 1 868 . 1 1 66 66 ASN C C 13 174.4 0.2 . 1 . . . . 66 ASN C . 7201 1 869 . 1 1 66 66 ASN CA C 13 50.9 0.2 . 1 . . . . 66 ASN CA . 7201 1 870 . 1 1 66 66 ASN CB C 13 39.9 0.2 . 1 . . . . 66 ASN CB . 7201 1 871 . 1 1 66 66 ASN N N 15 117.5 0.2 . 1 . . . . 66 ASN N . 7201 1 872 . 1 1 66 66 ASN ND2 N 15 111.4 0.2 . 1 . . . . 66 ASN ND2 . 7201 1 873 . 1 1 67 67 LYS H H 1 8.11 0.02 . 1 . . . . 67 LYS H . 7201 1 874 . 1 1 67 67 LYS HA H 1 3.93 0.02 . 1 . . . . 67 LYS HA . 7201 1 875 . 1 1 67 67 LYS HB2 H 1 1.69 0.02 . 2 . . . . 67 LYS HB2 . 7201 1 876 . 1 1 67 67 LYS HB3 H 1 1.80 0.02 . 2 . . . . 67 LYS HB3 . 7201 1 877 . 1 1 67 67 LYS HG2 H 1 1.15 0.02 . 1 . . . . 67 LYS HG2 . 7201 1 878 . 1 1 67 67 LYS HG3 H 1 1.15 0.02 . 1 . . . . 67 LYS HG3 . 7201 1 879 . 1 1 67 67 LYS HD2 H 1 1.59 0.02 . 1 . . . . 67 LYS HD2 . 7201 1 880 . 1 1 67 67 LYS HD3 H 1 1.59 0.02 . 1 . . . . 67 LYS HD3 . 7201 1 881 . 1 1 67 67 LYS HE2 H 1 2.93 0.02 . 1 . . . . 67 LYS HE2 . 7201 1 882 . 1 1 67 67 LYS HE3 H 1 2.93 0.02 . 1 . . . . 67 LYS HE3 . 7201 1 883 . 1 1 67 67 LYS C C 13 177.4 0.2 . 1 . . . . 67 LYS C . 7201 1 884 . 1 1 67 67 LYS CA C 13 60.2 0.2 . 1 . . . . 67 LYS CA . 7201 1 885 . 1 1 67 67 LYS CB C 13 33.5 0.2 . 1 . . . . 67 LYS CB . 7201 1 886 . 1 1 67 67 LYS CG C 13 24.5 0.2 . 1 . . . . 67 LYS CG . 7201 1 887 . 1 1 67 67 LYS CD C 13 29.9 0.2 . 1 . . . . 67 LYS CD . 7201 1 888 . 1 1 67 67 LYS CE C 13 42.0 0.2 . 1 . . . . 67 LYS CE . 7201 1 889 . 1 1 67 67 LYS N N 15 119.0 0.2 . 1 . . . . 67 LYS N . 7201 1 890 . 1 1 68 68 ALA H H 1 8.13 0.02 . 1 . . . . 68 ALA H . 7201 1 891 . 1 1 68 68 ALA HA H 1 4.18 0.02 . 1 . . . . 68 ALA HA . 7201 1 892 . 1 1 68 68 ALA HB1 H 1 1.43 0.02 . 1 . . . . 68 ALA HB . 7201 1 893 . 1 1 68 68 ALA HB2 H 1 1.43 0.02 . 1 . . . . 68 ALA HB . 7201 1 894 . 1 1 68 68 ALA HB3 H 1 1.43 0.02 . 1 . . . . 68 ALA HB . 7201 1 895 . 1 1 68 68 ALA C C 13 168.0 0.2 . 1 . . . . 68 ALA C . 7201 1 896 . 1 1 68 68 ALA CA C 13 55.2 0.2 . 1 . . . . 68 ALA CA . 7201 1 897 . 1 1 68 68 ALA CB C 13 18.0 0.2 . 1 . . . . 68 ALA CB . 7201 1 898 . 1 1 68 68 ALA N N 15 120.5 0.2 . 1 . . . . 68 ALA N . 7201 1 899 . 1 1 69 69 GLU H H 1 8.04 0.02 . 1 . . . . 69 GLU H . 7201 1 900 . 1 1 69 69 GLU HA H 1 4.06 0.02 . 1 . . . . 69 GLU HA . 7201 1 901 . 1 1 69 69 GLU HB2 H 1 1.94 0.02 . 2 . . . . 69 GLU HB2 . 7201 1 902 . 1 1 69 69 GLU HB3 H 1 2.07 0.02 . 2 . . . . 69 GLU HB3 . 7201 1 903 . 1 1 69 69 GLU HG2 H 1 2.22 0.02 . 2 . . . . 69 GLU HG2 . 7201 1 904 . 1 1 69 69 GLU HG3 H 1 2.45 0.02 . 2 . . . . 69 GLU HG3 . 7201 1 905 . 1 1 69 69 GLU C C 13 180.1 0.2 . 1 . . . . 69 GLU C . 7201 1 906 . 1 1 69 69 GLU CA C 13 59.3 0.2 . 1 . . . . 69 GLU CA . 7201 1 907 . 1 1 69 69 GLU CB C 13 29.7 0.2 . 1 . . . . 69 GLU CB . 7201 1 908 . 1 1 69 69 GLU CG C 13 37.2 0.2 . 1 . . . . 69 GLU CG . 7201 1 909 . 1 1 69 69 GLU N N 15 119.8 0.2 . 1 . . . . 69 GLU N . 7201 1 910 . 1 1 70 70 HIS H H 1 8.17 0.02 . 1 . . . . 70 HIS H . 7201 1 911 . 1 1 70 70 HIS HA H 1 4.24 0.02 . 1 . . . . 70 HIS HA . 7201 1 912 . 1 1 70 70 HIS HB2 H 1 2.77 0.02 . 2 . . . . 70 HIS HB2 . 7201 1 913 . 1 1 70 70 HIS HB3 H 1 3.48 0.02 . 2 . . . . 70 HIS HB3 . 7201 1 914 . 1 1 70 70 HIS C C 13 178.7 0.2 . 1 . . . . 70 HIS C . 7201 1 915 . 1 1 70 70 HIS CA C 13 58.1 0.2 . 1 . . . . 70 HIS CA . 7201 1 916 . 1 1 70 70 HIS CB C 13 33.5 0.2 . 1 . . . . 70 HIS CB . 7201 1 917 . 1 1 70 70 HIS N N 15 118.0 0.2 . 1 . . . . 70 HIS N . 7201 1 918 . 1 1 71 71 GLU H H 1 9.08 0.02 . 1 . . . . 71 GLU H . 7201 1 919 . 1 1 71 71 GLU HA H 1 3.75 0.02 . 1 . . . . 71 GLU HA . 7201 1 920 . 1 1 71 71 GLU HB2 H 1 1.95 0.02 . 2 . . . . 71 GLU HB2 . 7201 1 921 . 1 1 71 71 GLU HB3 H 1 2.24 0.02 . 2 . . . . 71 GLU HB3 . 7201 1 922 . 1 1 71 71 GLU HG2 H 1 2.04 0.02 . 2 . . . . 71 GLU HG2 . 7201 1 923 . 1 1 71 71 GLU HG3 H 1 2.94 0.02 . 2 . . . . 71 GLU HG3 . 7201 1 924 . 1 1 71 71 GLU C C 13 178.3 0.2 . 1 . . . . 71 GLU C . 7201 1 925 . 1 1 71 71 GLU CA C 13 61.1 0.2 . 1 . . . . 71 GLU CA . 7201 1 926 . 1 1 71 71 GLU CB C 13 28.5 0.2 . 1 . . . . 71 GLU CB . 7201 1 927 . 1 1 71 71 GLU CG C 13 38.3 0.2 . 1 . . . . 71 GLU CG . 7201 1 928 . 1 1 71 71 GLU N N 15 116.7 0.2 . 1 . . . . 71 GLU N . 7201 1 929 . 1 1 72 72 SER H H 1 8.01 0.02 . 1 . . . . 72 SER H . 7201 1 930 . 1 1 72 72 SER HA H 1 4.29 0.02 . 1 . . . . 72 SER HA . 7201 1 931 . 1 1 72 72 SER HB2 H 1 4.06 0.02 . 1 . . . . 72 SER HB2 . 7201 1 932 . 1 1 72 72 SER HB3 H 1 4.06 0.02 . 1 . . . . 72 SER HB3 . 7201 1 933 . 1 1 72 72 SER C C 13 176.7 0.2 . 1 . . . . 72 SER C . 7201 1 934 . 1 1 72 72 SER CA C 13 61.7 0.2 . 1 . . . . 72 SER CA . 7201 1 935 . 1 1 72 72 SER CB C 13 62.7 0.2 . 1 . . . . 72 SER CB . 7201 1 936 . 1 1 72 72 SER N N 15 116.1 0.2 . 1 . . . . 72 SER N . 7201 1 937 . 1 1 73 73 ILE H H 1 7.54 0.02 . 1 . . . . 73 ILE H . 7201 1 938 . 1 1 73 73 ILE HA H 1 3.79 0.02 . 1 . . . . 73 ILE HA . 7201 1 939 . 1 1 73 73 ILE HB H 1 1.93 0.02 . 1 . . . . 73 ILE HB . 7201 1 940 . 1 1 73 73 ILE HG12 H 1 0.92 0.02 . 1 . . . . 73 ILE HG12 . 7201 1 941 . 1 1 73 73 ILE HG13 H 1 0.92 0.02 . 1 . . . . 73 ILE HG13 . 7201 1 942 . 1 1 73 73 ILE HG21 H 1 0.93 0.02 . 1 . . . . 73 ILE HG2 . 7201 1 943 . 1 1 73 73 ILE HG22 H 1 0.93 0.02 . 1 . . . . 73 ILE HG2 . 7201 1 944 . 1 1 73 73 ILE HG23 H 1 0.93 0.02 . 1 . . . . 73 ILE HG2 . 7201 1 945 . 1 1 73 73 ILE HD11 H 1 0.58 0.02 . 1 . . . . 73 ILE HD1 . 7201 1 946 . 1 1 73 73 ILE HD12 H 1 0.58 0.02 . 1 . . . . 73 ILE HD1 . 7201 1 947 . 1 1 73 73 ILE HD13 H 1 0.58 0.02 . 1 . . . . 73 ILE HD1 . 7201 1 948 . 1 1 73 73 ILE C C 13 178.3 0.2 . 1 . . . . 73 ILE C . 7201 1 949 . 1 1 73 73 ILE CA C 13 65.5 0.2 . 1 . . . . 73 ILE CA . 7201 1 950 . 1 1 73 73 ILE CB C 13 38.7 0.2 . 1 . . . . 73 ILE CB . 7201 1 951 . 1 1 73 73 ILE CG1 C 13 29.2 0.2 . 1 . . . . 73 ILE CG1 . 7201 1 952 . 1 1 73 73 ILE CG2 C 13 18.0 0.2 . 1 . . . . 73 ILE CG2 . 7201 1 953 . 1 1 73 73 ILE CD1 C 13 14.4 0.2 . 1 . . . . 73 ILE CD1 . 7201 1 954 . 1 1 73 73 ILE N N 15 122.0 0.2 . 1 . . . . 73 ILE N . 7201 1 955 . 1 1 74 74 ILE H H 1 8.40 0.02 . 1 . . . . 74 ILE H . 7201 1 956 . 1 1 74 74 ILE HA H 1 3.53 0.02 . 1 . . . . 74 ILE HA . 7201 1 957 . 1 1 74 74 ILE HB H 1 1.77 0.02 . 1 . . . . 74 ILE HB . 7201 1 958 . 1 1 74 74 ILE HG12 H 1 1.77 0.02 . 2 . . . . 74 ILE HG12 . 7201 1 959 . 1 1 74 74 ILE HG13 H 1 1.86 0.02 . 2 . . . . 74 ILE HG13 . 7201 1 960 . 1 1 74 74 ILE HG21 H 1 0.75 0.02 . 1 . . . . 74 ILE HG2 . 7201 1 961 . 1 1 74 74 ILE HG22 H 1 0.75 0.02 . 1 . . . . 74 ILE HG2 . 7201 1 962 . 1 1 74 74 ILE HG23 H 1 0.75 0.02 . 1 . . . . 74 ILE HG2 . 7201 1 963 . 1 1 74 74 ILE HD11 H 1 0.46 0.02 . 1 . . . . 74 ILE HD1 . 7201 1 964 . 1 1 74 74 ILE HD12 H 1 0.46 0.02 . 1 . . . . 74 ILE HD1 . 7201 1 965 . 1 1 74 74 ILE HD13 H 1 0.46 0.02 . 1 . . . . 74 ILE HD1 . 7201 1 966 . 1 1 74 74 ILE C C 13 177.8 0.2 . 1 . . . . 74 ILE C . 7201 1 967 . 1 1 74 74 ILE CA C 13 66.6 0.2 . 1 . . . . 74 ILE CA . 7201 1 968 . 1 1 74 74 ILE CB C 13 38.8 0.2 . 1 . . . . 74 ILE CB . 7201 1 969 . 1 1 74 74 ILE CG1 C 13 30.4 0.2 . 1 . . . . 74 ILE CG1 . 7201 1 970 . 1 1 74 74 ILE CG2 C 13 18.2 0.2 . 1 . . . . 74 ILE CG2 . 7201 1 971 . 1 1 74 74 ILE CD1 C 13 12.6 0.2 . 1 . . . . 74 ILE CD1 . 7201 1 972 . 1 1 74 74 ILE N N 15 119.4 0.2 . 1 . . . . 74 ILE N . 7201 1 973 . 1 1 75 75 SER H H 1 8.65 0.02 . 1 . . . . 75 SER H . 7201 1 974 . 1 1 75 75 SER HA H 1 4.76 0.02 . 1 . . . . 75 SER HA . 7201 1 975 . 1 1 75 75 SER HB2 H 1 3.99 0.02 . 2 . . . . 75 SER HB2 . 7201 1 976 . 1 1 75 75 SER HB3 H 1 4.06 0.02 . 2 . . . . 75 SER HB3 . 7201 1 977 . 1 1 75 75 SER C C 13 178.9 0.2 . 1 . . . . 75 SER C . 7201 1 978 . 1 1 75 75 SER CA C 13 61.7 0.2 . 1 . . . . 75 SER CA . 7201 1 979 . 1 1 75 75 SER CB C 13 63.0 0.2 . 1 . . . . 75 SER CB . 7201 1 980 . 1 1 75 75 SER N N 15 115.1 0.2 . 1 . . . . 75 SER N . 7201 1 981 . 1 1 76 76 ASN H H 1 7.98 0.02 . 1 . . . . 76 ASN H . 7201 1 982 . 1 1 76 76 ASN HA H 1 4.61 0.02 . 1 . . . . 76 ASN HA . 7201 1 983 . 1 1 76 76 ASN HB2 H 1 3.07 0.02 . 2 . . . . 76 ASN HB2 . 7201 1 984 . 1 1 76 76 ASN HB3 H 1 3.16 0.02 . 2 . . . . 76 ASN HB3 . 7201 1 985 . 1 1 76 76 ASN HD21 H 1 6.95 0.02 . 2 . . . . 76 ASN HD21 . 7201 1 986 . 1 1 76 76 ASN HD22 H 1 7.62 0.02 . 2 . . . . 76 ASN HD22 . 7201 1 987 . 1 1 76 76 ASN C C 13 176.9 0.2 . 1 . . . . 76 ASN C . 7201 1 988 . 1 1 76 76 ASN CA C 13 55.8 0.2 . 1 . . . . 76 ASN CA . 7201 1 989 . 1 1 76 76 ASN CB C 13 38.5 0.2 . 1 . . . . 76 ASN CB . 7201 1 990 . 1 1 76 76 ASN N N 15 122.0 0.2 . 1 . . . . 76 ASN N . 7201 1 991 . 1 1 76 76 ASN ND2 N 15 112.7 0.2 . 1 . . . . 76 ASN ND2 . 7201 1 992 . 1 1 77 77 LEU H H 1 7.98 0.02 . 1 . . . . 77 LEU H . 7201 1 993 . 1 1 77 77 LEU HA H 1 4.41 0.02 . 1 . . . . 77 LEU HA . 7201 1 994 . 1 1 77 77 LEU HB2 H 1 1.88 0.02 . 2 . . . . 77 LEU HB2 . 7201 1 995 . 1 1 77 77 LEU HB3 H 1 2.28 0.02 . 2 . . . . 77 LEU HB3 . 7201 1 996 . 1 1 77 77 LEU HG H 1 1.99 0.02 . 1 . . . . 77 LEU HG . 7201 1 997 . 1 1 77 77 LEU HD11 H 1 0.82 0.02 . 1 . . . . 77 LEU HD1 . 7201 1 998 . 1 1 77 77 LEU HD12 H 1 0.82 0.02 . 1 . . . . 77 LEU HD1 . 7201 1 999 . 1 1 77 77 LEU HD13 H 1 0.82 0.02 . 1 . . . . 77 LEU HD1 . 7201 1 1000 . 1 1 77 77 LEU HD21 H 1 0.91 0.02 . 1 . . . . 77 LEU HD2 . 7201 1 1001 . 1 1 77 77 LEU HD22 H 1 0.91 0.02 . 1 . . . . 77 LEU HD2 . 7201 1 1002 . 1 1 77 77 LEU HD23 H 1 0.91 0.02 . 1 . . . . 77 LEU HD2 . 7201 1 1003 . 1 1 77 77 LEU C C 13 177.5 0.2 . 1 . . . . 77 LEU C . 7201 1 1004 . 1 1 77 77 LEU CA C 13 55.6 0.2 . 1 . . . . 77 LEU CA . 7201 1 1005 . 1 1 77 77 LEU CB C 13 42.3 0.2 . 1 . . . . 77 LEU CB . 7201 1 1006 . 1 1 77 77 LEU CG C 13 26.7 0.2 . 1 . . . . 77 LEU CG . 7201 1 1007 . 1 1 77 77 LEU CD1 C 13 27.0 0.02 . 1 . . . . 77 LEU CD1 . 7201 1 1008 . 1 1 77 77 LEU CD2 C 13 22.8 0.02 . 1 . . . . 77 LEU CD2 . 7201 1 1009 . 1 1 77 77 LEU N N 15 120.1 0.2 . 1 . . . . 77 LEU N . 7201 1 1010 . 1 1 78 78 GLY H H 1 7.96 0.02 . 1 . . . . 78 GLY H . 7201 1 1011 . 1 1 78 78 GLY HA2 H 1 3.84 0.02 . 2 . . . . 78 GLY HA2 . 7201 1 1012 . 1 1 78 78 GLY HA3 H 1 4.30 0.02 . 2 . . . . 78 GLY HA3 . 7201 1 1013 . 1 1 78 78 GLY C C 13 174.2 0.2 . 1 . . . . 78 GLY C . 7201 1 1014 . 1 1 78 78 GLY CA C 13 45.7 0.2 . 1 . . . . 78 GLY CA . 7201 1 1015 . 1 1 78 78 GLY N N 15 106.4 0.2 . 1 . . . . 78 GLY N . 7201 1 1016 . 1 1 79 79 ARG H H 1 7.45 0.02 . 1 . . . . 79 ARG H . 7201 1 1017 . 1 1 79 79 ARG HA H 1 4.68 0.02 . 1 . . . . 79 ARG HA . 7201 1 1018 . 1 1 79 79 ARG HB2 H 1 1.52 0.02 . 2 . . . . 79 ARG HB2 . 7201 1 1019 . 1 1 79 79 ARG HB3 H 1 1.69 0.02 . 2 . . . . 79 ARG HB3 . 7201 1 1020 . 1 1 79 79 ARG HG2 H 1 1.44 0.02 . 2 . . . . 79 ARG HG2 . 7201 1 1021 . 1 1 79 79 ARG HG3 H 1 1.62 0.02 . 2 . . . . 79 ARG HG3 . 7201 1 1022 . 1 1 79 79 ARG HD2 H 1 3.12 0.02 . 2 . . . . 79 ARG HD2 . 7201 1 1023 . 1 1 79 79 ARG HD3 H 1 3.20 0.02 . 2 . . . . 79 ARG HD3 . 7201 1 1024 . 1 1 79 79 ARG HE H 1 7.55 0.02 . 1 . . . . 79 ARG HE . 7201 1 1025 . 1 1 79 79 ARG C C 13 174.0 0.2 . 1 . . . . 79 ARG C . 7201 1 1026 . 1 1 79 79 ARG CA C 13 52.5 0.2 . 1 . . . . 79 ARG CA . 7201 1 1027 . 1 1 79 79 ARG CB C 13 32.3 0.2 . 1 . . . . 79 ARG CB . 7201 1 1028 . 1 1 79 79 ARG CG C 13 26.4 0.2 . 1 . . . . 79 ARG CG . 7201 1 1029 . 1 1 79 79 ARG CD C 13 41.5 0.2 . 1 . . . . 79 ARG CD . 7201 1 1030 . 1 1 79 79 ARG N N 15 119.3 0.2 . 1 . . . . 79 ARG N . 7201 1 1031 . 1 1 79 79 ARG NE N 15 83.6 0.2 . 1 . . . . 79 ARG NE . 7201 1 1032 . 1 1 80 80 ASN H H 1 8.68 0.02 . 1 . . . . 80 ASN H . 7201 1 1033 . 1 1 80 80 ASN HA H 1 4.92 0.02 . 1 . . . . 80 ASN HA . 7201 1 1034 . 1 1 80 80 ASN HB2 H 1 2.70 0.02 . 2 . . . . 80 ASN HB2 . 7201 1 1035 . 1 1 80 80 ASN HB3 H 1 2.96 0.02 . 2 . . . . 80 ASN HB3 . 7201 1 1036 . 1 1 80 80 ASN HD21 H 1 6.84 0.02 . 2 . . . . 80 ASN HD21 . 7201 1 1037 . 1 1 80 80 ASN HD22 H 1 7.22 0.02 . 2 . . . . 80 ASN HD22 . 7201 1 1038 . 1 1 80 80 ASN CA C 13 50.5 0.2 . 1 . . . . 80 ASN CA . 7201 1 1039 . 1 1 80 80 ASN CB C 13 39.0 0.2 . 1 . . . . 80 ASN CB . 7201 1 1040 . 1 1 80 80 ASN N N 15 120.9 0.2 . 1 . . . . 80 ASN N . 7201 1 1041 . 1 1 80 80 ASN ND2 N 15 111.2 0.2 . 1 . . . . 80 ASN ND2 . 7201 1 1042 . 1 1 81 81 PRO HA H 1 4.33 0.02 . 1 . . . . 81 PRO HA . 7201 1 1043 . 1 1 81 81 PRO HB2 H 1 2.11 0.02 . 2 . . . . 81 PRO HB2 . 7201 1 1044 . 1 1 81 81 PRO HB3 H 1 2.25 0.02 . 2 . . . . 81 PRO HB3 . 7201 1 1045 . 1 1 81 81 PRO HG2 H 1 1.97 0.02 . 2 . . . . 81 PRO HG2 . 7201 1 1046 . 1 1 81 81 PRO HG3 H 1 2.17 0.02 . 2 . . . . 81 PRO HG3 . 7201 1 1047 . 1 1 81 81 PRO HD2 H 1 3.94 0.02 . 2 . . . . 81 PRO HD2 . 7201 1 1048 . 1 1 81 81 PRO HD3 H 1 4.32 0.02 . 2 . . . . 81 PRO HD3 . 7201 1 1049 . 1 1 81 81 PRO C C 13 177.7 0.2 . 1 . . . . 81 PRO C . 7201 1 1050 . 1 1 81 81 PRO CA C 13 65.1 0.2 . 1 . . . . 81 PRO CA . 7201 1 1051 . 1 1 81 81 PRO CB C 13 32.2 0.2 . 1 . . . . 81 PRO CB . 7201 1 1052 . 1 1 81 81 PRO CG C 13 27.7 0.2 . 1 . . . . 81 PRO CG . 7201 1 1053 . 1 1 81 81 PRO CD C 13 51.2 0.2 . 1 . . . . 81 PRO CD . 7201 1 1054 . 1 1 82 82 SER H H 1 8.16 0.02 . 1 . . . . 82 SER H . 7201 1 1055 . 1 1 82 82 SER HA H 1 4.30 0.02 . 1 . . . . 82 SER HA . 7201 1 1056 . 1 1 82 82 SER HB2 H 1 3.87 0.02 . 1 . . . . 82 SER HB2 . 7201 1 1057 . 1 1 82 82 SER HB3 H 1 3.87 0.02 . 1 . . . . 82 SER HB3 . 7201 1 1058 . 1 1 82 82 SER C C 13 174.3 0.2 . 1 . . . . 82 SER C . 7201 1 1059 . 1 1 82 82 SER CA C 13 60.3 0.2 . 1 . . . . 82 SER CA . 7201 1 1060 . 1 1 82 82 SER CB C 13 62.7 0.2 . 1 . . . . 82 SER CB . 7201 1 1061 . 1 1 82 82 SER N N 15 112.6 0.2 . 1 . . . . 82 SER N . 7201 1 1062 . 1 1 83 83 ASP H H 1 7.73 0.02 . 1 . . . . 83 ASP H . 7201 1 1063 . 1 1 83 83 ASP HA H 1 4.16 0.02 . 1 . . . . 83 ASP HA . 7201 1 1064 . 1 1 83 83 ASP HB2 H 1 2.08 0.02 . 1 . . . . 83 ASP HB2 . 7201 1 1065 . 1 1 83 83 ASP HB3 H 1 2.08 0.02 . 1 . . . . 83 ASP HB3 . 7201 1 1066 . 1 1 83 83 ASP C C 13 175.0 0.2 . 1 . . . . 83 ASP C . 7201 1 1067 . 1 1 83 83 ASP CA C 13 55.5 0.2 . 1 . . . . 83 ASP CA . 7201 1 1068 . 1 1 83 83 ASP CB C 13 39.8 0.2 . 1 . . . . 83 ASP CB . 7201 1 1069 . 1 1 83 83 ASP N N 15 120.1 0.2 . 1 . . . . 83 ASP N . 7201 1 1070 . 1 1 84 84 PHE H H 1 7.49 0.02 . 1 . . . . 84 PHE H . 7201 1 1071 . 1 1 84 84 PHE HA H 1 4.69 0.02 . 1 . . . . 84 PHE HA . 7201 1 1072 . 1 1 84 84 PHE HB2 H 1 2.89 0.02 . 1 . . . . 84 PHE HB2 . 7201 1 1073 . 1 1 84 84 PHE HB3 H 1 2.89 0.02 . 1 . . . . 84 PHE HB3 . 7201 1 1074 . 1 1 84 84 PHE HD1 H 1 7.08 0.02 . 1 . . . . 84 PHE HD1 . 7201 1 1075 . 1 1 84 84 PHE HD2 H 1 7.08 0.02 . 1 . . . . 84 PHE HD2 . 7201 1 1076 . 1 1 84 84 PHE HE1 H 1 6.83 0.02 . 1 . . . . 84 PHE HE1 . 7201 1 1077 . 1 1 84 84 PHE HE2 H 1 6.83 0.02 . 1 . . . . 84 PHE HE2 . 7201 1 1078 . 1 1 84 84 PHE C C 13 176.0 0.2 . 1 . . . . 84 PHE C . 7201 1 1079 . 1 1 84 84 PHE CA C 13 57.0 0.2 . 1 . . . . 84 PHE CA . 7201 1 1080 . 1 1 84 84 PHE CB C 13 41.5 0.2 . 1 . . . . 84 PHE CB . 7201 1 1081 . 1 1 84 84 PHE CD1 C 13 131.6 0.02 . 1 . . . . 84 PHE CD1 . 7201 1 1082 . 1 1 84 84 PHE CD2 C 13 131.6 0.02 . 1 . . . . 84 PHE CD2 . 7201 1 1083 . 1 1 84 84 PHE CE1 C 13 131.0 0.02 . 1 . . . . 84 PHE CE1 . 7201 1 1084 . 1 1 84 84 PHE CE2 C 13 131.0 0.02 . 1 . . . . 84 PHE CE2 . 7201 1 1085 . 1 1 84 84 PHE N N 15 118.4 0.2 . 1 . . . . 84 PHE N . 7201 1 1086 . 1 1 85 85 LYS H H 1 9.15 0.02 . 1 . . . . 85 LYS H . 7201 1 1087 . 1 1 85 85 LYS HA H 1 4.33 0.02 . 1 . . . . 85 LYS HA . 7201 1 1088 . 1 1 85 85 LYS HB2 H 1 1.81 0.02 . 2 . . . . 85 LYS HB2 . 7201 1 1089 . 1 1 85 85 LYS HB3 H 1 1.90 0.02 . 2 . . . . 85 LYS HB3 . 7201 1 1090 . 1 1 85 85 LYS HG2 H 1 1.47 0.02 . 1 . . . . 85 LYS HG2 . 7201 1 1091 . 1 1 85 85 LYS HG3 H 1 1.47 0.02 . 1 . . . . 85 LYS HG3 . 7201 1 1092 . 1 1 85 85 LYS HD2 H 1 1.63 0.02 . 1 . . . . 85 LYS HD2 . 7201 1 1093 . 1 1 85 85 LYS HD3 H 1 1.63 0.02 . 1 . . . . 85 LYS HD3 . 7201 1 1094 . 1 1 85 85 LYS HE2 H 1 2.98 0.02 . 1 . . . . 85 LYS HE2 . 7201 1 1095 . 1 1 85 85 LYS HE3 H 1 2.98 0.02 . 1 . . . . 85 LYS HE3 . 7201 1 1096 . 1 1 85 85 LYS CA C 13 57.0 0.2 . 1 . . . . 85 LYS CA . 7201 1 1097 . 1 1 85 85 LYS CB C 13 34.0 0.2 . 1 . . . . 85 LYS CB . 7201 1 1098 . 1 1 85 85 LYS CG C 13 24.5 0.2 . 1 . . . . 85 LYS CG . 7201 1 1099 . 1 1 85 85 LYS CD C 13 28.5 0.2 . 1 . . . . 85 LYS CD . 7201 1 1100 . 1 1 85 85 LYS CE C 13 41.9 0.2 . 1 . . . . 85 LYS CE . 7201 1 1101 . 1 1 85 85 LYS N N 15 120.4 0.2 . 1 . . . . 85 LYS N . 7201 1 1102 . 1 1 86 86 ASN H H 1 7.38 0.02 . 1 . . . . 86 ASN H . 7201 1 1103 . 1 1 86 86 ASN HA H 1 4.77 0.02 . 1 . . . . 86 ASN HA . 7201 1 1104 . 1 1 86 86 ASN HB2 H 1 3.15 0.02 . 1 . . . . 86 ASN HB2 . 7201 1 1105 . 1 1 86 86 ASN HB3 H 1 3.15 0.02 . 1 . . . . 86 ASN HB3 . 7201 1 1106 . 1 1 86 86 ASN HD21 H 1 6.96 0.02 . 2 . . . . 86 ASN HD21 . 7201 1 1107 . 1 1 86 86 ASN HD22 H 1 7.51 0.02 . 2 . . . . 86 ASN HD22 . 7201 1 1108 . 1 1 86 86 ASN C C 13 174.7 0.2 . 1 . . . . 86 ASN C . 7201 1 1109 . 1 1 86 86 ASN CA C 13 52.0 0.2 . 1 . . . . 86 ASN CA . 7201 1 1110 . 1 1 86 86 ASN CB C 13 40.1 0.2 . 1 . . . . 86 ASN CB . 7201 1 1111 . 1 1 86 86 ASN N N 15 111.4 0.2 . 1 . . . . 86 ASN N . 7201 1 1112 . 1 1 86 86 ASN ND2 N 15 113.8 0.2 . 1 . . . . 86 ASN ND2 . 7201 1 1113 . 1 1 87 87 ALA H H 1 8.88 0.02 . 1 . . . . 87 ALA H . 7201 1 1114 . 1 1 87 87 ALA HA H 1 4.10 0.02 . 1 . . . . 87 ALA HA . 7201 1 1115 . 1 1 87 87 ALA HB1 H 1 1.58 0.02 . 1 . . . . 87 ALA HB . 7201 1 1116 . 1 1 87 87 ALA HB2 H 1 1.58 0.02 . 1 . . . . 87 ALA HB . 7201 1 1117 . 1 1 87 87 ALA HB3 H 1 1.58 0.02 . 1 . . . . 87 ALA HB . 7201 1 1118 . 1 1 87 87 ALA C C 13 178.4 0.2 . 1 . . . . 87 ALA C . 7201 1 1119 . 1 1 87 87 ALA CA C 13 55.9 0.2 . 1 . . . . 87 ALA CA . 7201 1 1120 . 1 1 87 87 ALA CB C 13 18.9 0.2 . 1 . . . . 87 ALA CB . 7201 1 1121 . 1 1 87 87 ALA N N 15 121.9 0.2 . 1 . . . . 87 ALA N . 7201 1 1122 . 1 1 88 88 ASP H H 1 8.13 0.02 . 1 . . . . 88 ASP H . 7201 1 1123 . 1 1 88 88 ASP HA H 1 4.27 0.02 . 1 . . . . 88 ASP HA . 7201 1 1124 . 1 1 88 88 ASP HB2 H 1 2.65 0.02 . 2 . . . . 88 ASP HB2 . 7201 1 1125 . 1 1 88 88 ASP HB3 H 1 2.71 0.02 . 2 . . . . 88 ASP HB3 . 7201 1 1126 . 1 1 88 88 ASP C C 13 179.6 0.2 . 1 . . . . 88 ASP C . 7201 1 1127 . 1 1 88 88 ASP CA C 13 57.8 0.2 . 1 . . . . 88 ASP CA . 7201 1 1128 . 1 1 88 88 ASP CB C 13 39.8 0.2 . 1 . . . . 88 ASP CB . 7201 1 1129 . 1 1 88 88 ASP N N 15 117.2 0.2 . 1 . . . . 88 ASP N . 7201 1 1130 . 1 1 89 89 GLU H H 1 8.37 0.02 . 1 . . . . 89 GLU H . 7201 1 1131 . 1 1 89 89 GLU HA H 1 4.15 0.02 . 1 . . . . 89 GLU HA . 7201 1 1132 . 1 1 89 89 GLU HB2 H 1 2.15 0.02 . 2 . . . . 89 GLU HB2 . 7201 1 1133 . 1 1 89 89 GLU HB3 H 1 2.38 0.02 . 2 . . . . 89 GLU HB3 . 7201 1 1134 . 1 1 89 89 GLU HG2 H 1 2.38 0.02 . 2 . . . . 89 GLU HG2 . 7201 1 1135 . 1 1 89 89 GLU HG3 H 1 2.79 0.02 . 2 . . . . 89 GLU HG3 . 7201 1 1136 . 1 1 89 89 GLU C C 13 180.0 0.2 . 1 . . . . 89 GLU C . 7201 1 1137 . 1 1 89 89 GLU CA C 13 59.2 0.2 . 1 . . . . 89 GLU CA . 7201 1 1138 . 1 1 89 89 GLU CB C 13 31.3 0.2 . 1 . . . . 89 GLU CB . 7201 1 1139 . 1 1 89 89 GLU CG C 13 36.6 0.2 . 1 . . . . 89 GLU CG . 7201 1 1140 . 1 1 89 89 GLU N N 15 118.7 0.2 . 1 . . . . 89 GLU N . 7201 1 1141 . 1 1 90 90 ARG H H 1 7.75 0.02 . 1 . . . . 90 ARG H . 7201 1 1142 . 1 1 90 90 ARG HA H 1 3.38 0.02 . 1 . . . . 90 ARG HA . 7201 1 1143 . 1 1 90 90 ARG HB2 H 1 1.22 0.02 . 2 . . . . 90 ARG HB2 . 7201 1 1144 . 1 1 90 90 ARG HB3 H 1 1.92 0.02 . 2 . . . . 90 ARG HB3 . 7201 1 1145 . 1 1 90 90 ARG HG2 H 1 1.16 0.02 . 2 . . . . 90 ARG HG2 . 7201 1 1146 . 1 1 90 90 ARG HG3 H 1 1.98 0.02 . 2 . . . . 90 ARG HG3 . 7201 1 1147 . 1 1 90 90 ARG HD2 H 1 3.15 0.02 . 2 . . . . 90 ARG HD2 . 7201 1 1148 . 1 1 90 90 ARG HD3 H 1 3.38 0.02 . 2 . . . . 90 ARG HD3 . 7201 1 1149 . 1 1 90 90 ARG HE H 1 9.31 0.02 . 1 . . . . 90 ARG HE . 7201 1 1150 . 1 1 90 90 ARG HH11 H 1 4.41 0.02 . 1 . . . . 90 ARG HH11 . 7201 1 1151 . 1 1 90 90 ARG HH12 H 1 4.41 0.02 . 1 . . . . 90 ARG HH12 . 7201 1 1152 . 1 1 90 90 ARG HH21 H 1 3.87 0.02 . 1 . . . . 90 ARG HH21 . 7201 1 1153 . 1 1 90 90 ARG HH22 H 1 3.87 0.02 . 1 . . . . 90 ARG HH22 . 7201 1 1154 . 1 1 90 90 ARG CA C 13 60.2 0.2 . 1 . . . . 90 ARG CA . 7201 1 1155 . 1 1 90 90 ARG CB C 13 30.9 0.2 . 1 . . . . 90 ARG CB . 7201 1 1156 . 1 1 90 90 ARG CD C 13 43.4 0.2 . 1 . . . . 90 ARG CD . 7201 1 1157 . 1 1 90 90 ARG N N 15 118.8 0.2 . 1 . . . . 90 ARG N . 7201 1 1158 . 1 1 90 90 ARG NE N 15 86.8 0.2 . 1 . . . . 90 ARG NE . 7201 1 1159 . 1 1 91 91 ILE H H 1 8.42 0.02 . 1 . . . . 91 ILE H . 7201 1 1160 . 1 1 91 91 ILE HA H 1 3.09 0.02 . 1 . . . . 91 ILE HA . 7201 1 1161 . 1 1 91 91 ILE HB H 1 1.75 0.02 . 1 . . . . 91 ILE HB . 7201 1 1162 . 1 1 91 91 ILE HG12 H 1 0.38 0.02 . 2 . . . . 91 ILE HG12 . 7201 1 1163 . 1 1 91 91 ILE HG13 H 1 1.46 0.02 . 2 . . . . 91 ILE HG13 . 7201 1 1164 . 1 1 91 91 ILE C C 13 176.7 0.2 . 1 . . . . 91 ILE C . 7201 1 1165 . 1 1 91 91 ILE CA C 13 66.0 0.2 . 1 . . . . 91 ILE CA . 7201 1 1166 . 1 1 91 91 ILE CB C 13 38.3 0.2 . 1 . . . . 91 ILE CB . 7201 1 1167 . 1 1 91 91 ILE CG1 C 13 30.2 0.2 . 1 . . . . 91 ILE CG1 . 7201 1 1168 . 1 1 91 91 ILE CG2 C 13 16.4 0.2 . 1 . . . . 91 ILE CG2 . 7201 1 1169 . 1 1 91 91 ILE CD1 C 13 13.6 0.2 . 1 . . . . 91 ILE CD1 . 7201 1 1170 . 1 1 91 91 ILE N N 15 118.0 0.2 . 1 . . . . 91 ILE N . 7201 1 1171 . 1 1 92 92 ALA H H 1 7.90 0.02 . 1 . . . . 92 ALA H . 7201 1 1172 . 1 1 92 92 ALA HA H 1 3.99 0.02 . 1 . . . . 92 ALA HA . 7201 1 1173 . 1 1 92 92 ALA HB1 H 1 1.48 0.02 . 1 . . . . 92 ALA HB . 7201 1 1174 . 1 1 92 92 ALA HB2 H 1 1.48 0.02 . 1 . . . . 92 ALA HB . 7201 1 1175 . 1 1 92 92 ALA HB3 H 1 1.48 0.02 . 1 . . . . 92 ALA HB . 7201 1 1176 . 1 1 92 92 ALA C C 13 180.4 0.2 . 1 . . . . 92 ALA C . 7201 1 1177 . 1 1 92 92 ALA CA C 13 55.1 0.2 . 1 . . . . 92 ALA CA . 7201 1 1178 . 1 1 92 92 ALA CB C 13 18.3 0.2 . 1 . . . . 92 ALA CB . 7201 1 1179 . 1 1 92 92 ALA N N 15 119.1 0.2 . 1 . . . . 92 ALA N . 7201 1 1180 . 1 1 93 93 TYR H H 1 7.43 0.02 . 1 . . . . 93 TYR H . 7201 1 1181 . 1 1 93 93 TYR HA H 1 4.12 0.02 . 1 . . . . 93 TYR HA . 7201 1 1182 . 1 1 93 93 TYR HB2 H 1 2.55 0.02 . 2 . . . . 93 TYR HB2 . 7201 1 1183 . 1 1 93 93 TYR HB3 H 1 3.10 0.02 . 2 . . . . 93 TYR HB3 . 7201 1 1184 . 1 1 93 93 TYR HD1 H 1 6.86 0.02 . 1 . . . . 93 TYR HD1 . 7201 1 1185 . 1 1 93 93 TYR HD2 H 1 6.86 0.02 . 1 . . . . 93 TYR HD2 . 7201 1 1186 . 1 1 93 93 TYR C C 13 177.0 0.2 . 1 . . . . 93 TYR C . 7201 1 1187 . 1 1 93 93 TYR CA C 13 61.8 0.2 . 1 . . . . 93 TYR CA . 7201 1 1188 . 1 1 93 93 TYR CB C 13 38.8 0.2 . 1 . . . . 93 TYR CB . 7201 1 1189 . 1 1 93 93 TYR CD1 C 13 133.2 0.02 . 1 . . . . 93 TYR CD1 . 7201 1 1190 . 1 1 93 93 TYR CD2 C 13 133.2 0.02 . 1 . . . . 93 TYR CD2 . 7201 1 1191 . 1 1 93 93 TYR N N 15 117.1 0.2 . 1 . . . . 93 TYR N . 7201 1 1192 . 1 1 94 94 ILE H H 1 7.84 0.02 . 1 . . . . 94 ILE H . 7201 1 1193 . 1 1 94 94 ILE HA H 1 3.00 0.02 . 1 . . . . 94 ILE HA . 7201 1 1194 . 1 1 94 94 ILE HB H 1 1.65 0.02 . 1 . . . . 94 ILE HB . 7201 1 1195 . 1 1 94 94 ILE HG12 H 1 1.63 0.02 . 2 . . . . 94 ILE HG12 . 7201 1 1196 . 1 1 94 94 ILE HG13 H 1 1.94 0.02 . 2 . . . . 94 ILE HG13 . 7201 1 1197 . 1 1 94 94 ILE HG21 H 1 0.80 0.02 . 1 . . . . 94 ILE HG2 . 7201 1 1198 . 1 1 94 94 ILE HG22 H 1 0.80 0.02 . 1 . . . . 94 ILE HG2 . 7201 1 1199 . 1 1 94 94 ILE HG23 H 1 0.80 0.02 . 1 . . . . 94 ILE HG2 . 7201 1 1200 . 1 1 94 94 ILE HD11 H 1 0.63 0.02 . 1 . . . . 94 ILE HD1 . 7201 1 1201 . 1 1 94 94 ILE HD12 H 1 0.63 0.02 . 1 . . . . 94 ILE HD1 . 7201 1 1202 . 1 1 94 94 ILE HD13 H 1 0.63 0.02 . 1 . . . . 94 ILE HD1 . 7201 1 1203 . 1 1 94 94 ILE C C 13 178.0 0.2 . 1 . . . . 94 ILE C . 7201 1 1204 . 1 1 94 94 ILE CA C 13 66.2 0.2 . 1 . . . . 94 ILE CA . 7201 1 1205 . 1 1 94 94 ILE CB C 13 38.2 0.2 . 1 . . . . 94 ILE CB . 7201 1 1206 . 1 1 94 94 ILE CG1 C 13 29.4 0.2 . 1 . . . . 94 ILE CG1 . 7201 1 1207 . 1 1 94 94 ILE CG2 C 13 18.5 0.2 . 1 . . . . 94 ILE CG2 . 7201 1 1208 . 1 1 94 94 ILE CD1 C 13 13.3 0.2 . 1 . . . . 94 ILE CD1 . 7201 1 1209 . 1 1 94 94 ILE N N 15 119.4 0.2 . 1 . . . . 94 ILE N . 7201 1 1210 . 1 1 95 95 LEU H H 1 8.31 0.02 . 1 . . . . 95 LEU H . 7201 1 1211 . 1 1 95 95 LEU HA H 1 3.91 0.02 . 1 . . . . 95 LEU HA . 7201 1 1212 . 1 1 95 95 LEU HB2 H 1 1.43 0.02 . 2 . . . . 95 LEU HB2 . 7201 1 1213 . 1 1 95 95 LEU HB3 H 1 1.73 0.02 . 2 . . . . 95 LEU HB3 . 7201 1 1214 . 1 1 95 95 LEU HG H 1 1.66 0.02 . 1 . . . . 95 LEU HG . 7201 1 1215 . 1 1 95 95 LEU HD11 H 1 0.73 0.02 . 2 . . . . 95 LEU HD1 . 7201 1 1216 . 1 1 95 95 LEU HD12 H 1 0.73 0.02 . 2 . . . . 95 LEU HD1 . 7201 1 1217 . 1 1 95 95 LEU HD13 H 1 0.73 0.02 . 2 . . . . 95 LEU HD1 . 7201 1 1218 . 1 1 95 95 LEU HD21 H 1 0.73 0.02 . 2 . . . . 95 LEU HD2 . 7201 1 1219 . 1 1 95 95 LEU HD22 H 1 0.73 0.02 . 2 . . . . 95 LEU HD2 . 7201 1 1220 . 1 1 95 95 LEU HD23 H 1 0.73 0.02 . 2 . . . . 95 LEU HD2 . 7201 1 1221 . 1 1 95 95 LEU C C 13 179.4 0.2 . 1 . . . . 95 LEU C . 7201 1 1222 . 1 1 95 95 LEU CA C 13 57.7 0.2 . 1 . . . . 95 LEU CA . 7201 1 1223 . 1 1 95 95 LEU CB C 13 41.7 0.2 . 1 . . . . 95 LEU CB . 7201 1 1224 . 1 1 95 95 LEU CG C 13 26.0 0.2 . 1 . . . . 95 LEU CG . 7201 1 1225 . 1 1 95 95 LEU CD1 C 13 23.9 0.02 . 1 . . . . 95 LEU CD1 . 7201 1 1226 . 1 1 95 95 LEU CD2 C 13 23.9 0.02 . 1 . . . . 95 LEU CD2 . 7201 1 1227 . 1 1 95 95 LEU N N 15 116.3 0.2 . 1 . . . . 95 LEU N . 7201 1 1228 . 1 1 96 96 LYS H H 1 7.50 0.02 . 1 . . . . 96 LYS H . 7201 1 1229 . 1 1 96 96 LYS HA H 1 4.09 0.02 . 1 . . . . 96 LYS HA . 7201 1 1230 . 1 1 96 96 LYS HB2 H 1 1.86 0.02 . 1 . . . . 96 LYS HB2 . 7201 1 1231 . 1 1 96 96 LYS HB3 H 1 1.86 0.02 . 1 . . . . 96 LYS HB3 . 7201 1 1232 . 1 1 96 96 LYS HG2 H 1 1.45 0.02 . 2 . . . . 96 LYS HG2 . 7201 1 1233 . 1 1 96 96 LYS HG3 H 1 1.52 0.02 . 2 . . . . 96 LYS HG3 . 7201 1 1234 . 1 1 96 96 LYS HD2 H 1 1.70 0.02 . 1 . . . . 96 LYS HD2 . 7201 1 1235 . 1 1 96 96 LYS HD3 H 1 1.70 0.02 . 1 . . . . 96 LYS HD3 . 7201 1 1236 . 1 1 96 96 LYS HE2 H 1 3.01 0.02 . 1 . . . . 96 LYS HE2 . 7201 1 1237 . 1 1 96 96 LYS HE3 H 1 3.01 0.02 . 1 . . . . 96 LYS HE3 . 7201 1 1238 . 1 1 96 96 LYS C C 13 178.1 0.2 . 1 . . . . 96 LYS C . 7201 1 1239 . 1 1 96 96 LYS CA C 13 58.3 0.2 . 1 . . . . 96 LYS CA . 7201 1 1240 . 1 1 96 96 LYS CB C 13 32.1 0.2 . 1 . . . . 96 LYS CB . 7201 1 1241 . 1 1 96 96 LYS CG C 13 24.8 0.2 . 1 . . . . 96 LYS CG . 7201 1 1242 . 1 1 96 96 LYS CD C 13 29.0 0.2 . 1 . . . . 96 LYS CD . 7201 1 1243 . 1 1 96 96 LYS CE C 13 42.1 0.2 . 1 . . . . 96 LYS CE . 7201 1 1244 . 1 1 96 96 LYS N N 15 118.4 0.2 . 1 . . . . 96 LYS N . 7201 1 1245 . 1 1 97 97 GLN H H 1 7.72 0.02 . 1 . . . . 97 GLN H . 7201 1 1246 . 1 1 97 97 GLN HA H 1 4.09 0.02 . 1 . . . . 97 GLN HA . 7201 1 1247 . 1 1 97 97 GLN HB2 H 1 1.84 0.02 . 2 . . . . 97 GLN HB2 . 7201 1 1248 . 1 1 97 97 GLN HB3 H 1 2.09 0.02 . 2 . . . . 97 GLN HB3 . 7201 1 1249 . 1 1 97 97 GLN HG2 H 1 2.04 0.02 . 1 . . . . 97 GLN HG2 . 7201 1 1250 . 1 1 97 97 GLN HG3 H 1 2.04 0.02 . 1 . . . . 97 GLN HG3 . 7201 1 1251 . 1 1 97 97 GLN HE21 H 1 6.58 0.02 . 2 . . . . 97 GLN HE21 . 7201 1 1252 . 1 1 97 97 GLN HE22 H 1 6.90 0.02 . 2 . . . . 97 GLN HE22 . 7201 1 1253 . 1 1 97 97 GLN C C 13 177.8 0.2 . 1 . . . . 97 GLN C . 7201 1 1254 . 1 1 97 97 GLN CA C 13 56.2 0.2 . 1 . . . . 97 GLN CA . 7201 1 1255 . 1 1 97 97 GLN CB C 13 27.9 0.2 . 1 . . . . 97 GLN CB . 7201 1 1256 . 1 1 97 97 GLN CG C 13 32.9 0.2 . 1 . . . . 97 GLN CG . 7201 1 1257 . 1 1 97 97 GLN N N 15 116.5 0.2 . 1 . . . . 97 GLN N . 7201 1 1258 . 1 1 97 97 GLN NE2 N 15 114.3 0.2 . 1 . . . . 97 GLN NE2 . 7201 1 1259 . 1 1 98 98 ILE H H 1 7.74 0.02 . 1 . . . . 98 ILE H . 7201 1 1260 . 1 1 98 98 ILE HA H 1 3.98 0.02 . 1 . . . . 98 ILE HA . 7201 1 1261 . 1 1 98 98 ILE HB H 1 1.98 0.02 . 1 . . . . 98 ILE HB . 7201 1 1262 . 1 1 98 98 ILE HG12 H 1 1.29 0.02 . 2 . . . . 98 ILE HG12 . 7201 1 1263 . 1 1 98 98 ILE HG13 H 1 1.66 0.02 . 2 . . . . 98 ILE HG13 . 7201 1 1264 . 1 1 98 98 ILE HG21 H 1 0.96 0.02 . 1 . . . . 98 ILE HG2 . 7201 1 1265 . 1 1 98 98 ILE HG22 H 1 0.96 0.02 . 1 . . . . 98 ILE HG2 . 7201 1 1266 . 1 1 98 98 ILE HG23 H 1 0.96 0.02 . 1 . . . . 98 ILE HG2 . 7201 1 1267 . 1 1 98 98 ILE HD11 H 1 0.96 0.02 . 1 . . . . 98 ILE HD1 . 7201 1 1268 . 1 1 98 98 ILE HD12 H 1 0.96 0.02 . 1 . . . . 98 ILE HD1 . 7201 1 1269 . 1 1 98 98 ILE HD13 H 1 0.96 0.02 . 1 . . . . 98 ILE HD1 . 7201 1 1270 . 1 1 98 98 ILE C C 13 176.8 0.2 . 1 . . . . 98 ILE C . 7201 1 1271 . 1 1 98 98 ILE CA C 13 63.1 0.2 . 1 . . . . 98 ILE CA . 7201 1 1272 . 1 1 98 98 ILE CB C 13 38.4 0.2 . 1 . . . . 98 ILE CB . 7201 1 1273 . 1 1 98 98 ILE CG1 C 13 27.5 0.2 . 1 . . . . 98 ILE CG1 . 7201 1 1274 . 1 1 98 98 ILE CG2 C 13 17.3 0.2 . 1 . . . . 98 ILE CG2 . 7201 1 1275 . 1 1 98 98 ILE CD1 C 13 14.3 0.2 . 1 . . . . 98 ILE CD1 . 7201 1 1276 . 1 1 98 98 ILE N N 15 118.2 0.2 . 1 . . . . 98 ILE N . 7201 1 1277 . 1 1 99 99 ASP H H 1 7.99 0.02 . 1 . . . . 99 ASP H . 7201 1 1278 . 1 1 99 99 ASP HA H 1 4.61 0.02 . 1 . . . . 99 ASP HA . 7201 1 1279 . 1 1 99 99 ASP HB2 H 1 2.70 0.02 . 1 . . . . 99 ASP HB2 . 7201 1 1280 . 1 1 99 99 ASP HB3 H 1 2.70 0.02 . 1 . . . . 99 ASP HB3 . 7201 1 1281 . 1 1 99 99 ASP C C 13 176.6 0.2 . 1 . . . . 99 ASP C . 7201 1 1282 . 1 1 99 99 ASP CA C 13 55.1 0.2 . 1 . . . . 99 ASP CA . 7201 1 1283 . 1 1 99 99 ASP CB C 13 41.1 0.2 . 1 . . . . 99 ASP CB . 7201 1 1284 . 1 1 99 99 ASP N N 15 122.0 0.2 . 1 . . . . 99 ASP N . 7201 1 1285 . 1 1 100 100 ASN H H 1 8.15 0.02 . 1 . . . . 100 ASN H . 7201 1 1286 . 1 1 100 100 ASN HA H 1 4.67 0.02 . 1 . . . . 100 ASN HA . 7201 1 1287 . 1 1 100 100 ASN HB2 H 1 2.84 0.02 . 1 . . . . 100 ASN HB2 . 7201 1 1288 . 1 1 100 100 ASN HB3 H 1 2.84 0.02 . 1 . . . . 100 ASN HB3 . 7201 1 1289 . 1 1 100 100 ASN HD21 H 1 6.88 0.02 . 2 . . . . 100 ASN HD21 . 7201 1 1290 . 1 1 100 100 ASN HD22 H 1 7.56 0.02 . 2 . . . . 100 ASN HD22 . 7201 1 1291 . 1 1 100 100 ASN C C 13 175.9 0.2 . 1 . . . . 100 ASN C . 7201 1 1292 . 1 1 100 100 ASN CA C 13 53.8 0.2 . 1 . . . . 100 ASN CA . 7201 1 1293 . 1 1 100 100 ASN CB C 13 38.7 0.2 . 1 . . . . 100 ASN CB . 7201 1 1294 . 1 1 100 100 ASN N N 15 118.9 0.2 . 1 . . . . 100 ASN N . 7201 1 1295 . 1 1 100 100 ASN ND2 N 15 112.2 0.2 . 1 . . . . 100 ASN ND2 . 7201 1 1296 . 1 1 101 101 LYS H H 1 8.21 0.02 . 1 . . . . 101 LYS H . 7201 1 1297 . 1 1 101 101 LYS HA H 1 4.25 0.02 . 1 . . . . 101 LYS HA . 7201 1 1298 . 1 1 101 101 LYS HB2 H 1 1.90 0.02 . 1 . . . . 101 LYS HB2 . 7201 1 1299 . 1 1 101 101 LYS HB3 H 1 1.90 0.02 . 1 . . . . 101 LYS HB3 . 7201 1 1300 . 1 1 101 101 LYS HG2 H 1 1.44 0.02 . 1 . . . . 101 LYS HG2 . 7201 1 1301 . 1 1 101 101 LYS HG3 H 1 1.44 0.02 . 1 . . . . 101 LYS HG3 . 7201 1 1302 . 1 1 101 101 LYS HD2 H 1 1.68 0.02 . 1 . . . . 101 LYS HD2 . 7201 1 1303 . 1 1 101 101 LYS HD3 H 1 1.68 0.02 . 1 . . . . 101 LYS HD3 . 7201 1 1304 . 1 1 101 101 LYS HE2 H 1 2.98 0.02 . 1 . . . . 101 LYS HE2 . 7201 1 1305 . 1 1 101 101 LYS HE3 H 1 2.98 0.02 . 1 . . . . 101 LYS HE3 . 7201 1 1306 . 1 1 101 101 LYS C C 13 177.5 0.2 . 1 . . . . 101 LYS C . 7201 1 1307 . 1 1 101 101 LYS CA C 13 57.3 0.2 . 1 . . . . 101 LYS CA . 7201 1 1308 . 1 1 101 101 LYS CB C 13 32.3 0.2 . 1 . . . . 101 LYS CB . 7201 1 1309 . 1 1 101 101 LYS CG C 13 24.8 0.2 . 1 . . . . 101 LYS CG . 7201 1 1310 . 1 1 101 101 LYS CD C 13 28.8 0.2 . 1 . . . . 101 LYS CD . 7201 1 1311 . 1 1 101 101 LYS CE C 13 42.1 0.2 . 1 . . . . 101 LYS CE . 7201 1 1312 . 1 1 101 101 LYS N N 15 120.5 0.2 . 1 . . . . 101 LYS N . 7201 1 1313 . 1 1 102 102 GLY H H 1 8.32 0.02 . 1 . . . . 102 GLY H . 7201 1 1314 . 1 1 102 102 GLY HA2 H 1 3.94 0.02 . 1 . . . . 102 GLY HA2 . 7201 1 1315 . 1 1 102 102 GLY HA3 H 1 3.94 0.02 . 1 . . . . 102 GLY HA3 . 7201 1 1316 . 1 1 102 102 GLY CA C 13 45.8 0.2 . 1 . . . . 102 GLY CA . 7201 1 1317 . 1 1 102 102 GLY N N 15 108.6 0.2 . 1 . . . . 102 GLY N . 7201 1 1318 . 1 1 103 103 GLU H H 1 8.16 0.02 . 1 . . . . 103 GLU H . 7201 1 1319 . 1 1 103 103 GLU HA H 1 4.25 0.02 . 1 . . . . 103 GLU HA . 7201 1 1320 . 1 1 103 103 GLU HB2 H 1 1.97 0.02 . 2 . . . . 103 GLU HB2 . 7201 1 1321 . 1 1 103 103 GLU HB3 H 1 2.07 0.02 . 2 . . . . 103 GLU HB3 . 7201 1 1322 . 1 1 103 103 GLU HG2 H 1 2.28 0.02 . 1 . . . . 103 GLU HG2 . 7201 1 1323 . 1 1 103 103 GLU HG3 H 1 2.28 0.02 . 1 . . . . 103 GLU HG3 . 7201 1 1324 . 1 1 103 103 GLU C C 13 177.0 0.2 . 1 . . . . 103 GLU C . 7201 1 1325 . 1 1 103 103 GLU CA C 13 56.9 0.2 . 1 . . . . 103 GLU CA . 7201 1 1326 . 1 1 103 103 GLU CB C 13 30.1 0.2 . 1 . . . . 103 GLU CB . 7201 1 1327 . 1 1 103 103 GLU CG C 13 36.0 0.2 . 1 . . . . 103 GLU CG . 7201 1 1328 . 1 1 103 103 GLU N N 15 120.5 0.2 . 1 . . . . 103 GLU N . 7201 1 1329 . 1 1 104 104 LEU H H 1 8.16 0.02 . 1 . . . . 104 LEU H . 7201 1 1330 . 1 1 104 104 LEU HA H 1 4.22 0.02 . 1 . . . . 104 LEU HA . 7201 1 1331 . 1 1 104 104 LEU HB2 H 1 1.54 0.02 . 2 . . . . 104 LEU HB2 . 7201 1 1332 . 1 1 104 104 LEU HB3 H 1 1.64 0.02 . 2 . . . . 104 LEU HB3 . 7201 1 1333 . 1 1 104 104 LEU HG H 1 1.62 0.02 . 1 . . . . 104 LEU HG . 7201 1 1334 . 1 1 104 104 LEU HD11 H 1 0.90 0.02 . 2 . . . . 104 LEU HD1 . 7201 1 1335 . 1 1 104 104 LEU HD12 H 1 0.90 0.02 . 2 . . . . 104 LEU HD1 . 7201 1 1336 . 1 1 104 104 LEU HD13 H 1 0.90 0.02 . 2 . . . . 104 LEU HD1 . 7201 1 1337 . 1 1 104 104 LEU HD21 H 1 0.84 0.02 . 2 . . . . 104 LEU HD2 . 7201 1 1338 . 1 1 104 104 LEU HD22 H 1 0.84 0.02 . 2 . . . . 104 LEU HD2 . 7201 1 1339 . 1 1 104 104 LEU HD23 H 1 0.84 0.02 . 2 . . . . 104 LEU HD2 . 7201 1 1340 . 1 1 104 104 LEU C C 13 177.7 0.2 . 1 . . . . 104 LEU C . 7201 1 1341 . 1 1 104 104 LEU CA C 13 55.9 0.2 . 1 . . . . 104 LEU CA . 7201 1 1342 . 1 1 104 104 LEU CB C 13 42.2 0.2 . 1 . . . . 104 LEU CB . 7201 1 1343 . 1 1 104 104 LEU CG C 13 27.0 0.2 . 1 . . . . 104 LEU CG . 7201 1 1344 . 1 1 104 104 LEU CD1 C 13 24.8 0.02 . 2 . . . . 104 LEU CD1 . 7201 1 1345 . 1 1 104 104 LEU CD2 C 13 23.4 0.02 . 2 . . . . 104 LEU CD2 . 7201 1 1346 . 1 1 104 104 LEU N N 15 121.8 0.2 . 1 . . . . 104 LEU N . 7201 1 1347 . 1 1 105 105 GLU H H 1 8.14 0.02 . 1 . . . . 105 GLU H . 7201 1 1348 . 1 1 105 105 GLU C C 13 176.5 0.2 . 1 . . . . 105 GLU C . 7201 1 1349 . 1 1 105 105 GLU CA C 13 56.9 0.2 . 1 . . . . 105 GLU CA . 7201 1 1350 . 1 1 105 105 GLU CB C 13 30.0 0.2 . 1 . . . . 105 GLU CB . 7201 1 1351 . 1 1 105 105 GLU N N 15 119.7 0.2 . 1 . . . . 105 GLU N . 7201 1 1352 . 1 1 106 106 HIS H H 1 8.22 0.02 . 1 . . . . 106 HIS H . 7201 1 1353 . 1 1 106 106 HIS C C 13 173.7 0.2 . 1 . . . . 106 HIS C . 7201 1 1354 . 1 1 106 106 HIS CA C 13 55.7 0.2 . 1 . . . . 106 HIS CA . 7201 1 1355 . 1 1 106 106 HIS CB C 13 29.7 0.2 . 1 . . . . 106 HIS CB . 7201 1 1356 . 1 1 106 106 HIS N N 15 118.3 0.2 . 1 . . . . 106 HIS N . 7201 1 1357 . 1 1 107 107 HIS H H 1 8.25 0.02 . 1 . . . . 107 HIS H . 7201 1 1358 . 1 1 107 107 HIS C C 13 174.6 0.2 . 1 . . . . 107 HIS C . 7201 1 1359 . 1 1 107 107 HIS CA C 13 55.8 0.2 . 1 . . . . 107 HIS CA . 7201 1 1360 . 1 1 107 107 HIS CB C 13 29.2 0.2 . 1 . . . . 107 HIS CB . 7201 1 1361 . 1 1 107 107 HIS N N 15 125.3 0.2 . 1 . . . . 107 HIS N . 7201 1 1362 . 1 1 108 108 HIS H H 1 8.30 0.02 . 1 . . . . 108 HIS H . 7201 1 1363 . 1 1 108 108 HIS C C 13 172.7 0.2 . 1 . . . . 108 HIS C . 7201 1 1364 . 1 1 108 108 HIS CA C 13 44.3 0.2 . 1 . . . . 108 HIS CA . 7201 1 1365 . 1 1 108 108 HIS N N 15 118.8 0.2 . 1 . . . . 108 HIS N . 7201 1 stop_ save_