data_6943 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6943 _Entry.Title ; Resonance Assignment of Bombyx mori Chemosensory Protein 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-01-20 _Entry.Accession_date 2006-01-20 _Entry.Last_release_date . _Entry.Original_release_date . _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 Severine Jansen . . . 6943 2 Lukas Zidek . . . 6943 3 Christer Lofstedt . . . 6943 4 Jean-Francois Picimbon . . . 6943 5 Vladimir Sklenar . . . 6943 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6943 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 477 6943 '15N chemical shifts' 114 6943 '1H chemical shifts' 764 6943 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2007-02-08 2006-01-20 update BMRB 'complete entry citation' 6943 1 . . 2006-08-07 2006-01-20 original author 'original release' 6943 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2JNT 'BMRB Entry Tracking System' 6943 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6943 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16819588 _Citation.Full_citation . _Citation.Title ; 1H, 13C, and 15N Resonance Assignment of Bombyx mori Chemosensory Protein 1 (BmorCSP1). ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _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 47 _Citation.Page_last 47 _Citation.Year 2006 _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 Severine Jansen . . . 6943 1 2 Lukas Zidek . . . 6943 1 3 Christer Lofstedt . . . 6943 1 4 Jean-Francois Picimbon . . . 6943 1 5 Vladimir Sklenar . . . 6943 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6943 _Assembly.ID 1 _Assembly.Name 'chemosensory protein 1' _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 disulfide bound' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'chemosensory protein 1' 1 $chemosensory_protein_1 . . no native no no . . . 6943 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide SING . 1 . 1 CYS 26 26 SG . 1 . 1 CYS 33 33 SG . . . . . . . . . . 6943 1 2 disulfide SING . 1 . 1 CYS 52 52 SG . 1 . 1 CYS 55 55 SG . . . . . . . . . . 6943 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_chemosensory_protein_1 _Entity.Sf_category entity _Entity.Sf_framecode chemosensory_protein_1 _Entity.Entry_ID 6943 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'chemosensory protein 1' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; YTDKYDKINLQEILENKRLL ESYMDCVLGKGKCTPEGKEL KDHLQEALETGCEKCTEAQE KGAETSIDYLIKNELEIWKE LTAHFDPDGKWRKKYEDRAK AKGIVIPE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 108 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _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 2JNT . "Structure Of Bombyx Mori Chemosensory Protein 1 In Solution" . . . . . 100.00 108 100.00 100.00 1.36e-70 . . . . 6943 1 2 no EMBL CAJ01457 . "hypothetical protein [Bombyx mori]" . . . . . 100.00 127 100.00 100.00 5.30e-71 . . . . 6943 1 3 no GB AAM34276 . "chemosensory protein CSP1 [Bombyx mori]" . . . . . 100.00 127 100.00 100.00 5.30e-71 . . . . 6943 1 4 no GB AAV34688 . "chemosensory protein 1 [Bombyx mori]" . . . . . 100.00 114 100.00 100.00 9.69e-71 . . . . 6943 1 5 no GB ABH88197 . "chemosensory protein 4 [Bombyx mori]" . . . . . 100.00 127 100.00 100.00 5.30e-71 . . . . 6943 1 6 no GB ACJ66920 . "chemosensory protein CSP1 [Bombyx mori]" . . . . . 100.00 127 100.00 100.00 5.30e-71 . . . . 6943 1 7 no GB AFD97750 . "chemosensory protein-1 variant, partial [Bombyx mori]" . . . . . 100.00 112 99.07 100.00 5.27e-70 . . . . 6943 1 8 no REF NP_001037052 . "chemosensory protein 4 precursor [Bombyx mori]" . . . . . 100.00 127 100.00 100.00 5.30e-71 . . . . 6943 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 . TYR . 6943 1 2 . THR . 6943 1 3 . ASP . 6943 1 4 . LYS . 6943 1 5 . TYR . 6943 1 6 . ASP . 6943 1 7 . LYS . 6943 1 8 . ILE . 6943 1 9 . ASN . 6943 1 10 . LEU . 6943 1 11 . GLN . 6943 1 12 . GLU . 6943 1 13 . ILE . 6943 1 14 . LEU . 6943 1 15 . GLU . 6943 1 16 . ASN . 6943 1 17 . LYS . 6943 1 18 . ARG . 6943 1 19 . LEU . 6943 1 20 . LEU . 6943 1 21 . GLU . 6943 1 22 . SER . 6943 1 23 . TYR . 6943 1 24 . MET . 6943 1 25 . ASP . 6943 1 26 . CYS . 6943 1 27 . VAL . 6943 1 28 . LEU . 6943 1 29 . GLY . 6943 1 30 . LYS . 6943 1 31 . GLY . 6943 1 32 . LYS . 6943 1 33 . CYS . 6943 1 34 . THR . 6943 1 35 . PRO . 6943 1 36 . GLU . 6943 1 37 . GLY . 6943 1 38 . LYS . 6943 1 39 . GLU . 6943 1 40 . LEU . 6943 1 41 . LYS . 6943 1 42 . ASP . 6943 1 43 . HIS . 6943 1 44 . LEU . 6943 1 45 . GLN . 6943 1 46 . GLU . 6943 1 47 . ALA . 6943 1 48 . LEU . 6943 1 49 . GLU . 6943 1 50 . THR . 6943 1 51 . GLY . 6943 1 52 . CYS . 6943 1 53 . GLU . 6943 1 54 . LYS . 6943 1 55 . CYS . 6943 1 56 . THR . 6943 1 57 . GLU . 6943 1 58 . ALA . 6943 1 59 . GLN . 6943 1 60 . GLU . 6943 1 61 . LYS . 6943 1 62 . GLY . 6943 1 63 . ALA . 6943 1 64 . GLU . 6943 1 65 . THR . 6943 1 66 . SER . 6943 1 67 . ILE . 6943 1 68 . ASP . 6943 1 69 . TYR . 6943 1 70 . LEU . 6943 1 71 . ILE . 6943 1 72 . LYS . 6943 1 73 . ASN . 6943 1 74 . GLU . 6943 1 75 . LEU . 6943 1 76 . GLU . 6943 1 77 . ILE . 6943 1 78 . TRP . 6943 1 79 . LYS . 6943 1 80 . GLU . 6943 1 81 . LEU . 6943 1 82 . THR . 6943 1 83 . ALA . 6943 1 84 . HIS . 6943 1 85 . PHE . 6943 1 86 . ASP . 6943 1 87 . PRO . 6943 1 88 . ASP . 6943 1 89 . GLY . 6943 1 90 . LYS . 6943 1 91 . TRP . 6943 1 92 . ARG . 6943 1 93 . LYS . 6943 1 94 . LYS . 6943 1 95 . TYR . 6943 1 96 . GLU . 6943 1 97 . ASP . 6943 1 98 . ARG . 6943 1 99 . ALA . 6943 1 100 . LYS . 6943 1 101 . ALA . 6943 1 102 . LYS . 6943 1 103 . GLY . 6943 1 104 . ILE . 6943 1 105 . VAL . 6943 1 106 . ILE . 6943 1 107 . PRO . 6943 1 108 . GLU . 6943 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 . TYR 1 1 6943 1 . THR 2 2 6943 1 . ASP 3 3 6943 1 . LYS 4 4 6943 1 . TYR 5 5 6943 1 . ASP 6 6 6943 1 . LYS 7 7 6943 1 . ILE 8 8 6943 1 . ASN 9 9 6943 1 . LEU 10 10 6943 1 . GLN 11 11 6943 1 . GLU 12 12 6943 1 . ILE 13 13 6943 1 . LEU 14 14 6943 1 . GLU 15 15 6943 1 . ASN 16 16 6943 1 . LYS 17 17 6943 1 . ARG 18 18 6943 1 . LEU 19 19 6943 1 . LEU 20 20 6943 1 . GLU 21 21 6943 1 . SER 22 22 6943 1 . TYR 23 23 6943 1 . MET 24 24 6943 1 . ASP 25 25 6943 1 . CYS 26 26 6943 1 . VAL 27 27 6943 1 . LEU 28 28 6943 1 . GLY 29 29 6943 1 . LYS 30 30 6943 1 . GLY 31 31 6943 1 . LYS 32 32 6943 1 . CYS 33 33 6943 1 . THR 34 34 6943 1 . PRO 35 35 6943 1 . GLU 36 36 6943 1 . GLY 37 37 6943 1 . LYS 38 38 6943 1 . GLU 39 39 6943 1 . LEU 40 40 6943 1 . LYS 41 41 6943 1 . ASP 42 42 6943 1 . HIS 43 43 6943 1 . LEU 44 44 6943 1 . GLN 45 45 6943 1 . GLU 46 46 6943 1 . ALA 47 47 6943 1 . LEU 48 48 6943 1 . GLU 49 49 6943 1 . THR 50 50 6943 1 . GLY 51 51 6943 1 . CYS 52 52 6943 1 . GLU 53 53 6943 1 . LYS 54 54 6943 1 . CYS 55 55 6943 1 . THR 56 56 6943 1 . GLU 57 57 6943 1 . ALA 58 58 6943 1 . GLN 59 59 6943 1 . GLU 60 60 6943 1 . LYS 61 61 6943 1 . GLY 62 62 6943 1 . ALA 63 63 6943 1 . GLU 64 64 6943 1 . THR 65 65 6943 1 . SER 66 66 6943 1 . ILE 67 67 6943 1 . ASP 68 68 6943 1 . TYR 69 69 6943 1 . LEU 70 70 6943 1 . ILE 71 71 6943 1 . LYS 72 72 6943 1 . ASN 73 73 6943 1 . GLU 74 74 6943 1 . LEU 75 75 6943 1 . GLU 76 76 6943 1 . ILE 77 77 6943 1 . TRP 78 78 6943 1 . LYS 79 79 6943 1 . GLU 80 80 6943 1 . LEU 81 81 6943 1 . THR 82 82 6943 1 . ALA 83 83 6943 1 . HIS 84 84 6943 1 . PHE 85 85 6943 1 . ASP 86 86 6943 1 . PRO 87 87 6943 1 . ASP 88 88 6943 1 . GLY 89 89 6943 1 . LYS 90 90 6943 1 . TRP 91 91 6943 1 . ARG 92 92 6943 1 . LYS 93 93 6943 1 . LYS 94 94 6943 1 . TYR 95 95 6943 1 . GLU 96 96 6943 1 . ASP 97 97 6943 1 . ARG 98 98 6943 1 . ALA 99 99 6943 1 . LYS 100 100 6943 1 . ALA 101 101 6943 1 . LYS 102 102 6943 1 . GLY 103 103 6943 1 . ILE 104 104 6943 1 . VAL 105 105 6943 1 . ILE 106 106 6943 1 . PRO 107 107 6943 1 . GLU 108 108 6943 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 6943 _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 $chemosensory_protein_1 . 7091 organism . 'Bombyx mori' 'Domestic silkworm' . . Eukaryota Metazoa Bombyx mori . . . antennae . . . . . . . . . . . . . . . . . 6943 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 6943 _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 $chemosensory_protein_1 . 'recombinant technology' . 'E. coli' . . Escherichia coli BL21 . . . . . . . . . . . . plasmid . . pET32a . Novagen . . . . 6943 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6943 _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 'chemosensory protein 1' '[U-95% 13C; U-90% 15N]' . . 1 $chemosensory_protein_1 . protein 1.0 . . mM 0.1 . . . 6943 1 2 'sodium phosphate' . . . . . . buffer 20 . . mM . . . . 6943 1 3 'sodium azide' . . . . . . 'antimicrobial agent' 0.05 . . mM . . . . 6943 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 6943 _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 pH 6.0 0.1 pH 6943 1 temperature 293 1 K 6943 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrpipe _Software.Sf_category software _Software.Sf_framecode nmrpipe _Software.Entry_ID 6943 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 6943 1 stop_ save_ save_sparky _Software.Sf_category software _Software.Sf_framecode sparky _Software.Entry_ID 6943 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'spectra analysis' 6943 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 6943 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6943 _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 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 2 HNCA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 3 HN(CO)CA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 4 HNCACB no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 5 CBCA(CO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 6 HCCH_TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 7 13C15N_edited_NOESY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 8 HNCO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6943 1 stop_ 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 6943 _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 6943 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6943 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6943 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 6943 _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 $sample_1 isotropic 6943 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 TYR C C 13 176.30 0.2 . 1 . . . . 1 Tyr C . 6943 1 2 . 1 1 1 1 TYR CA C 13 56.50 0.2 . 1 . . . . 1 Tyr CA . 6943 1 3 . 1 1 1 1 TYR CB C 13 38.40 0.2 . 1 . . . . 1 Tyr CB . 6943 1 4 . 1 1 2 2 THR H H 1 7.84 0.02 . 1 . . . . 2 Thr H . 6943 1 5 . 1 1 2 2 THR HA H 1 4.32 0.02 . 1 . . . . 2 Thr HA . 6943 1 6 . 1 1 2 2 THR HB H 1 4.20 0.02 . 1 . . . . 2 Thr HB . 6943 1 7 . 1 1 2 2 THR HG21 H 1 1.17 0.02 . 1 . . . . 2 Thr HG2 . 6943 1 8 . 1 1 2 2 THR HG22 H 1 1.17 0.02 . 1 . . . . 2 Thr HG2 . 6943 1 9 . 1 1 2 2 THR HG23 H 1 1.17 0.02 . 1 . . . . 2 Thr HG2 . 6943 1 10 . 1 1 2 2 THR CA C 13 61.90 0.2 . 1 . . . . 2 Thr CA . 6943 1 11 . 1 1 2 2 THR CB C 13 69.90 0.2 . 1 . . . . 2 Thr CB . 6943 1 12 . 1 1 2 2 THR CG2 C 13 21.60 0.2 . 1 . . . . 2 Thr CG2 . 6943 1 13 . 1 1 2 2 THR N N 15 115.50 0.2 . 1 . . . . 2 Thr N . 6943 1 14 . 1 1 3 3 ASP H H 1 8.30 0.02 . 1 . . . . 3 Asp H . 6943 1 15 . 1 1 3 3 ASP HA H 1 4.62 0.02 . 1 . . . . 3 Asp HA . 6943 1 16 . 1 1 3 3 ASP HB2 H 1 2.68 0.02 . 2 . . . . 3 Asp HB2 . 6943 1 17 . 1 1 3 3 ASP HB3 H 1 2.58 0.02 . 2 . . . . 3 Asp HB3 . 6943 1 18 . 1 1 3 3 ASP CA C 13 54.40 0.2 . 1 . . . . 3 Asp CA . 6943 1 19 . 1 1 3 3 ASP CB C 13 41.10 0.2 . 1 . . . . 3 Asp CB . 6943 1 20 . 1 1 3 3 ASP N N 15 123.70 0.2 . 1 . . . . 3 Asp N . 6943 1 21 . 1 1 4 4 LYS H H 1 8.16 0.02 . 1 . . . . 4 Lys H . 6943 1 22 . 1 1 4 4 LYS HA H 1 4.15 0.02 . 1 . . . . 4 Lys HA . 6943 1 23 . 1 1 4 4 LYS HB2 H 1 1.61 0.02 . 1 . . . . 4 Lys HB2 . 6943 1 24 . 1 1 4 4 LYS HB3 H 1 1.61 0.02 . 1 . . . . 4 Lys HB3 . 6943 1 25 . 1 1 4 4 LYS HG2 H 1 1.17 0.02 . 1 . . . . 4 Lys HG2 . 6943 1 26 . 1 1 4 4 LYS HG3 H 1 1.17 0.02 . 1 . . . . 4 Lys HG3 . 6943 1 27 . 1 1 4 4 LYS HD2 H 1 1.55 0.02 . 1 . . . . 4 Lys HD2 . 6943 1 28 . 1 1 4 4 LYS HD3 H 1 1.55 0.02 . 1 . . . . 4 Lys HD3 . 6943 1 29 . 1 1 4 4 LYS HE2 H 1 2.88 0.02 . 1 . . . . 4 Lys HE2 . 6943 1 30 . 1 1 4 4 LYS HE3 H 1 2.88 0.02 . 1 . . . . 4 Lys HE3 . 6943 1 31 . 1 1 4 4 LYS C C 13 176.00 0.2 . 1 . . . . 4 Lys C . 6943 1 32 . 1 1 4 4 LYS CA C 13 56.50 0.2 . 1 . . . . 4 Lys CA . 6943 1 33 . 1 1 4 4 LYS CB C 13 32.90 0.2 . 1 . . . . 4 Lys CB . 6943 1 34 . 1 1 4 4 LYS CG C 13 24.30 0.2 . 1 . . . . 4 Lys CG . 6943 1 35 . 1 1 4 4 LYS CD C 13 29.10 0.2 . 1 . . . . 4 Lys CD . 6943 1 36 . 1 1 4 4 LYS CE C 13 42.00 0.2 . 1 . . . . 4 Lys CE . 6943 1 37 . 1 1 4 4 LYS N N 15 120.80 0.2 . 1 . . . . 4 Lys N . 6943 1 38 . 1 1 5 5 TYR H H 1 8.21 0.02 . 1 . . . . 5 Tyr H . 6943 1 39 . 1 1 5 5 TYR HA H 1 4.52 0.02 . 1 . . . . 5 Tyr HA . 6943 1 40 . 1 1 5 5 TYR HB2 H 1 3.05 0.02 . 2 . . . . 5 Tyr HB2 . 6943 1 41 . 1 1 5 5 TYR HB3 H 1 2.86 0.02 . 2 . . . . 5 Tyr HB3 . 6943 1 42 . 1 1 5 5 TYR HD1 H 1 7.05 0.02 . 1 . . . . 5 Tyr HD1 . 6943 1 43 . 1 1 5 5 TYR HD2 H 1 7.05 0.02 . 1 . . . . 5 Tyr HD2 . 6943 1 44 . 1 1 5 5 TYR HE1 H 1 6.75 0.02 . 1 . . . . 5 Tyr HE1 . 6943 1 45 . 1 1 5 5 TYR HE2 H 1 6.75 0.02 . 1 . . . . 5 Tyr HE2 . 6943 1 46 . 1 1 5 5 TYR C C 13 175.40 0.2 . 1 . . . . 5 Tyr C . 6943 1 47 . 1 1 5 5 TYR CA C 13 57.70 0.2 . 1 . . . . 5 Tyr CA . 6943 1 48 . 1 1 5 5 TYR CB C 13 38.50 0.2 . 1 . . . . 5 Tyr CB . 6943 1 49 . 1 1 5 5 TYR CD1 C 13 133.00 0.2 . 1 . . . . 5 Tyr CD . 6943 1 50 . 1 1 5 5 TYR CD2 C 13 133.00 0.2 . 1 . . . . 5 Tyr CD . 6943 1 51 . 1 1 5 5 TYR CE1 C 13 117.90 0.2 . 1 . . . . 5 Tyr CE . 6943 1 52 . 1 1 5 5 TYR CE2 C 13 117.90 0.2 . 1 . . . . 5 Tyr CE . 6943 1 53 . 1 1 5 5 TYR N N 15 120.90 0.2 . 1 . . . . 5 Tyr N . 6943 1 54 . 1 1 6 6 ASP H H 1 8.19 0.02 . 1 . . . . 6 Asp H . 6943 1 55 . 1 1 6 6 ASP HA H 1 4.52 0.02 . 1 . . . . 6 Asp HA . 6943 1 56 . 1 1 6 6 ASP HB2 H 1 2.57 0.02 . 2 . . . . 6 Asp HB2 . 6943 1 57 . 1 1 6 6 ASP HB3 H 1 2.69 0.02 . 2 . . . . 6 Asp HB3 . 6943 1 58 . 1 1 6 6 ASP CA C 13 54.30 0.2 . 1 . . . . 6 Asp CA . 6943 1 59 . 1 1 6 6 ASP CB C 13 41.00 0.2 . 1 . . . . 6 Asp CB . 6943 1 60 . 1 1 6 6 ASP N N 15 121.60 0.2 . 1 . . . . 6 Asp N . 6943 1 61 . 1 1 7 7 LYS H H 1 8.04 0.02 . 1 . . . . 7 Lys H . 6943 1 62 . 1 1 7 7 LYS HA H 1 4.26 0.02 . 1 . . . . 7 Lys HA . 6943 1 63 . 1 1 7 7 LYS HB2 H 1 1.76 0.02 . 1 . . . . 7 Lys HB2 . 6943 1 64 . 1 1 7 7 LYS HB3 H 1 1.76 0.02 . 1 . . . . 7 Lys HB3 . 6943 1 65 . 1 1 7 7 LYS HG2 H 1 1.35 0.02 . 1 . . . . 7 Lys HG2 . 6943 1 66 . 1 1 7 7 LYS HG3 H 1 1.35 0.02 . 1 . . . . 7 Lys HG3 . 6943 1 67 . 1 1 7 7 LYS HD2 H 1 1.63 0.02 . 1 . . . . 7 Lys HD2 . 6943 1 68 . 1 1 7 7 LYS HD3 H 1 1.63 0.02 . 1 . . . . 7 Lys HD3 . 6943 1 69 . 1 1 7 7 LYS HE2 H 1 2.95 0.02 . 1 . . . . 7 Lys HE2 . 6943 1 70 . 1 1 7 7 LYS HE3 H 1 2.95 0.02 . 1 . . . . 7 Lys HE3 . 6943 1 71 . 1 1 7 7 LYS C C 13 176.40 0.2 . 1 . . . . 7 Lys C . 6943 1 72 . 1 1 7 7 LYS CA C 13 56.10 0.2 . 1 . . . . 7 Lys CA . 6943 1 73 . 1 1 7 7 LYS CB C 13 33.30 0.2 . 1 . . . . 7 Lys CB . 6943 1 74 . 1 1 7 7 LYS CG C 13 24.60 0.2 . 1 . . . . 7 Lys CG . 6943 1 75 . 1 1 7 7 LYS CD C 13 28.90 0.2 . 1 . . . . 7 Lys CD . 6943 1 76 . 1 1 7 7 LYS CE C 13 42.20 0.2 . 1 . . . . 7 Lys CE . 6943 1 77 . 1 1 7 7 LYS N N 15 120.70 0.2 . 1 . . . . 7 Lys N . 6943 1 78 . 1 1 8 8 ILE H H 1 8.22 0.02 . 1 . . . . 8 Ile H . 6943 1 79 . 1 1 8 8 ILE HA H 1 4.02 0.02 . 1 . . . . 8 Ile HA . 6943 1 80 . 1 1 8 8 ILE HB H 1 1.72 0.02 . 1 . . . . 8 Ile HB . 6943 1 81 . 1 1 8 8 ILE HG12 H 1 1.35 0.02 . 2 . . . . 8 Ile HG12 . 6943 1 82 . 1 1 8 8 ILE HG13 H 1 1.06 0.02 . 2 . . . . 8 Ile HG13 . 6943 1 83 . 1 1 8 8 ILE HG21 H 1 0.73 0.02 . 1 . . . . 8 Ile HG2 . 6943 1 84 . 1 1 8 8 ILE HG22 H 1 0.73 0.02 . 1 . . . . 8 Ile HG2 . 6943 1 85 . 1 1 8 8 ILE HG23 H 1 0.73 0.02 . 1 . . . . 8 Ile HG2 . 6943 1 86 . 1 1 8 8 ILE HD11 H 1 0.72 0.02 . 1 . . . . 8 Ile HD1 . 6943 1 87 . 1 1 8 8 ILE HD12 H 1 0.72 0.02 . 1 . . . . 8 Ile HD1 . 6943 1 88 . 1 1 8 8 ILE HD13 H 1 0.72 0.02 . 1 . . . . 8 Ile HD1 . 6943 1 89 . 1 1 8 8 ILE C C 13 174.90 0.2 . 1 . . . . 8 Ile C . 6943 1 90 . 1 1 8 8 ILE CA C 13 61.10 0.2 . 1 . . . . 8 Ile CA . 6943 1 91 . 1 1 8 8 ILE CB C 13 38.90 0.2 . 1 . . . . 8 Ile CB . 6943 1 92 . 1 1 8 8 ILE CG1 C 13 27.40 0.2 . 1 . . . . 8 Ile CG1 . 6943 1 93 . 1 1 8 8 ILE CG2 C 13 17.30 0.2 . 1 . . . . 8 Ile CG2 . 6943 1 94 . 1 1 8 8 ILE CD1 C 13 13.50 0.2 . 1 . . . . 8 Ile CD1 . 6943 1 95 . 1 1 8 8 ILE N N 15 121.60 0.2 . 1 . . . . 8 Ile N . 6943 1 96 . 1 1 9 9 ASN H H 1 8.48 0.02 . 1 . . . . 9 Asn H . 6943 1 97 . 1 1 9 9 ASN HA H 1 4.64 0.02 . 1 . . . . 9 Asn HA . 6943 1 98 . 1 1 9 9 ASN HB2 H 1 2.90 0.02 . 2 . . . . 9 Asn HB2 . 6943 1 99 . 1 1 9 9 ASN HB3 H 1 2.63 0.02 . 2 . . . . 9 Asn HB3 . 6943 1 100 . 1 1 9 9 ASN HD21 H 1 7.57 0.02 . 2 . . . . 9 Asn HD21 . 6943 1 101 . 1 1 9 9 ASN HD22 H 1 6.88 0.02 . 2 . . . . 9 Asn HD22 . 6943 1 102 . 1 1 9 9 ASN C C 13 175.60 0.2 . 1 . . . . 9 Asn C . 6943 1 103 . 1 1 9 9 ASN CA C 13 52.10 0.2 . 1 . . . . 9 Asn CA . 6943 1 104 . 1 1 9 9 ASN CB C 13 38.10 0.2 . 1 . . . . 9 Asn CB . 6943 1 105 . 1 1 9 9 ASN N N 15 123.60 0.2 . 1 . . . . 9 Asn N . 6943 1 106 . 1 1 9 9 ASN ND2 N 15 112.30 0.2 . 1 . . . . 9 Asn ND2 . 6943 1 107 . 1 1 10 10 LEU H H 1 8.28 0.02 . 1 . . . . 10 Leu H . 6943 1 108 . 1 1 10 10 LEU HA H 1 3.78 0.02 . 1 . . . . 10 Leu HA . 6943 1 109 . 1 1 10 10 LEU HB2 H 1 1.45 0.02 . 2 . . . . 10 Leu HB2 . 6943 1 110 . 1 1 10 10 LEU HB3 H 1 1.09 0.02 . 2 . . . . 10 Leu HB3 . 6943 1 111 . 1 1 10 10 LEU HG H 1 1.45 0.02 . 1 . . . . 10 Leu HG . 6943 1 112 . 1 1 10 10 LEU HD11 H 1 0.53 0.02 . 2 . . . . 10 Leu HD1 . 6943 1 113 . 1 1 10 10 LEU HD12 H 1 0.53 0.02 . 2 . . . . 10 Leu HD1 . 6943 1 114 . 1 1 10 10 LEU HD13 H 1 0.53 0.02 . 2 . . . . 10 Leu HD1 . 6943 1 115 . 1 1 10 10 LEU HD21 H 1 0.38 0.02 . 2 . . . . 10 Leu HD2 . 6943 1 116 . 1 1 10 10 LEU HD22 H 1 0.38 0.02 . 2 . . . . 10 Leu HD2 . 6943 1 117 . 1 1 10 10 LEU HD23 H 1 0.38 0.02 . 2 . . . . 10 Leu HD2 . 6943 1 118 . 1 1 10 10 LEU C C 13 176.10 0.2 . 1 . . . . 10 Leu C . 6943 1 119 . 1 1 10 10 LEU CA C 13 57.50 0.2 . 1 . . . . 10 Leu CA . 6943 1 120 . 1 1 10 10 LEU CB C 13 41.30 0.2 . 1 . . . . 10 Leu CB . 6943 1 121 . 1 1 10 10 LEU CG C 13 26.60 0.2 . 1 . . . . 10 Leu CG . 6943 1 122 . 1 1 10 10 LEU CD1 C 13 23.30 0.2 . 2 . . . . 10 Leu CD1 . 6943 1 123 . 1 1 10 10 LEU CD2 C 13 24.60 0.2 . 2 . . . . 10 Leu CD2 . 6943 1 124 . 1 1 10 10 LEU N N 15 123.80 0.2 . 1 . . . . 10 Leu N . 6943 1 125 . 1 1 11 11 GLN H H 1 7.92 0.02 . 1 . . . . 11 Gln H . 6943 1 126 . 1 1 11 11 GLN HA H 1 3.62 0.02 . 1 . . . . 11 Gln HA . 6943 1 127 . 1 1 11 11 GLN HB2 H 1 1.96 0.02 . 2 . . . . 11 Gln HB2 . 6943 1 128 . 1 1 11 11 GLN HB3 H 1 1.84 0.02 . 2 . . . . 11 Gln HB3 . 6943 1 129 . 1 1 11 11 GLN HG2 H 1 2.16 0.02 . 1 . . . . 11 Gln HG2 . 6943 1 130 . 1 1 11 11 GLN HG3 H 1 2.16 0.02 . 1 . . . . 11 Gln HG3 . 6943 1 131 . 1 1 11 11 GLN HE21 H 1 7.84 0.02 . 2 . . . . 11 Gln HE21 . 6943 1 132 . 1 1 11 11 GLN HE22 H 1 5.79 0.02 . 2 . . . . 11 Gln HE22 . 6943 1 133 . 1 1 11 11 GLN C C 13 177.20 0.2 . 1 . . . . 11 Gln C . 6943 1 134 . 1 1 11 11 GLN CA C 13 58.80 0.2 . 1 . . . . 11 Gln CA . 6943 1 135 . 1 1 11 11 GLN CB C 13 27.30 0.2 . 1 . . . . 11 Gln CB . 6943 1 136 . 1 1 11 11 GLN CG C 13 32.80 0.2 . 1 . . . . 11 Gln CG . 6943 1 137 . 1 1 11 11 GLN N N 15 118.50 0.2 . 1 . . . . 11 Gln N . 6943 1 138 . 1 1 11 11 GLN NE2 N 15 110.50 0.2 . 1 . . . . 11 Gln NE2 . 6943 1 139 . 1 1 12 12 GLU H H 1 7.25 0.02 . 1 . . . . 12 Glu H . 6943 1 140 . 1 1 12 12 GLU HA H 1 3.83 0.02 . 1 . . . . 12 Glu HA . 6943 1 141 . 1 1 12 12 GLU HB2 H 1 1.93 0.02 . 2 . . . . 12 Glu HB2 . 6943 1 142 . 1 1 12 12 GLU HG2 H 1 2.17 0.02 . 1 . . . . 12 Glu HG2 . 6943 1 143 . 1 1 12 12 GLU HG3 H 1 2.17 0.02 . 1 . . . . 12 Glu HG3 . 6943 1 144 . 1 1 12 12 GLU C C 13 178.90 0.2 . 1 . . . . 12 Glu C . 6943 1 145 . 1 1 12 12 GLU CA C 13 58.50 0.2 . 1 . . . . 12 Glu CA . 6943 1 146 . 1 1 12 12 GLU CB C 13 29.60 0.2 . 1 . . . . 12 Glu CB . 6943 1 147 . 1 1 12 12 GLU CG C 13 36.60 0.2 . 1 . . . . 12 Glu CG . 6943 1 148 . 1 1 12 12 GLU N N 15 115.70 0.2 . 1 . . . . 12 Glu N . 6943 1 149 . 1 1 13 13 ILE H H 1 7.10 0.02 . 1 . . . . 13 Ile H . 6943 1 150 . 1 1 13 13 ILE HA H 1 3.63 0.02 . 1 . . . . 13 Ile HA . 6943 1 151 . 1 1 13 13 ILE HB H 1 1.87 0.02 . 1 . . . . 13 Ile HB . 6943 1 152 . 1 1 13 13 ILE HG12 H 1 1.69 0.02 . 2 . . . . 13 Ile HG12 . 6943 1 153 . 1 1 13 13 ILE HG13 H 1 0.94 0.02 . 2 . . . . 13 Ile HG13 . 6943 1 154 . 1 1 13 13 ILE HG21 H 1 0.74 0.02 . 1 . . . . 13 Ile HG2 . 6943 1 155 . 1 1 13 13 ILE HG22 H 1 0.74 0.02 . 1 . . . . 13 Ile HG2 . 6943 1 156 . 1 1 13 13 ILE HG23 H 1 0.74 0.02 . 1 . . . . 13 Ile HG2 . 6943 1 157 . 1 1 13 13 ILE HD11 H 1 0.67 0.02 . 1 . . . . 13 Ile HD1 . 6943 1 158 . 1 1 13 13 ILE HD12 H 1 0.67 0.02 . 1 . . . . 13 Ile HD1 . 6943 1 159 . 1 1 13 13 ILE HD13 H 1 0.67 0.02 . 1 . . . . 13 Ile HD1 . 6943 1 160 . 1 1 13 13 ILE C C 13 176.40 0.2 . 1 . . . . 13 Ile C . 6943 1 161 . 1 1 13 13 ILE CA C 13 64.90 0.2 . 1 . . . . 13 Ile CA . 6943 1 162 . 1 1 13 13 ILE CB C 13 38.00 0.2 . 1 . . . . 13 Ile CB . 6943 1 163 . 1 1 13 13 ILE CG1 C 13 28.50 0.2 . 1 . . . . 13 Ile CG1 . 6943 1 164 . 1 1 13 13 ILE CG2 C 13 18.00 0.2 . 1 . . . . 13 Ile CG2 . 6943 1 165 . 1 1 13 13 ILE CD1 C 13 14.00 0.2 . 1 . . . . 13 Ile CD1 . 6943 1 166 . 1 1 13 13 ILE N N 15 117.90 0.2 . 1 . . . . 13 Ile N . 6943 1 167 . 1 1 14 14 LEU H H 1 7.52 0.02 . 1 . . . . 14 Leu H . 6943 1 168 . 1 1 14 14 LEU HA H 1 3.78 0.02 . 1 . . . . 14 Leu HA . 6943 1 169 . 1 1 14 14 LEU HB2 H 1 1.45 0.02 . 2 . . . . 14 Leu HB2 . 6943 1 170 . 1 1 14 14 LEU HB3 H 1 1.10 0.02 . 2 . . . . 14 Leu HB3 . 6943 1 171 . 1 1 14 14 LEU HG H 1 1.76 0.02 . 1 . . . . 14 Leu HG . 6943 1 172 . 1 1 14 14 LEU HD11 H 1 0.84 0.02 . 2 . . . . 14 Leu HD1 . 6943 1 173 . 1 1 14 14 LEU HD12 H 1 0.84 0.02 . 2 . . . . 14 Leu HD1 . 6943 1 174 . 1 1 14 14 LEU HD13 H 1 0.84 0.02 . 2 . . . . 14 Leu HD1 . 6943 1 175 . 1 1 14 14 LEU HD21 H 1 0.84 0.02 . 2 . . . . 14 Leu HD2 . 6943 1 176 . 1 1 14 14 LEU HD22 H 1 0.84 0.02 . 2 . . . . 14 Leu HD2 . 6943 1 177 . 1 1 14 14 LEU HD23 H 1 0.84 0.02 . 2 . . . . 14 Leu HD2 . 6943 1 178 . 1 1 14 14 LEU C C 13 177.10 0.2 . 1 . . . . 14 Leu C . 6943 1 179 . 1 1 14 14 LEU CA C 13 57.70 0.2 . 1 . . . . 14 Leu CA . 6943 1 180 . 1 1 14 14 LEU CB C 13 41.40 0.2 . 1 . . . . 14 Leu CB . 6943 1 181 . 1 1 14 14 LEU CG C 13 26.90 0.2 . 1 . . . . 14 Leu CG . 6943 1 182 . 1 1 14 14 LEU CD1 C 13 26.00 0.2 . 2 . . . . 14 Leu CD1 . 6943 1 183 . 1 1 14 14 LEU CD2 C 13 24.10 0.2 . 2 . . . . 14 Leu CD2 . 6943 1 184 . 1 1 14 14 LEU N N 15 114.90 0.2 . 1 . . . . 14 Leu N . 6943 1 185 . 1 1 15 15 GLU H H 1 7.17 0.02 . 1 . . . . 15 Glu H . 6943 1 186 . 1 1 15 15 GLU HA H 1 4.01 0.02 . 1 . . . . 15 Glu HA . 6943 1 187 . 1 1 15 15 GLU HB2 H 1 2.01 0.02 . 2 . . . . 15 Glu HB2 . 6943 1 188 . 1 1 15 15 GLU HB3 H 1 1.66 0.02 . 2 . . . . 15 Glu HB3 . 6943 1 189 . 1 1 15 15 GLU HG2 H 1 2.14 0.02 . 2 . . . . 15 Glu HG2 . 6943 1 190 . 1 1 15 15 GLU HG3 H 1 2.12 0.02 . 2 . . . . 15 Glu HG3 . 6943 1 191 . 1 1 15 15 GLU C C 13 175.40 0.2 . 1 . . . . 15 Glu C . 6943 1 192 . 1 1 15 15 GLU CA C 13 56.40 0.2 . 1 . . . . 15 Glu CA . 6943 1 193 . 1 1 15 15 GLU CB C 13 29.40 0.2 . 1 . . . . 15 Glu CB . 6943 1 194 . 1 1 15 15 GLU CG C 13 36.40 0.2 . 1 . . . . 15 Glu CG . 6943 1 195 . 1 1 15 15 GLU N N 15 110.20 0.2 . 1 . . . . 15 Glu N . 6943 1 196 . 1 1 16 16 ASN H H 1 7.43 0.02 . 1 . . . . 16 Asn H . 6943 1 197 . 1 1 16 16 ASN HA H 1 4.83 0.02 . 1 . . . . 16 Asn HA . 6943 1 198 . 1 1 16 16 ASN HB2 H 1 3.24 0.02 . 2 . . . . 16 Asn HB2 . 6943 1 199 . 1 1 16 16 ASN HB3 H 1 2.64 0.02 . 2 . . . . 16 Asn HB3 . 6943 1 200 . 1 1 16 16 ASN HD21 H 1 7.93 0.02 . 2 . . . . 16 Asn HD21 . 6943 1 201 . 1 1 16 16 ASN HD22 H 1 6.81 0.02 . 2 . . . . 16 Asn HD22 . 6943 1 202 . 1 1 16 16 ASN C C 13 173.60 0.2 . 1 . . . . 16 Asn C . 6943 1 203 . 1 1 16 16 ASN CA C 13 51.20 0.2 . 1 . . . . 16 Asn CA . 6943 1 204 . 1 1 16 16 ASN CB C 13 38.60 0.2 . 1 . . . . 16 Asn CB . 6943 1 205 . 1 1 16 16 ASN N N 15 120.30 0.2 . 1 . . . . 16 Asn N . 6943 1 206 . 1 1 16 16 ASN ND2 N 15 112.80 0.2 . 1 . . . . 16 Asn ND2 . 6943 1 207 . 1 1 17 17 LYS H H 1 8.37 0.02 . 1 . . . . 17 Lys H . 6943 1 208 . 1 1 17 17 LYS HA H 1 3.86 0.02 . 1 . . . . 17 Lys HA . 6943 1 209 . 1 1 17 17 LYS HB2 H 1 1.96 0.02 . 2 . . . . 17 Lys HB2 . 6943 1 210 . 1 1 17 17 LYS HB3 H 1 1.80 0.02 . 2 . . . . 17 Lys HB3 . 6943 1 211 . 1 1 17 17 LYS HG2 H 1 1.49 0.02 . 1 . . . . 17 Lys HG2 . 6943 1 212 . 1 1 17 17 LYS HG3 H 1 1.49 0.02 . 1 . . . . 17 Lys HG3 . 6943 1 213 . 1 1 17 17 LYS HD2 H 1 1.79 0.02 . 2 . . . . 17 Lys HD2 . 6943 1 214 . 1 1 17 17 LYS HD3 H 1 1.50 0.02 . 2 . . . . 17 Lys HD3 . 6943 1 215 . 1 1 17 17 LYS HE2 H 1 3.03 0.02 . 2 . . . . 17 Lys HE2 . 6943 1 216 . 1 1 17 17 LYS HE3 H 1 3.05 0.02 . 2 . . . . 17 Lys HE3 . 6943 1 217 . 1 1 17 17 LYS C C 13 177.70 0.2 . 1 . . . . 17 Lys C . 6943 1 218 . 1 1 17 17 LYS CA C 13 60.10 0.2 . 1 . . . . 17 Lys CA . 6943 1 219 . 1 1 17 17 LYS CB C 13 32.60 0.2 . 1 . . . . 17 Lys CB . 6943 1 220 . 1 1 17 17 LYS CG C 13 24.40 0.2 . 1 . . . . 17 Lys CG . 6943 1 221 . 1 1 17 17 LYS CD C 13 28.70 0.2 . 1 . . . . 17 Lys CD . 6943 1 222 . 1 1 17 17 LYS CE C 13 42.10 0.2 . 1 . . . . 17 Lys CE . 6943 1 223 . 1 1 17 17 LYS N N 15 124.80 0.2 . 1 . . . . 17 Lys N . 6943 1 224 . 1 1 18 18 ARG H H 1 8.18 0.02 . 1 . . . . 18 Arg H . 6943 1 225 . 1 1 18 18 ARG HA H 1 4.13 0.02 . 1 . . . . 18 Arg HA . 6943 1 226 . 1 1 18 18 ARG HB2 H 1 1.86 0.02 . 2 . . . . 18 Arg HB2 . 6943 1 227 . 1 1 18 18 ARG HB3 H 1 1.82 0.02 . 2 . . . . 18 Arg HB3 . 6943 1 228 . 1 1 18 18 ARG HG2 H 1 1.71 0.02 . 2 . . . . 18 Arg HG2 . 6943 1 229 . 1 1 18 18 ARG HG3 H 1 1.64 0.02 . 2 . . . . 18 Arg HG3 . 6943 1 230 . 1 1 18 18 ARG HD2 H 1 3.23 0.02 . 2 . . . . 18 Arg HD2 . 6943 1 231 . 1 1 18 18 ARG HD3 H 1 3.19 0.02 . 2 . . . . 18 Arg HD3 . 6943 1 232 . 1 1 18 18 ARG HE H 1 7.31 0.02 . 1 . . . . 18 Arg HE . 6943 1 233 . 1 1 18 18 ARG C C 13 179.50 0.2 . 1 . . . . 18 Arg C . 6943 1 234 . 1 1 18 18 ARG CA C 13 58.70 0.2 . 1 . . . . 18 Arg CA . 6943 1 235 . 1 1 18 18 ARG CB C 13 29.70 0.2 . 1 . . . . 18 Arg CB . 6943 1 236 . 1 1 18 18 ARG CG C 13 27.00 0.2 . 1 . . . . 18 Arg CG . 6943 1 237 . 1 1 18 18 ARG CD C 13 43.00 0.2 . 1 . . . . 18 Arg CD . 6943 1 238 . 1 1 18 18 ARG N N 15 115.50 0.2 . 1 . . . . 18 Arg N . 6943 1 239 . 1 1 18 18 ARG NE N 15 84.30 0.2 . 1 . . . . 18 Arg NE . 6943 1 240 . 1 1 19 19 LEU H H 1 7.45 0.02 . 1 . . . . 19 Leu H . 6943 1 241 . 1 1 19 19 LEU HA H 1 3.95 0.02 . 1 . . . . 19 Leu HA . 6943 1 242 . 1 1 19 19 LEU HB2 H 1 1.63 0.02 . 2 . . . . 19 Leu HB2 . 6943 1 243 . 1 1 19 19 LEU HB3 H 1 1.60 0.02 . 2 . . . . 19 Leu HB3 . 6943 1 244 . 1 1 19 19 LEU HG H 1 1.29 0.02 . 1 . . . . 19 Leu HG . 6943 1 245 . 1 1 19 19 LEU HD11 H 1 0.86 0.02 . 2 . . . . 19 Leu HD1 . 6943 1 246 . 1 1 19 19 LEU HD12 H 1 0.86 0.02 . 2 . . . . 19 Leu HD1 . 6943 1 247 . 1 1 19 19 LEU HD13 H 1 0.86 0.02 . 2 . . . . 19 Leu HD1 . 6943 1 248 . 1 1 19 19 LEU HD21 H 1 0.76 0.02 . 2 . . . . 19 Leu HD2 . 6943 1 249 . 1 1 19 19 LEU HD22 H 1 0.76 0.02 . 2 . . . . 19 Leu HD2 . 6943 1 250 . 1 1 19 19 LEU HD23 H 1 0.76 0.02 . 2 . . . . 19 Leu HD2 . 6943 1 251 . 1 1 19 19 LEU C C 13 179.10 0.2 . 1 . . . . 19 Leu C . 6943 1 252 . 1 1 19 19 LEU CA C 13 56.80 0.2 . 1 . . . . 19 Leu CA . 6943 1 253 . 1 1 19 19 LEU CB C 13 42.00 0.2 . 1 . . . . 19 Leu CB . 6943 1 254 . 1 1 19 19 LEU CG C 13 26.70 0.2 . 1 . . . . 19 Leu CG . 6943 1 255 . 1 1 19 19 LEU CD1 C 13 25.00 0.2 . 2 . . . . 19 Leu CD1 . 6943 1 256 . 1 1 19 19 LEU CD2 C 13 23.70 0.2 . 2 . . . . 19 Leu CD2 . 6943 1 257 . 1 1 19 19 LEU N N 15 121.90 0.2 . 1 . . . . 19 Leu N . 6943 1 258 . 1 1 20 20 LEU H H 1 8.82 0.02 . 1 . . . . 20 Leu H . 6943 1 259 . 1 1 20 20 LEU HA H 1 3.78 0.02 . 1 . . . . 20 Leu HA . 6943 1 260 . 1 1 20 20 LEU HB2 H 1 1.93 0.02 . 2 . . . . 20 Leu HB2 . 6943 1 261 . 1 1 20 20 LEU HB3 H 1 1.91 0.02 . 2 . . . . 20 Leu HB3 . 6943 1 262 . 1 1 20 20 LEU HG H 1 1.51 0.02 . 1 . . . . 20 Leu HG . 6943 1 263 . 1 1 20 20 LEU HD11 H 1 1.06 0.02 . 2 . . . . 20 Leu HD1 . 6943 1 264 . 1 1 20 20 LEU HD12 H 1 1.06 0.02 . 2 . . . . 20 Leu HD1 . 6943 1 265 . 1 1 20 20 LEU HD13 H 1 1.06 0.02 . 2 . . . . 20 Leu HD1 . 6943 1 266 . 1 1 20 20 LEU HD21 H 1 0.92 0.02 . 2 . . . . 20 Leu HD2 . 6943 1 267 . 1 1 20 20 LEU HD22 H 1 0.92 0.02 . 2 . . . . 20 Leu HD2 . 6943 1 268 . 1 1 20 20 LEU HD23 H 1 0.92 0.02 . 2 . . . . 20 Leu HD2 . 6943 1 269 . 1 1 20 20 LEU C C 13 179.20 0.2 . 1 . . . . 20 Leu C . 6943 1 270 . 1 1 20 20 LEU CA C 13 59.10 0.2 . 1 . . . . 20 Leu CA . 6943 1 271 . 1 1 20 20 LEU CB C 13 40.80 0.2 . 1 . . . . 20 Leu CB . 6943 1 272 . 1 1 20 20 LEU CG C 13 27.30 0.2 . 1 . . . . 20 Leu CG . 6943 1 273 . 1 1 20 20 LEU CD1 C 13 26.20 0.2 . 2 . . . . 20 Leu CD1 . 6943 1 274 . 1 1 20 20 LEU CD2 C 13 23.30 0.2 . 2 . . . . 20 Leu CD2 . 6943 1 275 . 1 1 20 20 LEU N N 15 122.20 0.2 . 1 . . . . 20 Leu N . 6943 1 276 . 1 1 21 21 GLU H H 1 8.49 0.02 . 1 . . . . 21 Glu H . 6943 1 277 . 1 1 21 21 GLU HA H 1 3.83 0.02 . 1 . . . . 21 Glu HA . 6943 1 278 . 1 1 21 21 GLU HB2 H 1 2.13 0.02 . 2 . . . . 21 Glu HB2 . 6943 1 279 . 1 1 21 21 GLU HB3 H 1 1.97 0.02 . 2 . . . . 21 Glu HB3 . 6943 1 280 . 1 1 21 21 GLU HG2 H 1 2.49 0.02 . 2 . . . . 21 Glu HG2 . 6943 1 281 . 1 1 21 21 GLU HG3 H 1 2.17 0.02 . 2 . . . . 21 Glu HG3 . 6943 1 282 . 1 1 21 21 GLU C C 13 179.80 0.2 . 1 . . . . 21 Glu C . 6943 1 283 . 1 1 21 21 GLU CA C 13 59.90 0.2 . 1 . . . . 21 Glu CA . 6943 1 284 . 1 1 21 21 GLU CB C 13 29.40 0.2 . 1 . . . . 21 Glu CB . 6943 1 285 . 1 1 21 21 GLU CG C 13 37.10 0.2 . 1 . . . . 21 Glu CG . 6943 1 286 . 1 1 21 21 GLU N N 15 115.20 0.2 . 1 . . . . 21 Glu N . 6943 1 287 . 1 1 22 22 SER H H 1 7.71 0.02 . 1 . . . . 22 Ser H . 6943 1 288 . 1 1 22 22 SER HA H 1 4.33 0.02 . 1 . . . . 22 Ser HA . 6943 1 289 . 1 1 22 22 SER HB2 H 1 3.92 0.02 . 1 . . . . 22 Ser HB2 . 6943 1 290 . 1 1 22 22 SER HB3 H 1 3.92 0.02 . 1 . . . . 22 Ser HB3 . 6943 1 291 . 1 1 22 22 SER C C 13 175.90 0.2 . 1 . . . . 22 Ser C . 6943 1 292 . 1 1 22 22 SER CA C 13 61.00 0.2 . 1 . . . . 22 Ser CA . 6943 1 293 . 1 1 22 22 SER CB C 13 62.90 0.2 . 1 . . . . 22 Ser CB . 6943 1 294 . 1 1 22 22 SER N N 15 115.80 0.2 . 1 . . . . 22 Ser N . 6943 1 295 . 1 1 23 23 TYR H H 1 7.87 0.02 . 1 . . . . 23 Tyr H . 6943 1 296 . 1 1 23 23 TYR HA H 1 4.91 0.02 . 1 . . . . 23 Tyr HA . 6943 1 297 . 1 1 23 23 TYR HB2 H 1 3.22 0.02 . 2 . . . . 23 Tyr HB2 . 6943 1 298 . 1 1 23 23 TYR HB3 H 1 2.88 0.02 . 2 . . . . 23 Tyr HB3 . 6943 1 299 . 1 1 23 23 TYR HD1 H 1 6.96 0.02 . 1 . . . . 23 Tyr HD1 . 6943 1 300 . 1 1 23 23 TYR HD2 H 1 6.96 0.02 . 1 . . . . 23 Tyr HD2 . 6943 1 301 . 1 1 23 23 TYR HE1 H 1 6.58 0.02 . 1 . . . . 23 Tyr HE1 . 6943 1 302 . 1 1 23 23 TYR HE2 H 1 6.58 0.02 . 1 . . . . 23 Tyr HE2 . 6943 1 303 . 1 1 23 23 TYR C C 13 177.10 0.2 . 1 . . . . 23 Tyr C . 6943 1 304 . 1 1 23 23 TYR CA C 13 57.50 0.2 . 1 . . . . 23 Tyr CA . 6943 1 305 . 1 1 23 23 TYR CB C 13 39.40 0.2 . 1 . . . . 23 Tyr CB . 6943 1 306 . 1 1 23 23 TYR CD1 C 13 131.40 0.2 . 1 . . . . 23 Tyr CD . 6943 1 307 . 1 1 23 23 TYR CD2 C 13 131.40 0.2 . 1 . . . . 23 Tyr CD . 6943 1 308 . 1 1 23 23 TYR CE1 C 13 117.30 0.2 . 1 . . . . 23 Tyr CE . 6943 1 309 . 1 1 23 23 TYR CE2 C 13 117.30 0.2 . 1 . . . . 23 Tyr CE . 6943 1 310 . 1 1 23 23 TYR N N 15 121.30 0.2 . 1 . . . . 23 Tyr N . 6943 1 311 . 1 1 24 24 MET H H 1 7.75 0.02 . 1 . . . . 24 Met H . 6943 1 312 . 1 1 24 24 MET HA H 1 4.43 0.02 . 1 . . . . 24 Met HA . 6943 1 313 . 1 1 24 24 MET HB2 H 1 2.23 0.02 . 1 . . . . 24 Met HB2 . 6943 1 314 . 1 1 24 24 MET HB3 H 1 2.23 0.02 . 1 . . . . 24 Met HB3 . 6943 1 315 . 1 1 24 24 MET HG2 H 1 1.93 0.02 . 1 . . . . 24 Met HG2 . 6943 1 316 . 1 1 24 24 MET HG3 H 1 1.93 0.02 . 1 . . . . 24 Met HG3 . 6943 1 317 . 1 1 24 24 MET C C 13 177.90 0.2 . 1 . . . . 24 Met C . 6943 1 318 . 1 1 24 24 MET CA C 13 57.30 0.2 . 1 . . . . 24 Met CA . 6943 1 319 . 1 1 24 24 MET CB C 13 30.30 0.2 . 1 . . . . 24 Met CB . 6943 1 320 . 1 1 24 24 MET CG C 13 30.20 0.2 . 1 . . . . 24 Met CG . 6943 1 321 . 1 1 24 24 MET N N 15 120.90 0.2 . 1 . . . . 24 Met N . 6943 1 322 . 1 1 25 25 ASP H H 1 8.63 0.02 . 1 . . . . 25 Asp H . 6943 1 323 . 1 1 25 25 ASP HA H 1 4.20 0.02 . 1 . . . . 25 Asp HA . 6943 1 324 . 1 1 25 25 ASP HB2 H 1 2.71 0.02 . 2 . . . . 25 Asp HB2 . 6943 1 325 . 1 1 25 25 ASP HB3 H 1 2.11 0.02 . 2 . . . . 25 Asp HB3 . 6943 1 326 . 1 1 25 25 ASP C C 13 178.60 0.2 . 1 . . . . 25 Asp C . 6943 1 327 . 1 1 25 25 ASP CA C 13 58.00 0.2 . 1 . . . . 25 Asp CA . 6943 1 328 . 1 1 25 25 ASP CB C 13 38.90 0.2 . 1 . . . . 25 Asp CB . 6943 1 329 . 1 1 25 25 ASP N N 15 119.50 0.2 . 1 . . . . 25 Asp N . 6943 1 330 . 1 1 26 26 CYS H H 1 7.84 0.02 . 1 . . . . 26 Cys H . 6943 1 331 . 1 1 26 26 CYS HA H 1 4.37 0.02 . 1 . . . . 26 Cys HA . 6943 1 332 . 1 1 26 26 CYS HB2 H 1 3.51 0.02 . 2 . . . . 26 Cys HB2 . 6943 1 333 . 1 1 26 26 CYS HB3 H 1 3.30 0.02 . 2 . . . . 26 Cys HB3 . 6943 1 334 . 1 1 26 26 CYS C C 13 177.90 0.2 . 1 . . . . 26 Cys C . 6943 1 335 . 1 1 26 26 CYS CA C 13 58.60 0.2 . 1 . . . . 26 Cys CA . 6943 1 336 . 1 1 26 26 CYS CB C 13 39.90 0.2 . 1 . . . . 26 Cys CB . 6943 1 337 . 1 1 26 26 CYS N N 15 119.40 0.2 . 1 . . . . 26 Cys N . 6943 1 338 . 1 1 27 27 VAL H H 1 8.36 0.02 . 1 . . . . 27 Val H . 6943 1 339 . 1 1 27 27 VAL HA H 1 3.42 0.02 . 1 . . . . 27 Val HA . 6943 1 340 . 1 1 27 27 VAL HB H 1 2.29 0.02 . 1 . . . . 27 Val HB . 6943 1 341 . 1 1 27 27 VAL HG11 H 1 1.06 0.02 . 2 . . . . 27 Val HG1 . 6943 1 342 . 1 1 27 27 VAL HG12 H 1 1.06 0.02 . 2 . . . . 27 Val HG1 . 6943 1 343 . 1 1 27 27 VAL HG13 H 1 1.06 0.02 . 2 . . . . 27 Val HG1 . 6943 1 344 . 1 1 27 27 VAL HG21 H 1 0.99 0.02 . 2 . . . . 27 Val HG2 . 6943 1 345 . 1 1 27 27 VAL HG22 H 1 0.99 0.02 . 2 . . . . 27 Val HG2 . 6943 1 346 . 1 1 27 27 VAL HG23 H 1 0.99 0.02 . 2 . . . . 27 Val HG2 . 6943 1 347 . 1 1 27 27 VAL C C 13 176.30 0.2 . 1 . . . . 27 Val C . 6943 1 348 . 1 1 27 27 VAL CA C 13 66.70 0.2 . 1 . . . . 27 Val CA . 6943 1 349 . 1 1 27 27 VAL CB C 13 31.50 0.2 . 1 . . . . 27 Val CB . 6943 1 350 . 1 1 27 27 VAL CG1 C 13 23.30 0.2 . 2 . . . . 27 Val CG1 . 6943 1 351 . 1 1 27 27 VAL CG2 C 13 22.70 0.2 . 2 . . . . 27 Val CG2 . 6943 1 352 . 1 1 27 27 VAL N N 15 121.20 0.2 . 1 . . . . 27 Val N . 6943 1 353 . 1 1 28 28 LEU H H 1 8.22 0.02 . 1 . . . . 28 Leu H . 6943 1 354 . 1 1 28 28 LEU HA H 1 3.35 0.02 . 1 . . . . 28 Leu HA . 6943 1 355 . 1 1 28 28 LEU HB2 H 1 1.52 0.02 . 2 . . . . 28 Leu HB2 . 6943 1 356 . 1 1 28 28 LEU HB3 H 1 1.16 0.02 . 2 . . . . 28 Leu HB3 . 6943 1 357 . 1 1 28 28 LEU HG H 1 1.56 0.02 . 1 . . . . 28 Leu HG . 6943 1 358 . 1 1 28 28 LEU HD11 H 1 0.69 0.02 . 2 . . . . 28 Leu HD1 . 6943 1 359 . 1 1 28 28 LEU HD12 H 1 0.69 0.02 . 2 . . . . 28 Leu HD1 . 6943 1 360 . 1 1 28 28 LEU HD13 H 1 0.69 0.02 . 2 . . . . 28 Leu HD1 . 6943 1 361 . 1 1 28 28 LEU HD21 H 1 0.27 0.02 . 2 . . . . 28 Leu HD2 . 6943 1 362 . 1 1 28 28 LEU HD22 H 1 0.27 0.02 . 2 . . . . 28 Leu HD2 . 6943 1 363 . 1 1 28 28 LEU HD23 H 1 0.27 0.02 . 2 . . . . 28 Leu HD2 . 6943 1 364 . 1 1 28 28 LEU C C 13 176.60 0.2 . 1 . . . . 28 Leu C . 6943 1 365 . 1 1 28 28 LEU CA C 13 54.20 0.2 . 1 . . . . 28 Leu CA . 6943 1 366 . 1 1 28 28 LEU CB C 13 41.70 0.2 . 1 . . . . 28 Leu CB . 6943 1 367 . 1 1 28 28 LEU CG C 13 26.50 0.2 . 1 . . . . 28 Leu CG . 6943 1 368 . 1 1 28 28 LEU CD1 C 13 25.60 0.2 . 2 . . . . 28 Leu CD1 . 6943 1 369 . 1 1 28 28 LEU CD2 C 13 22.30 0.2 . 2 . . . . 28 Leu CD2 . 6943 1 370 . 1 1 28 28 LEU N N 15 113.50 0.2 . 1 . . . . 28 Leu N . 6943 1 371 . 1 1 29 29 GLY H H 1 7.71 0.02 . 1 . . . . 29 Gly H . 6943 1 372 . 1 1 29 29 GLY HA2 H 1 4.08 0.02 . 2 . . . . 29 Gly HA2 . 6943 1 373 . 1 1 29 29 GLY HA3 H 1 4.05 0.02 . 2 . . . . 29 Gly HA3 . 6943 1 374 . 1 1 29 29 GLY C C 13 175.00 0.2 . 1 . . . . 29 Gly C . 6943 1 375 . 1 1 29 29 GLY CA C 13 46.30 0.2 . 1 . . . . 29 Gly CA . 6943 1 376 . 1 1 29 29 GLY N N 15 107.10 0.2 . 1 . . . . 29 Gly N . 6943 1 377 . 1 1 30 30 LYS H H 1 8.54 0.02 . 1 . . . . 30 Lys H . 6943 1 378 . 1 1 30 30 LYS HA H 1 4.32 0.02 . 1 . . . . 30 Lys HA . 6943 1 379 . 1 1 30 30 LYS HB2 H 1 1.86 0.02 . 2 . . . . 30 Lys HB2 . 6943 1 380 . 1 1 30 30 LYS HB3 H 1 1.50 0.02 . 2 . . . . 30 Lys HB3 . 6943 1 381 . 1 1 30 30 LYS HG2 H 1 1.51 0.02 . 2 . . . . 30 Lys HG2 . 6943 1 382 . 1 1 30 30 LYS HG3 H 1 1.17 0.02 . 2 . . . . 30 Lys HG3 . 6943 1 383 . 1 1 30 30 LYS HD2 H 1 1.56 0.02 . 1 . . . . 30 Lys HD2 . 6943 1 384 . 1 1 30 30 LYS HD3 H 1 1.56 0.02 . 1 . . . . 30 Lys HD3 . 6943 1 385 . 1 1 30 30 LYS HE2 H 1 2.83 0.02 . 1 . . . . 30 Lys HE2 . 6943 1 386 . 1 1 30 30 LYS HE3 H 1 2.83 0.02 . 1 . . . . 30 Lys HE3 . 6943 1 387 . 1 1 30 30 LYS C C 13 175.80 0.2 . 1 . . . . 30 Lys C . 6943 1 388 . 1 1 30 30 LYS CA C 13 56.10 0.2 . 1 . . . . 30 Lys CA . 6943 1 389 . 1 1 30 30 LYS CB C 13 33.90 0.2 . 1 . . . . 30 Lys CB . 6943 1 390 . 1 1 30 30 LYS CG C 13 25.00 0.2 . 1 . . . . 30 Lys CG . 6943 1 391 . 1 1 30 30 LYS CD C 13 29.40 0.2 . 1 . . . . 30 Lys CD . 6943 1 392 . 1 1 30 30 LYS CE C 13 41.90 0.2 . 1 . . . . 30 Lys CE . 6943 1 393 . 1 1 30 30 LYS N N 15 118.00 0.2 . 1 . . . . 30 Lys N . 6943 1 394 . 1 1 31 31 GLY H H 1 7.15 0.02 . 1 . . . . 31 Gly H . 6943 1 395 . 1 1 31 31 GLY HA2 H 1 3.71 0.02 . 2 . . . . 31 Gly HA2 . 6943 1 396 . 1 1 31 31 GLY HA3 H 1 4.28 0.02 . 2 . . . . 31 Gly HA3 . 6943 1 397 . 1 1 31 31 GLY C C 13 171.70 0.2 . 1 . . . . 31 Gly C . 6943 1 398 . 1 1 31 31 GLY CA C 13 44.10 0.2 . 1 . . . . 31 Gly CA . 6943 1 399 . 1 1 31 31 GLY N N 15 105.70 0.2 . 1 . . . . 31 Gly N . 6943 1 400 . 1 1 32 32 LYS H H 1 8.38 0.02 . 1 . . . . 32 Lys H . 6943 1 401 . 1 1 32 32 LYS HA H 1 4.26 0.02 . 1 . . . . 32 Lys HA . 6943 1 402 . 1 1 32 32 LYS HB2 H 1 1.76 0.02 . 1 . . . . 32 Lys HB2 . 6943 1 403 . 1 1 32 32 LYS HB3 H 1 1.76 0.02 . 1 . . . . 32 Lys HB3 . 6943 1 404 . 1 1 32 32 LYS HG2 H 1 1.39 0.02 . 1 . . . . 32 Lys HG2 . 6943 1 405 . 1 1 32 32 LYS HG3 H 1 1.39 0.02 . 1 . . . . 32 Lys HG3 . 6943 1 406 . 1 1 32 32 LYS HD2 H 1 1.65 0.02 . 1 . . . . 32 Lys HD2 . 6943 1 407 . 1 1 32 32 LYS HD3 H 1 1.65 0.02 . 1 . . . . 32 Lys HD3 . 6943 1 408 . 1 1 32 32 LYS HE2 H 1 2.97 0.02 . 2 . . . . 32 Lys HE2 . 6943 1 409 . 1 1 32 32 LYS C C 13 177.00 0.2 . 1 . . . . 32 Lys C . 6943 1 410 . 1 1 32 32 LYS CA C 13 56.50 0.2 . 1 . . . . 32 Lys CA . 6943 1 411 . 1 1 32 32 LYS CB C 13 33.20 0.2 . 1 . . . . 32 Lys CB . 6943 1 412 . 1 1 32 32 LYS CG C 13 24.70 0.2 . 1 . . . . 32 Lys CG . 6943 1 413 . 1 1 32 32 LYS CD C 13 29.00 0.2 . 1 . . . . 32 Lys CD . 6943 1 414 . 1 1 32 32 LYS CE C 13 42.10 0.2 . 1 . . . . 32 Lys CE . 6943 1 415 . 1 1 32 32 LYS N N 15 118.60 0.2 . 1 . . . . 32 Lys N . 6943 1 416 . 1 1 33 33 CYS H H 1 8.83 0.02 . 1 . . . . 33 Cys H . 6943 1 417 . 1 1 33 33 CYS HA H 1 5.00 0.02 . 1 . . . . 33 Cys HA . 6943 1 418 . 1 1 33 33 CYS HB2 H 1 3.21 0.02 . 2 . . . . 33 Cys HB2 . 6943 1 419 . 1 1 33 33 CYS HB3 H 1 2.86 0.02 . 2 . . . . 33 Cys HB3 . 6943 1 420 . 1 1 33 33 CYS C C 13 176.50 0.2 . 1 . . . . 33 Cys C . 6943 1 421 . 1 1 33 33 CYS CA C 13 55.10 0.2 . 1 . . . . 33 Cys CA . 6943 1 422 . 1 1 33 33 CYS CB C 13 45.60 0.2 . 1 . . . . 33 Cys CB . 6943 1 423 . 1 1 33 33 CYS N N 15 119.60 0.2 . 1 . . . . 33 Cys N . 6943 1 424 . 1 1 34 34 THR H H 1 8.62 0.02 . 1 . . . . 34 Thr H . 6943 1 425 . 1 1 34 34 THR HA H 1 4.70 0.02 . 1 . . . . 34 Thr HA . 6943 1 426 . 1 1 34 34 THR HB H 1 4.83 0.02 . 1 . . . . 34 Thr HB . 6943 1 427 . 1 1 34 34 THR HG21 H 1 1.43 0.02 . 1 . . . . 34 Thr HG2 . 6943 1 428 . 1 1 34 34 THR HG22 H 1 1.43 0.02 . 1 . . . . 34 Thr HG2 . 6943 1 429 . 1 1 34 34 THR HG23 H 1 1.43 0.02 . 1 . . . . 34 Thr HG2 . 6943 1 430 . 1 1 34 34 THR CA C 13 60.30 0.2 . 1 . . . . 34 Thr CA . 6943 1 431 . 1 1 34 34 THR CB C 13 68.20 0.2 . 1 . . . . 34 Thr CB . 6943 1 432 . 1 1 34 34 THR CG2 C 13 22.40 0.2 . 1 . . . . 34 Thr CG2 . 6943 1 433 . 1 1 34 34 THR N N 15 116.10 0.2 . 1 . . . . 34 Thr N . 6943 1 434 . 1 1 35 35 PRO HA H 1 4.14 0.02 . 1 . . . . 35 Pro HA . 6943 1 435 . 1 1 35 35 PRO HB2 H 1 2.33 0.02 . 2 . . . . 35 Pro HB2 . 6943 1 436 . 1 1 35 35 PRO HB3 H 1 1.80 0.02 . 2 . . . . 35 Pro HB3 . 6943 1 437 . 1 1 35 35 PRO HG2 H 1 2.21 0.02 . 2 . . . . 35 Pro HG2 . 6943 1 438 . 1 1 35 35 PRO HG3 H 1 1.95 0.02 . 2 . . . . 35 Pro HG3 . 6943 1 439 . 1 1 35 35 PRO HD2 H 1 3.86 0.02 . 1 . . . . 35 Pro HD2 . 6943 1 440 . 1 1 35 35 PRO HD3 H 1 3.86 0.02 . 1 . . . . 35 Pro HD3 . 6943 1 441 . 1 1 35 35 PRO C C 13 179.50 0.2 . 1 . . . . 35 Pro C . 6943 1 442 . 1 1 35 35 PRO CA C 13 66.60 0.2 . 1 . . . . 35 Pro CA . 6943 1 443 . 1 1 35 35 PRO CB C 13 31.60 0.2 . 1 . . . . 35 Pro CB . 6943 1 444 . 1 1 35 35 PRO CG C 13 28.50 0.2 . 1 . . . . 35 Pro CG . 6943 1 445 . 1 1 35 35 PRO CD C 13 50.20 0.2 . 1 . . . . 35 Pro CD . 6943 1 446 . 1 1 36 36 GLU H H 1 8.96 0.02 . 1 . . . . 36 Glu H . 6943 1 447 . 1 1 36 36 GLU HA H 1 3.83 0.02 . 1 . . . . 36 Glu HA . 6943 1 448 . 1 1 36 36 GLU HB2 H 1 2.16 0.02 . 2 . . . . 36 Glu HB2 . 6943 1 449 . 1 1 36 36 GLU HB3 H 1 1.97 0.02 . 2 . . . . 36 Glu HB3 . 6943 1 450 . 1 1 36 36 GLU HG2 H 1 2.33 0.02 . 2 . . . . 36 Glu HG2 . 6943 1 451 . 1 1 36 36 GLU HG3 H 1 2.14 0.02 . 2 . . . . 36 Glu HG3 . 6943 1 452 . 1 1 36 36 GLU C C 13 178.00 0.2 . 1 . . . . 36 Glu C . 6943 1 453 . 1 1 36 36 GLU CA C 13 60.40 0.2 . 1 . . . . 36 Glu CA . 6943 1 454 . 1 1 36 36 GLU CB C 13 29.00 0.2 . 1 . . . . 36 Glu CB . 6943 1 455 . 1 1 36 36 GLU CG C 13 36.10 0.2 . 1 . . . . 36 Glu CG . 6943 1 456 . 1 1 36 36 GLU N N 15 117.10 0.2 . 1 . . . . 36 Glu N . 6943 1 457 . 1 1 37 37 GLY H H 1 7.38 0.02 . 1 . . . . 37 Gly H . 6943 1 458 . 1 1 37 37 GLY HA2 H 1 3.06 0.02 . 2 . . . . 37 Gly HA2 . 6943 1 459 . 1 1 37 37 GLY HA3 H 1 3.75 0.02 . 2 . . . . 37 Gly HA3 . 6943 1 460 . 1 1 37 37 GLY C C 13 175.20 0.2 . 1 . . . . 37 Gly C . 6943 1 461 . 1 1 37 37 GLY CA C 13 47.50 0.2 . 1 . . . . 37 Gly CA . 6943 1 462 . 1 1 37 37 GLY N N 15 107.60 0.2 . 1 . . . . 37 Gly N . 6943 1 463 . 1 1 38 38 LYS H H 1 8.55 0.02 . 1 . . . . 38 Lys H . 6943 1 464 . 1 1 38 38 LYS HA H 1 3.85 0.02 . 1 . . . . 38 Lys HA . 6943 1 465 . 1 1 38 38 LYS HB2 H 1 1.96 0.02 . 2 . . . . 38 Lys HB2 . 6943 1 466 . 1 1 38 38 LYS HB3 H 1 1.68 0.02 . 2 . . . . 38 Lys HB3 . 6943 1 467 . 1 1 38 38 LYS HG2 H 1 1.40 0.02 . 1 . . . . 38 Lys HG2 . 6943 1 468 . 1 1 38 38 LYS HG3 H 1 1.40 0.02 . 1 . . . . 38 Lys HG3 . 6943 1 469 . 1 1 38 38 LYS HD2 H 1 1.77 0.02 . 2 . . . . 38 Lys HD2 . 6943 1 470 . 1 1 38 38 LYS HD3 H 1 1.54 0.02 . 2 . . . . 38 Lys HD3 . 6943 1 471 . 1 1 38 38 LYS HE2 H 1 2.96 0.02 . 1 . . . . 38 Lys HE2 . 6943 1 472 . 1 1 38 38 LYS HE3 H 1 2.96 0.02 . 1 . . . . 38 Lys HE3 . 6943 1 473 . 1 1 38 38 LYS C C 13 177.50 0.2 . 1 . . . . 38 Lys C . 6943 1 474 . 1 1 38 38 LYS CA C 13 59.00 0.2 . 1 . . . . 38 Lys CA . 6943 1 475 . 1 1 38 38 LYS CB C 13 32.30 0.2 . 1 . . . . 38 Lys CB . 6943 1 476 . 1 1 38 38 LYS CG C 13 25.10 0.2 . 1 . . . . 38 Lys CG . 6943 1 477 . 1 1 38 38 LYS CD C 13 28.70 0.2 . 1 . . . . 38 Lys CD . 6943 1 478 . 1 1 38 38 LYS CE C 13 42.20 0.2 . 1 . . . . 38 Lys CE . 6943 1 479 . 1 1 38 38 LYS N N 15 121.80 0.2 . 1 . . . . 38 Lys N . 6943 1 480 . 1 1 39 39 GLU H H 1 7.47 0.02 . 1 . . . . 39 Glu H . 6943 1 481 . 1 1 39 39 GLU HA H 1 4.03 0.02 . 1 . . . . 39 Glu HA . 6943 1 482 . 1 1 39 39 GLU HB2 H 1 2.04 0.02 . 2 . . . . 39 Glu HB2 . 6943 1 483 . 1 1 39 39 GLU HB3 H 1 2.00 0.02 . 2 . . . . 39 Glu HB3 . 6943 1 484 . 1 1 39 39 GLU HG2 H 1 2.32 0.02 . 2 . . . . 39 Glu HG2 . 6943 1 485 . 1 1 39 39 GLU HG3 H 1 2.18 0.02 . 2 . . . . 39 Glu HG3 . 6943 1 486 . 1 1 39 39 GLU C C 13 179.50 0.2 . 1 . . . . 39 Glu C . 6943 1 487 . 1 1 39 39 GLU CA C 13 59.50 0.2 . 1 . . . . 39 Glu CA . 6943 1 488 . 1 1 39 39 GLU CB C 13 29.10 0.2 . 1 . . . . 39 Glu CB . 6943 1 489 . 1 1 39 39 GLU CG C 13 36.10 0.2 . 1 . . . . 39 Glu CG . 6943 1 490 . 1 1 39 39 GLU N N 15 118.00 0.2 . 1 . . . . 39 Glu N . 6943 1 491 . 1 1 40 40 LEU H H 1 7.64 0.02 . 1 . . . . 40 Leu H . 6943 1 492 . 1 1 40 40 LEU HA H 1 3.97 0.02 . 1 . . . . 40 Leu HA . 6943 1 493 . 1 1 40 40 LEU HB2 H 1 1.98 0.02 . 2 . . . . 40 Leu HB2 . 6943 1 494 . 1 1 40 40 LEU HB3 H 1 1.24 0.02 . 2 . . . . 40 Leu HB3 . 6943 1 495 . 1 1 40 40 LEU HG H 1 1.51 0.02 . 1 . . . . 40 Leu HG . 6943 1 496 . 1 1 40 40 LEU HD11 H 1 0.85 0.02 . 2 . . . . 40 Leu HD1 . 6943 1 497 . 1 1 40 40 LEU HD12 H 1 0.85 0.02 . 2 . . . . 40 Leu HD1 . 6943 1 498 . 1 1 40 40 LEU HD13 H 1 0.85 0.02 . 2 . . . . 40 Leu HD1 . 6943 1 499 . 1 1 40 40 LEU HD21 H 1 0.79 0.02 . 2 . . . . 40 Leu HD2 . 6943 1 500 . 1 1 40 40 LEU HD22 H 1 0.79 0.02 . 2 . . . . 40 Leu HD2 . 6943 1 501 . 1 1 40 40 LEU HD23 H 1 0.79 0.02 . 2 . . . . 40 Leu HD2 . 6943 1 502 . 1 1 40 40 LEU C C 13 177.60 0.2 . 1 . . . . 40 Leu C . 6943 1 503 . 1 1 40 40 LEU CA C 13 58.20 0.2 . 1 . . . . 40 Leu CA . 6943 1 504 . 1 1 40 40 LEU CB C 13 41.40 0.2 . 1 . . . . 40 Leu CB . 6943 1 505 . 1 1 40 40 LEU CG C 13 27.20 0.2 . 1 . . . . 40 Leu CG . 6943 1 506 . 1 1 40 40 LEU CD1 C 13 23.30 0.2 . 2 . . . . 40 Leu CD1 . 6943 1 507 . 1 1 40 40 LEU CD2 C 13 26.20 0.2 . 2 . . . . 40 Leu CD2 . 6943 1 508 . 1 1 40 40 LEU N N 15 120.70 0.2 . 1 . . . . 40 Leu N . 6943 1 509 . 1 1 41 41 LYS H H 1 8.85 0.02 . 1 . . . . 41 Lys H . 6943 1 510 . 1 1 41 41 LYS HA H 1 3.80 0.02 . 1 . . . . 41 Lys HA . 6943 1 511 . 1 1 41 41 LYS HB2 H 1 2.17 0.02 . 1 . . . . 41 Lys HB2 . 6943 1 512 . 1 1 41 41 LYS HB3 H 1 2.17 0.02 . 1 . . . . 41 Lys HB3 . 6943 1 513 . 1 1 41 41 LYS HG2 H 1 1.80 0.02 . 2 . . . . 41 Lys HG2 . 6943 1 514 . 1 1 41 41 LYS HG3 H 1 1.71 0.02 . 2 . . . . 41 Lys HG3 . 6943 1 515 . 1 1 41 41 LYS HD2 H 1 1.92 0.02 . 2 . . . . 41 Lys HD2 . 6943 1 516 . 1 1 41 41 LYS HD3 H 1 1.79 0.02 . 2 . . . . 41 Lys HD3 . 6943 1 517 . 1 1 41 41 LYS HE2 H 1 3.14 0.02 . 2 . . . . 41 Lys HE2 . 6943 1 518 . 1 1 41 41 LYS C C 13 177.30 0.2 . 1 . . . . 41 Lys C . 6943 1 519 . 1 1 41 41 LYS CA C 13 60.90 0.2 . 1 . . . . 41 Lys CA . 6943 1 520 . 1 1 41 41 LYS CB C 13 32.50 0.2 . 1 . . . . 41 Lys CB . 6943 1 521 . 1 1 41 41 LYS CG C 13 24.60 0.2 . 1 . . . . 41 Lys CG . 6943 1 522 . 1 1 41 41 LYS CD C 13 29.80 0.2 . 1 . . . . 41 Lys CD . 6943 1 523 . 1 1 41 41 LYS CE C 13 42.30 0.2 . 1 . . . . 41 Lys CE . 6943 1 524 . 1 1 41 41 LYS N N 15 120.20 0.2 . 1 . . . . 41 Lys N . 6943 1 525 . 1 1 42 42 ASP H H 1 8.83 0.02 . 1 . . . . 42 Asp H . 6943 1 526 . 1 1 42 42 ASP HA H 1 4.28 0.02 . 1 . . . . 42 Asp HA . 6943 1 527 . 1 1 42 42 ASP HB2 H 1 2.70 0.02 . 2 . . . . 42 Asp HB2 . 6943 1 528 . 1 1 42 42 ASP HB3 H 1 2.62 0.02 . 2 . . . . 42 Asp HB3 . 6943 1 529 . 1 1 42 42 ASP C C 13 179.00 0.2 . 1 . . . . 42 Asp C . 6943 1 530 . 1 1 42 42 ASP CA C 13 57.50 0.2 . 1 . . . . 42 Asp CA . 6943 1 531 . 1 1 42 42 ASP CB C 13 39.70 0.2 . 1 . . . . 42 Asp CB . 6943 1 532 . 1 1 42 42 ASP N N 15 118.10 0.2 . 1 . . . . 42 Asp N . 6943 1 533 . 1 1 43 43 HIS H H 1 7.78 0.02 . 1 . . . . 43 His H . 6943 1 534 . 1 1 43 43 HIS HA H 1 4.30 0.02 . 1 . . . . 43 His HA . 6943 1 535 . 1 1 43 43 HIS HB2 H 1 3.32 0.02 . 2 . . . . 43 His HB2 . 6943 1 536 . 1 1 43 43 HIS HB3 H 1 3.14 0.02 . 2 . . . . 43 His HB3 . 6943 1 537 . 1 1 43 43 HIS C C 13 178.00 0.2 . 1 . . . . 43 His C . 6943 1 538 . 1 1 43 43 HIS CA C 13 58.90 0.2 . 1 . . . . 43 His CA . 6943 1 539 . 1 1 43 43 HIS CB C 13 28.40 0.2 . 1 . . . . 43 His CB . 6943 1 540 . 1 1 43 43 HIS N N 15 119.20 0.2 . 1 . . . . 43 His N . 6943 1 541 . 1 1 44 44 LEU H H 1 8.12 0.02 . 1 . . . . 44 Leu H . 6943 1 542 . 1 1 44 44 LEU HA H 1 3.78 0.02 . 1 . . . . 44 Leu HA . 6943 1 543 . 1 1 44 44 LEU HB2 H 1 1.61 0.02 . 2 . . . . 44 Leu HB2 . 6943 1 544 . 1 1 44 44 LEU HB3 H 1 1.83 0.02 . 2 . . . . 44 Leu HB3 . 6943 1 545 . 1 1 44 44 LEU HG H 1 0.91 0.02 . 1 . . . . 44 Leu HG . 6943 1 546 . 1 1 44 44 LEU HD11 H 1 0.84 0.02 . 2 . . . . 44 Leu HD1 . 6943 1 547 . 1 1 44 44 LEU HD12 H 1 0.84 0.02 . 2 . . . . 44 Leu HD1 . 6943 1 548 . 1 1 44 44 LEU HD13 H 1 0.84 0.02 . 2 . . . . 44 Leu HD1 . 6943 1 549 . 1 1 44 44 LEU HD21 H 1 0.76 0.02 . 2 . . . . 44 Leu HD2 . 6943 1 550 . 1 1 44 44 LEU HD22 H 1 0.76 0.02 . 2 . . . . 44 Leu HD2 . 6943 1 551 . 1 1 44 44 LEU HD23 H 1 0.76 0.02 . 2 . . . . 44 Leu HD2 . 6943 1 552 . 1 1 44 44 LEU C C 13 177.60 0.2 . 1 . . . . 44 Leu C . 6943 1 553 . 1 1 44 44 LEU CA C 13 57.20 0.2 . 1 . . . . 44 Leu CA . 6943 1 554 . 1 1 44 44 LEU CB C 13 42.30 0.2 . 1 . . . . 44 Leu CB . 6943 1 555 . 1 1 44 44 LEU CG C 13 26.10 0.2 . 1 . . . . 44 Leu CG . 6943 1 556 . 1 1 44 44 LEU CD1 C 13 24.90 0.2 . 2 . . . . 44 Leu CD1 . 6943 1 557 . 1 1 44 44 LEU CD2 C 13 23.60 0.2 . 2 . . . . 44 Leu CD2 . 6943 1 558 . 1 1 44 44 LEU N N 15 117.90 0.2 . 1 . . . . 44 Leu N . 6943 1 559 . 1 1 45 45 GLN H H 1 9.10 0.02 . 1 . . . . 45 Gln H . 6943 1 560 . 1 1 45 45 GLN HA H 1 4.08 0.02 . 1 . . . . 45 Gln HA . 6943 1 561 . 1 1 45 45 GLN HB2 H 1 2.08 0.02 . 2 . . . . 45 Gln HB2 . 6943 1 562 . 1 1 45 45 GLN HG2 H 1 2.01 0.02 . 2 . . . . 45 Gln HG2 . 6943 1 563 . 1 1 45 45 GLN HE21 H 1 8.11 0.02 . 2 . . . . 45 Gln HE21 . 6943 1 564 . 1 1 45 45 GLN HE22 H 1 6.72 0.02 . 2 . . . . 45 Gln HE22 . 6943 1 565 . 1 1 45 45 GLN C C 13 177.90 0.2 . 1 . . . . 45 Gln C . 6943 1 566 . 1 1 45 45 GLN CA C 13 59.50 0.2 . 1 . . . . 45 Gln CA . 6943 1 567 . 1 1 45 45 GLN CB C 13 27.80 0.2 . 1 . . . . 45 Gln CB . 6943 1 568 . 1 1 45 45 GLN CG C 13 32.70 0.2 . 1 . . . . 45 Gln CG . 6943 1 569 . 1 1 45 45 GLN N N 15 120.40 0.2 . 1 . . . . 45 Gln N . 6943 1 570 . 1 1 45 45 GLN NE2 N 15 111.80 0.2 . 1 . . . . 45 Gln NE2 . 6943 1 571 . 1 1 46 46 GLU H H 1 7.75 0.02 . 1 . . . . 46 Glu H . 6943 1 572 . 1 1 46 46 GLU HA H 1 3.93 0.02 . 1 . . . . 46 Glu HA . 6943 1 573 . 1 1 46 46 GLU HB2 H 1 2.00 0.02 . 2 . . . . 46 Glu HB2 . 6943 1 574 . 1 1 46 46 GLU HB3 H 1 1.82 0.02 . 2 . . . . 46 Glu HB3 . 6943 1 575 . 1 1 46 46 GLU HG2 H 1 2.02 0.02 . 1 . . . . 46 Glu HG2 . 6943 1 576 . 1 1 46 46 GLU HG3 H 1 2.02 0.02 . 1 . . . . 46 Glu HG3 . 6943 1 577 . 1 1 46 46 GLU C C 13 180.40 0.2 . 1 . . . . 46 Glu C . 6943 1 578 . 1 1 46 46 GLU CA C 13 59.30 0.2 . 1 . . . . 46 Glu CA . 6943 1 579 . 1 1 46 46 GLU CB C 13 29.20 0.2 . 1 . . . . 46 Glu CB . 6943 1 580 . 1 1 46 46 GLU CG C 13 36.30 0.2 . 1 . . . . 46 Glu CG . 6943 1 581 . 1 1 46 46 GLU N N 15 117.70 0.2 . 1 . . . . 46 Glu N . 6943 1 582 . 1 1 47 47 ALA H H 1 7.35 0.02 . 1 . . . . 47 Ala H . 6943 1 583 . 1 1 47 47 ALA HA H 1 3.75 0.02 . 1 . . . . 47 Ala HA . 6943 1 584 . 1 1 47 47 ALA HB1 H 1 1.12 0.02 . 1 . . . . 47 Ala HB . 6943 1 585 . 1 1 47 47 ALA HB2 H 1 1.12 0.02 . 1 . . . . 47 Ala HB . 6943 1 586 . 1 1 47 47 ALA HB3 H 1 1.12 0.02 . 1 . . . . 47 Ala HB . 6943 1 587 . 1 1 47 47 ALA C C 13 176.50 0.2 . 1 . . . . 47 Ala C . 6943 1 588 . 1 1 47 47 ALA CA C 13 55.40 0.2 . 1 . . . . 47 Ala CA . 6943 1 589 . 1 1 47 47 ALA CB C 13 18.00 0.2 . 1 . . . . 47 Ala CB . 6943 1 590 . 1 1 47 47 ALA N N 15 120.10 0.2 . 1 . . . . 47 Ala N . 6943 1 591 . 1 1 48 48 LEU H H 1 8.35 0.02 . 1 . . . . 48 Leu H . 6943 1 592 . 1 1 48 48 LEU HA H 1 4.39 0.02 . 1 . . . . 48 Leu HA . 6943 1 593 . 1 1 48 48 LEU HB2 H 1 1.66 0.02 . 2 . . . . 48 Leu HB2 . 6943 1 594 . 1 1 48 48 LEU HB3 H 1 1.63 0.02 . 2 . . . . 48 Leu HB3 . 6943 1 595 . 1 1 48 48 LEU HG H 1 1.81 0.02 . 1 . . . . 48 Leu HG . 6943 1 596 . 1 1 48 48 LEU HD11 H 1 0.90 0.02 . 2 . . . . 48 Leu HD1 . 6943 1 597 . 1 1 48 48 LEU HD12 H 1 0.90 0.02 . 2 . . . . 48 Leu HD1 . 6943 1 598 . 1 1 48 48 LEU HD13 H 1 0.90 0.02 . 2 . . . . 48 Leu HD1 . 6943 1 599 . 1 1 48 48 LEU HD21 H 1 0.83 0.02 . 2 . . . . 48 Leu HD2 . 6943 1 600 . 1 1 48 48 LEU HD22 H 1 0.83 0.02 . 2 . . . . 48 Leu HD2 . 6943 1 601 . 1 1 48 48 LEU HD23 H 1 0.83 0.02 . 2 . . . . 48 Leu HD2 . 6943 1 602 . 1 1 48 48 LEU C C 13 175.90 0.2 . 1 . . . . 48 Leu C . 6943 1 603 . 1 1 48 48 LEU CA C 13 56.90 0.2 . 1 . . . . 48 Leu CA . 6943 1 604 . 1 1 48 48 LEU CB C 13 42.60 0.2 . 1 . . . . 48 Leu CB . 6943 1 605 . 1 1 48 48 LEU CG C 13 27.80 0.2 . 1 . . . . 48 Leu CG . 6943 1 606 . 1 1 48 48 LEU CD1 C 13 23.50 0.2 . 2 . . . . 48 Leu CD1 . 6943 1 607 . 1 1 48 48 LEU CD2 C 13 26.20 0.2 . 2 . . . . 48 Leu CD2 . 6943 1 608 . 1 1 48 48 LEU N N 15 115.80 0.2 . 1 . . . . 48 Leu N . 6943 1 609 . 1 1 49 49 GLU H H 1 8.68 0.02 . 1 . . . . 49 Glu H . 6943 1 610 . 1 1 49 49 GLU HA H 1 4.74 0.02 . 1 . . . . 49 Glu HA . 6943 1 611 . 1 1 49 49 GLU HB2 H 1 2.26 0.02 . 2 . . . . 49 Glu HB2 . 6943 1 612 . 1 1 49 49 GLU HB3 H 1 2.17 0.02 . 2 . . . . 49 Glu HB3 . 6943 1 613 . 1 1 49 49 GLU HG2 H 1 2.77 0.02 . 2 . . . . 49 Glu HG2 . 6943 1 614 . 1 1 49 49 GLU HG3 H 1 2.41 0.02 . 2 . . . . 49 Glu HG3 . 6943 1 615 . 1 1 49 49 GLU C C 13 178.80 0.2 . 1 . . . . 49 Glu C . 6943 1 616 . 1 1 49 49 GLU CA C 13 58.00 0.2 . 1 . . . . 49 Glu CA . 6943 1 617 . 1 1 49 49 GLU CB C 13 31.70 0.2 . 1 . . . . 49 Glu CB . 6943 1 618 . 1 1 49 49 GLU CG C 13 37.40 0.2 . 1 . . . . 49 Glu CG . 6943 1 619 . 1 1 49 49 GLU N N 15 114.80 0.2 . 1 . . . . 49 Glu N . 6943 1 620 . 1 1 50 50 THR H H 1 6.72 0.02 . 1 . . . . 50 Thr H . 6943 1 621 . 1 1 50 50 THR HA H 1 4.82 0.02 . 1 . . . . 50 Thr HA . 6943 1 622 . 1 1 50 50 THR HB H 1 4.58 0.02 . 1 . . . . 50 Thr HB . 6943 1 623 . 1 1 50 50 THR HG21 H 1 1.23 0.02 . 1 . . . . 50 Thr HG2 . 6943 1 624 . 1 1 50 50 THR HG22 H 1 1.23 0.02 . 1 . . . . 50 Thr HG2 . 6943 1 625 . 1 1 50 50 THR HG23 H 1 1.23 0.02 . 1 . . . . 50 Thr HG2 . 6943 1 626 . 1 1 50 50 THR C C 13 175.00 0.2 . 1 . . . . 50 Thr C . 6943 1 627 . 1 1 50 50 THR CA C 13 60.10 0.2 . 1 . . . . 50 Thr CA . 6943 1 628 . 1 1 50 50 THR CB C 13 71.30 0.2 . 1 . . . . 50 Thr CB . 6943 1 629 . 1 1 50 50 THR CG2 C 13 21.60 0.2 . 1 . . . . 50 Thr CG2 . 6943 1 630 . 1 1 50 50 THR N N 15 102.00 0.2 . 1 . . . . 50 Thr N . 6943 1 631 . 1 1 51 51 GLY H H 1 6.12 0.02 . 1 . . . . 51 Gly H . 6943 1 632 . 1 1 51 51 GLY HA2 H 1 3.82 0.02 . 1 . . . . 51 Gly HA2 . 6943 1 633 . 1 1 51 51 GLY HA3 H 1 3.82 0.02 . 1 . . . . 51 Gly HA3 . 6943 1 634 . 1 1 51 51 GLY C C 13 174.30 0.2 . 1 . . . . 51 Gly C . 6943 1 635 . 1 1 51 51 GLY CA C 13 45.90 0.2 . 1 . . . . 51 Gly CA . 6943 1 636 . 1 1 51 51 GLY N N 15 109.70 0.2 . 1 . . . . 51 Gly N . 6943 1 637 . 1 1 52 52 CYS H H 1 8.12 0.02 . 1 . . . . 52 Cys H . 6943 1 638 . 1 1 52 52 CYS HA H 1 3.99 0.02 . 1 . . . . 52 Cys HA . 6943 1 639 . 1 1 52 52 CYS HB2 H 1 2.44 0.02 . 2 . . . . 52 Cys HB2 . 6943 1 640 . 1 1 52 52 CYS HB3 H 1 2.42 0.02 . 2 . . . . 52 Cys HB3 . 6943 1 641 . 1 1 52 52 CYS C C 13 176.90 0.2 . 1 . . . . 52 Cys C . 6943 1 642 . 1 1 52 52 CYS CA C 13 56.80 0.2 . 1 . . . . 52 Cys CA . 6943 1 643 . 1 1 52 52 CYS CB C 13 34.90 0.2 . 1 . . . . 52 Cys CB . 6943 1 644 . 1 1 52 52 CYS N N 15 118.00 0.2 . 1 . . . . 52 Cys N . 6943 1 645 . 1 1 53 53 GLU H H 1 7.21 0.02 . 1 . . . . 53 Glu H . 6943 1 646 . 1 1 53 53 GLU HA H 1 3.83 0.02 . 1 . . . . 53 Glu HA . 6943 1 647 . 1 1 53 53 GLU HB2 H 1 2.15 0.02 . 2 . . . . 53 Glu HB2 . 6943 1 648 . 1 1 53 53 GLU HB3 H 1 1.85 0.02 . 2 . . . . 53 Glu HB3 . 6943 1 649 . 1 1 53 53 GLU HG2 H 1 2.17 0.02 . 1 . . . . 53 Glu HG2 . 6943 1 650 . 1 1 53 53 GLU HG3 H 1 2.17 0.02 . 1 . . . . 53 Glu HG3 . 6943 1 651 . 1 1 53 53 GLU C C 13 177.80 0.2 . 1 . . . . 53 Glu C . 6943 1 652 . 1 1 53 53 GLU CA C 13 60.30 0.2 . 1 . . . . 53 Glu CA . 6943 1 653 . 1 1 53 53 GLU CB C 13 29.70 0.2 . 1 . . . . 53 Glu CB . 6943 1 654 . 1 1 53 53 GLU CG C 13 36.60 0.2 . 1 . . . . 53 Glu CG . 6943 1 655 . 1 1 53 53 GLU N N 15 119.70 0.2 . 1 . . . . 53 Glu N . 6943 1 656 . 1 1 54 54 LYS H H 1 8.93 0.02 . 1 . . . . 54 Lys H . 6943 1 657 . 1 1 54 54 LYS HA H 1 4.43 0.02 . 1 . . . . 54 Lys HA . 6943 1 658 . 1 1 54 54 LYS HB2 H 1 2.00 0.02 . 1 . . . . 54 Lys HB2 . 6943 1 659 . 1 1 54 54 LYS HB3 H 1 2.00 0.02 . 1 . . . . 54 Lys HB3 . 6943 1 660 . 1 1 54 54 LYS HG2 H 1 1.37 0.02 . 2 . . . . 54 Lys HG2 . 6943 1 661 . 1 1 54 54 LYS HG3 H 1 1.32 0.02 . 2 . . . . 54 Lys HG3 . 6943 1 662 . 1 1 54 54 LYS HD2 H 1 1.60 0.02 . 1 . . . . 54 Lys HD2 . 6943 1 663 . 1 1 54 54 LYS HD3 H 1 1.60 0.02 . 1 . . . . 54 Lys HD3 . 6943 1 664 . 1 1 54 54 LYS HE2 H 1 2.95 0.02 . 1 . . . . 54 Lys HE2 . 6943 1 665 . 1 1 54 54 LYS HE3 H 1 2.95 0.02 . 1 . . . . 54 Lys HE3 . 6943 1 666 . 1 1 54 54 LYS C C 13 176.30 0.2 . 1 . . . . 54 Lys C . 6943 1 667 . 1 1 54 54 LYS CA C 13 55.00 0.2 . 1 . . . . 54 Lys CA . 6943 1 668 . 1 1 54 54 LYS CB C 13 31.40 0.2 . 1 . . . . 54 Lys CB . 6943 1 669 . 1 1 54 54 LYS CG C 13 25.00 0.2 . 1 . . . . 54 Lys CG . 6943 1 670 . 1 1 54 54 LYS CD C 13 29.00 0.2 . 1 . . . . 54 Lys CD . 6943 1 671 . 1 1 54 54 LYS CE C 13 42.20 0.2 . 1 . . . . 54 Lys CE . 6943 1 672 . 1 1 54 54 LYS N N 15 115.70 0.2 . 1 . . . . 54 Lys N . 6943 1 673 . 1 1 55 55 CYS H H 1 7.34 0.02 . 1 . . . . 55 Cys H . 6943 1 674 . 1 1 55 55 CYS HA H 1 4.26 0.02 . 1 . . . . 55 Cys HA . 6943 1 675 . 1 1 55 55 CYS HB2 H 1 3.28 0.02 . 2 . . . . 55 Cys HB2 . 6943 1 676 . 1 1 55 55 CYS HB3 H 1 3.04 0.02 . 2 . . . . 55 Cys HB3 . 6943 1 677 . 1 1 55 55 CYS C C 13 175.90 0.2 . 1 . . . . 55 Cys C . 6943 1 678 . 1 1 55 55 CYS CA C 13 54.70 0.2 . 1 . . . . 55 Cys CA . 6943 1 679 . 1 1 55 55 CYS CB C 13 39.70 0.2 . 1 . . . . 55 Cys CB . 6943 1 680 . 1 1 55 55 CYS N N 15 119.00 0.2 . 1 . . . . 55 Cys N . 6943 1 681 . 1 1 56 56 THR H H 1 8.62 0.02 . 1 . . . . 56 Thr H . 6943 1 682 . 1 1 56 56 THR HA H 1 4.39 0.02 . 1 . . . . 56 Thr HA . 6943 1 683 . 1 1 56 56 THR HB H 1 4.70 0.02 . 1 . . . . 56 Thr HB . 6943 1 684 . 1 1 56 56 THR HG21 H 1 1.32 0.02 . 1 . . . . 56 Thr HG2 . 6943 1 685 . 1 1 56 56 THR HG22 H 1 1.32 0.02 . 1 . . . . 56 Thr HG2 . 6943 1 686 . 1 1 56 56 THR HG23 H 1 1.32 0.02 . 1 . . . . 56 Thr HG2 . 6943 1 687 . 1 1 56 56 THR C C 13 174.90 0.2 . 1 . . . . 56 Thr C . 6943 1 688 . 1 1 56 56 THR CA C 13 61.10 0.2 . 1 . . . . 56 Thr CA . 6943 1 689 . 1 1 56 56 THR CB C 13 70.90 0.2 . 1 . . . . 56 Thr CB . 6943 1 690 . 1 1 56 56 THR CG2 C 13 21.90 0.2 . 1 . . . . 56 Thr CG2 . 6943 1 691 . 1 1 56 56 THR N N 15 113.90 0.2 . 1 . . . . 56 Thr N . 6943 1 692 . 1 1 57 57 GLU H H 1 8.99 0.02 . 1 . . . . 57 Glu H . 6943 1 693 . 1 1 57 57 GLU HA H 1 4.09 0.02 . 1 . . . . 57 Glu HA . 6943 1 694 . 1 1 57 57 GLU HB2 H 1 2.09 0.02 . 2 . . . . 57 Glu HB2 . 6943 1 695 . 1 1 57 57 GLU HB3 H 1 2.01 0.02 . 2 . . . . 57 Glu HB3 . 6943 1 696 . 1 1 57 57 GLU HG2 H 1 2.37 0.02 . 2 . . . . 57 Glu HG2 . 6943 1 697 . 1 1 57 57 GLU HG3 H 1 2.21 0.02 . 2 . . . . 57 Glu HG3 . 6943 1 698 . 1 1 57 57 GLU C C 13 179.00 0.2 . 1 . . . . 57 Glu C . 6943 1 699 . 1 1 57 57 GLU CA C 13 60.20 0.2 . 1 . . . . 57 Glu CA . 6943 1 700 . 1 1 57 57 GLU CB C 13 29.30 0.2 . 1 . . . . 57 Glu CB . 6943 1 701 . 1 1 57 57 GLU CG C 13 36.60 0.2 . 1 . . . . 57 Glu CG . 6943 1 702 . 1 1 57 57 GLU N N 15 122.10 0.2 . 1 . . . . 57 Glu N . 6943 1 703 . 1 1 58 58 ALA H H 1 8.48 0.02 . 1 . . . . 58 Ala H . 6943 1 704 . 1 1 58 58 ALA HA H 1 4.09 0.02 . 1 . . . . 58 Ala HA . 6943 1 705 . 1 1 58 58 ALA HB1 H 1 1.38 0.02 . 1 . . . . 58 Ala HB . 6943 1 706 . 1 1 58 58 ALA HB2 H 1 1.38 0.02 . 1 . . . . 58 Ala HB . 6943 1 707 . 1 1 58 58 ALA HB3 H 1 1.38 0.02 . 1 . . . . 58 Ala HB . 6943 1 708 . 1 1 58 58 ALA C C 13 181.70 0.2 . 1 . . . . 58 Ala C . 6943 1 709 . 1 1 58 58 ALA CA C 13 55.00 0.2 . 1 . . . . 58 Ala CA . 6943 1 710 . 1 1 58 58 ALA CB C 13 18.30 0.2 . 1 . . . . 58 Ala CB . 6943 1 711 . 1 1 58 58 ALA N N 15 120.10 0.2 . 1 . . . . 58 Ala N . 6943 1 712 . 1 1 59 59 GLN H H 1 7.74 0.02 . 1 . . . . 59 Gln H . 6943 1 713 . 1 1 59 59 GLN HA H 1 4.06 0.02 . 1 . . . . 59 Gln HA . 6943 1 714 . 1 1 59 59 GLN HB2 H 1 2.08 0.02 . 2 . . . . 59 Gln HB2 . 6943 1 715 . 1 1 59 59 GLN HB3 H 1 2.01 0.02 . 2 . . . . 59 Gln HB3 . 6943 1 716 . 1 1 59 59 GLN HG2 H 1 2.38 0.02 . 1 . . . . 59 Gln HG2 . 6943 1 717 . 1 1 59 59 GLN HG3 H 1 2.38 0.02 . 1 . . . . 59 Gln HG3 . 6943 1 718 . 1 1 59 59 GLN HE21 H 1 7.50 0.02 . 2 . . . . 59 Gln HE21 . 6943 1 719 . 1 1 59 59 GLN HE22 H 1 6.84 0.02 . 2 . . . . 59 Gln HE22 . 6943 1 720 . 1 1 59 59 GLN C C 13 179.10 0.2 . 1 . . . . 59 Gln C . 6943 1 721 . 1 1 59 59 GLN CA C 13 58.40 0.2 . 1 . . . . 59 Gln CA . 6943 1 722 . 1 1 59 59 GLN CB C 13 28.40 0.2 . 1 . . . . 59 Gln CB . 6943 1 723 . 1 1 59 59 GLN CG C 13 34.10 0.2 . 1 . . . . 59 Gln CG . 6943 1 724 . 1 1 59 59 GLN N N 15 119.60 0.2 . 1 . . . . 59 Gln N . 6943 1 725 . 1 1 59 59 GLN NE2 N 15 111.70 0.2 . 1 . . . . 59 Gln NE2 . 6943 1 726 . 1 1 60 60 GLU H H 1 8.93 0.02 . 1 . . . . 60 Glu H . 6943 1 727 . 1 1 60 60 GLU HA H 1 4.10 0.02 . 1 . . . . 60 Glu HA . 6943 1 728 . 1 1 60 60 GLU HB2 H 1 2.03 0.02 . 1 . . . . 60 Glu HB2 . 6943 1 729 . 1 1 60 60 GLU HB3 H 1 2.03 0.02 . 1 . . . . 60 Glu HB3 . 6943 1 730 . 1 1 60 60 GLU HG2 H 1 2.31 0.02 . 2 . . . . 60 Glu HG2 . 6943 1 731 . 1 1 60 60 GLU HG3 H 1 2.17 0.02 . 2 . . . . 60 Glu HG3 . 6943 1 732 . 1 1 60 60 GLU C C 13 179.00 0.2 . 1 . . . . 60 Glu C . 6943 1 733 . 1 1 60 60 GLU CA C 13 60.00 0.2 . 1 . . . . 60 Glu CA . 6943 1 734 . 1 1 60 60 GLU CB C 13 29.30 0.2 . 1 . . . . 60 Glu CB . 6943 1 735 . 1 1 60 60 GLU CG C 13 36.30 0.2 . 1 . . . . 60 Glu CG . 6943 1 736 . 1 1 60 60 GLU N N 15 122.40 0.2 . 1 . . . . 60 Glu N . 6943 1 737 . 1 1 61 61 LYS H H 1 8.21 0.02 . 1 . . . . 61 Lys H . 6943 1 738 . 1 1 61 61 LYS HA H 1 4.15 0.02 . 1 . . . . 61 Lys HA . 6943 1 739 . 1 1 61 61 LYS HB2 H 1 1.88 0.02 . 1 . . . . 61 Lys HB2 . 6943 1 740 . 1 1 61 61 LYS HB3 H 1 1.88 0.02 . 1 . . . . 61 Lys HB3 . 6943 1 741 . 1 1 61 61 LYS HG2 H 1 1.49 0.02 . 2 . . . . 61 Lys HG2 . 6943 1 742 . 1 1 61 61 LYS HG3 H 1 1.51 0.02 . 2 . . . . 61 Lys HG3 . 6943 1 743 . 1 1 61 61 LYS HD2 H 1 1.65 0.02 . 2 . . . . 61 Lys HD2 . 6943 1 744 . 1 1 61 61 LYS HD3 H 1 1.58 0.02 . 2 . . . . 61 Lys HD3 . 6943 1 745 . 1 1 61 61 LYS HE2 H 1 2.93 0.02 . 1 . . . . 61 Lys HE2 . 6943 1 746 . 1 1 61 61 LYS HE3 H 1 2.93 0.02 . 1 . . . . 61 Lys HE3 . 6943 1 747 . 1 1 61 61 LYS C C 13 180.00 0.2 . 1 . . . . 61 Lys C . 6943 1 748 . 1 1 61 61 LYS CA C 13 58.90 0.2 . 1 . . . . 61 Lys CA . 6943 1 749 . 1 1 61 61 LYS CB C 13 31.90 0.2 . 1 . . . . 61 Lys CB . 6943 1 750 . 1 1 61 61 LYS CG C 13 25.00 0.2 . 1 . . . . 61 Lys CG . 6943 1 751 . 1 1 61 61 LYS CD C 13 29.10 0.2 . 1 . . . . 61 Lys CD . 6943 1 752 . 1 1 61 61 LYS CE C 13 42.20 0.2 . 1 . . . . 61 Lys CE . 6943 1 753 . 1 1 61 61 LYS N N 15 119.90 0.2 . 1 . . . . 61 Lys N . 6943 1 754 . 1 1 62 62 GLY H H 1 8.13 0.02 . 1 . . . . 62 Gly H . 6943 1 755 . 1 1 62 62 GLY HA2 H 1 3.88 0.02 . 1 . . . . 62 Gly HA2 . 6943 1 756 . 1 1 62 62 GLY HA3 H 1 3.88 0.02 . 1 . . . . 62 Gly HA3 . 6943 1 757 . 1 1 62 62 GLY C C 13 176.20 0.2 . 1 . . . . 62 Gly C . 6943 1 758 . 1 1 62 62 GLY CA C 13 47.00 0.2 . 1 . . . . 62 Gly CA . 6943 1 759 . 1 1 62 62 GLY N N 15 107.80 0.2 . 1 . . . . 62 Gly N . 6943 1 760 . 1 1 63 63 ALA H H 1 8.28 0.02 . 1 . . . . 63 Ala H . 6943 1 761 . 1 1 63 63 ALA HA H 1 4.07 0.02 . 1 . . . . 63 Ala HA . 6943 1 762 . 1 1 63 63 ALA HB1 H 1 1.25 0.02 . 1 . . . . 63 Ala HB . 6943 1 763 . 1 1 63 63 ALA HB2 H 1 1.25 0.02 . 1 . . . . 63 Ala HB . 6943 1 764 . 1 1 63 63 ALA HB3 H 1 1.25 0.02 . 1 . . . . 63 Ala HB . 6943 1 765 . 1 1 63 63 ALA C C 13 178.70 0.2 . 1 . . . . 63 Ala C . 6943 1 766 . 1 1 63 63 ALA CA C 13 55.00 0.2 . 1 . . . . 63 Ala CA . 6943 1 767 . 1 1 63 63 ALA CB C 13 17.40 0.2 . 1 . . . . 63 Ala CB . 6943 1 768 . 1 1 63 63 ALA N N 15 124.50 0.2 . 1 . . . . 63 Ala N . 6943 1 769 . 1 1 64 64 GLU H H 1 8.21 0.02 . 1 . . . . 64 Glu H . 6943 1 770 . 1 1 64 64 GLU HA H 1 3.69 0.02 . 1 . . . . 64 Glu HA . 6943 1 771 . 1 1 64 64 GLU HB2 H 1 2.08 0.02 . 2 . . . . 64 Glu HB2 . 6943 1 772 . 1 1 64 64 GLU HB3 H 1 2.02 0.02 . 2 . . . . 64 Glu HB3 . 6943 1 773 . 1 1 64 64 GLU HG2 H 1 2.31 0.02 . 2 . . . . 64 Glu HG2 . 6943 1 774 . 1 1 64 64 GLU HG3 H 1 2.17 0.02 . 2 . . . . 64 Glu HG3 . 6943 1 775 . 1 1 64 64 GLU CA C 13 60.00 0.2 . 1 . . . . 64 Glu CA . 6943 1 776 . 1 1 64 64 GLU CB C 13 29.30 0.2 . 1 . . . . 64 Glu CB . 6943 1 777 . 1 1 64 64 GLU CG C 13 36.00 0.2 . 1 . . . . 64 Glu CG . 6943 1 778 . 1 1 64 64 GLU N N 15 118.40 0.2 . 1 . . . . 64 Glu N . 6943 1 779 . 1 1 65 65 THR H H 1 7.92 0.02 . 1 . . . . 65 Thr H . 6943 1 780 . 1 1 65 65 THR HA H 1 3.95 0.02 . 1 . . . . 65 Thr HA . 6943 1 781 . 1 1 65 65 THR HB H 1 4.33 0.02 . 1 . . . . 65 Thr HB . 6943 1 782 . 1 1 65 65 THR HG21 H 1 1.22 0.02 . 1 . . . . 65 Thr HG2 . 6943 1 783 . 1 1 65 65 THR HG22 H 1 1.22 0.02 . 1 . . . . 65 Thr HG2 . 6943 1 784 . 1 1 65 65 THR HG23 H 1 1.22 0.02 . 1 . . . . 65 Thr HG2 . 6943 1 785 . 1 1 65 65 THR C C 13 177.50 0.2 . 1 . . . . 65 Thr C . 6943 1 786 . 1 1 65 65 THR CA C 13 66.60 0.2 . 1 . . . . 65 Thr CA . 6943 1 787 . 1 1 65 65 THR CB C 13 68.80 0.2 . 1 . . . . 65 Thr CB . 6943 1 788 . 1 1 65 65 THR CG2 C 13 21.70 0.2 . 1 . . . . 65 Thr CG2 . 6943 1 789 . 1 1 65 65 THR N N 15 114.40 0.2 . 1 . . . . 65 Thr N . 6943 1 790 . 1 1 66 66 SER H H 1 7.76 0.02 . 1 . . . . 66 Ser H . 6943 1 791 . 1 1 66 66 SER HA H 1 4.07 0.02 . 1 . . . . 66 Ser HA . 6943 1 792 . 1 1 66 66 SER HB2 H 1 4.13 0.02 . 1 . . . . 66 Ser HB2 . 6943 1 793 . 1 1 66 66 SER HB3 H 1 4.13 0.02 . 1 . . . . 66 Ser HB3 . 6943 1 794 . 1 1 66 66 SER C C 13 174.90 0.2 . 1 . . . . 66 Ser C . 6943 1 795 . 1 1 66 66 SER CA C 13 62.00 0.2 . 1 . . . . 66 Ser CA . 6943 1 796 . 1 1 66 66 SER CB C 13 62.40 0.2 . 1 . . . . 66 Ser CB . 6943 1 797 . 1 1 66 66 SER N N 15 119.40 0.2 . 1 . . . . 66 Ser N . 6943 1 798 . 1 1 67 67 ILE H H 1 8.56 0.02 . 1 . . . . 67 Ile H . 6943 1 799 . 1 1 67 67 ILE HA H 1 3.27 0.02 . 1 . . . . 67 Ile HA . 6943 1 800 . 1 1 67 67 ILE HB H 1 1.52 0.02 . 1 . . . . 67 Ile HB . 6943 1 801 . 1 1 67 67 ILE HG12 H 1 1.41 0.02 . 2 . . . . 67 Ile HG12 . 6943 1 802 . 1 1 67 67 ILE HG13 H 1 0.81 0.02 . 2 . . . . 67 Ile HG13 . 6943 1 803 . 1 1 67 67 ILE HG21 H 1 0.36 0.02 . 1 . . . . 67 Ile HG2 . 6943 1 804 . 1 1 67 67 ILE HG22 H 1 0.36 0.02 . 1 . . . . 67 Ile HG2 . 6943 1 805 . 1 1 67 67 ILE HG23 H 1 0.36 0.02 . 1 . . . . 67 Ile HG2 . 6943 1 806 . 1 1 67 67 ILE HD11 H 1 -0.03 0.02 . 1 . . . . 67 Ile HD1 . 6943 1 807 . 1 1 67 67 ILE HD12 H 1 -0.03 0.02 . 1 . . . . 67 Ile HD1 . 6943 1 808 . 1 1 67 67 ILE HD13 H 1 -0.03 0.02 . 1 . . . . 67 Ile HD1 . 6943 1 809 . 1 1 67 67 ILE CA C 13 65.90 0.2 . 1 . . . . 67 Ile CA . 6943 1 810 . 1 1 67 67 ILE CB C 13 37.70 0.2 . 1 . . . . 67 Ile CB . 6943 1 811 . 1 1 67 67 ILE CG1 C 13 30.10 0.2 . 1 . . . . 67 Ile CG1 . 6943 1 812 . 1 1 67 67 ILE CG2 C 13 17.80 0.2 . 1 . . . . 67 Ile CG2 . 6943 1 813 . 1 1 67 67 ILE CD1 C 13 12.50 0.2 . 1 . . . . 67 Ile CD1 . 6943 1 814 . 1 1 67 67 ILE N N 15 123.10 0.2 . 1 . . . . 67 Ile N . 6943 1 815 . 1 1 68 68 ASP H H 1 8.58 0.02 . 1 . . . . 68 Asp H . 6943 1 816 . 1 1 68 68 ASP HA H 1 3.96 0.02 . 1 . . . . 68 Asp HA . 6943 1 817 . 1 1 68 68 ASP HB2 H 1 2.66 0.02 . 2 . . . . 68 Asp HB2 . 6943 1 818 . 1 1 68 68 ASP HB3 H 1 2.34 0.02 . 2 . . . . 68 Asp HB3 . 6943 1 819 . 1 1 68 68 ASP C C 13 178.30 0.2 . 1 . . . . 68 Asp C . 6943 1 820 . 1 1 68 68 ASP CA C 13 57.40 0.2 . 1 . . . . 68 Asp CA . 6943 1 821 . 1 1 68 68 ASP CB C 13 39.50 0.2 . 1 . . . . 68 Asp CB . 6943 1 822 . 1 1 68 68 ASP N N 15 119.50 0.2 . 1 . . . . 68 Asp N . 6943 1 823 . 1 1 69 69 TYR H H 1 7.41 0.02 . 1 . . . . 69 Tyr H . 6943 1 824 . 1 1 69 69 TYR HA H 1 3.79 0.02 . 1 . . . . 69 Tyr HA . 6943 1 825 . 1 1 69 69 TYR HB2 H 1 3.30 0.02 . 2 . . . . 69 Tyr HB2 . 6943 1 826 . 1 1 69 69 TYR HB3 H 1 3.12 0.02 . 2 . . . . 69 Tyr HB3 . 6943 1 827 . 1 1 69 69 TYR HD1 H 1 6.90 0.02 . 1 . . . . 69 Tyr HD1 . 6943 1 828 . 1 1 69 69 TYR HD2 H 1 6.90 0.02 . 1 . . . . 69 Tyr HD2 . 6943 1 829 . 1 1 69 69 TYR HE1 H 1 6.77 0.02 . 1 . . . . 69 Tyr HE1 . 6943 1 830 . 1 1 69 69 TYR HE2 H 1 6.77 0.02 . 1 . . . . 69 Tyr HE2 . 6943 1 831 . 1 1 69 69 TYR C C 13 178.10 0.2 . 1 . . . . 69 Tyr C . 6943 1 832 . 1 1 69 69 TYR CA C 13 62.80 0.2 . 1 . . . . 69 Tyr CA . 6943 1 833 . 1 1 69 69 TYR CB C 13 38.20 0.2 . 1 . . . . 69 Tyr CB . 6943 1 834 . 1 1 69 69 TYR CD1 C 13 132.80 0.2 . 1 . . . . 69 Tyr CD . 6943 1 835 . 1 1 69 69 TYR CD2 C 13 132.80 0.2 . 1 . . . . 69 Tyr CD . 6943 1 836 . 1 1 69 69 TYR CE1 C 13 118.40 0.2 . 1 . . . . 69 Tyr CE . 6943 1 837 . 1 1 69 69 TYR CE2 C 13 118.40 0.2 . 1 . . . . 69 Tyr CE . 6943 1 838 . 1 1 69 69 TYR N N 15 117.90 0.2 . 1 . . . . 69 Tyr N . 6943 1 839 . 1 1 70 70 LEU H H 1 8.22 0.02 . 1 . . . . 70 Leu H . 6943 1 840 . 1 1 70 70 LEU HA H 1 3.84 0.02 . 1 . . . . 70 Leu HA . 6943 1 841 . 1 1 70 70 LEU HB2 H 1 2.20 0.02 . 2 . . . . 70 Leu HB2 . 6943 1 842 . 1 1 70 70 LEU HB3 H 1 1.41 0.02 . 2 . . . . 70 Leu HB3 . 6943 1 843 . 1 1 70 70 LEU HG H 1 2.27 0.02 . 1 . . . . 70 Leu HG . 6943 1 844 . 1 1 70 70 LEU HD11 H 1 1.03 0.02 . 2 . . . . 70 Leu HD1 . 6943 1 845 . 1 1 70 70 LEU HD12 H 1 1.03 0.02 . 2 . . . . 70 Leu HD1 . 6943 1 846 . 1 1 70 70 LEU HD13 H 1 1.03 0.02 . 2 . . . . 70 Leu HD1 . 6943 1 847 . 1 1 70 70 LEU HD21 H 1 0.95 0.02 . 2 . . . . 70 Leu HD2 . 6943 1 848 . 1 1 70 70 LEU HD22 H 1 0.95 0.02 . 2 . . . . 70 Leu HD2 . 6943 1 849 . 1 1 70 70 LEU HD23 H 1 0.95 0.02 . 2 . . . . 70 Leu HD2 . 6943 1 850 . 1 1 70 70 LEU C C 13 178.10 0.2 . 1 . . . . 70 Leu C . 6943 1 851 . 1 1 70 70 LEU CA C 13 58.00 0.2 . 1 . . . . 70 Leu CA . 6943 1 852 . 1 1 70 70 LEU CB C 13 42.90 0.2 . 1 . . . . 70 Leu CB . 6943 1 853 . 1 1 70 70 LEU CG C 13 26.70 0.2 . 1 . . . . 70 Leu CG . 6943 1 854 . 1 1 70 70 LEU CD1 C 13 23.50 0.2 . 2 . . . . 70 Leu CD1 . 6943 1 855 . 1 1 70 70 LEU CD2 C 13 26.10 0.2 . 2 . . . . 70 Leu CD2 . 6943 1 856 . 1 1 70 70 LEU N N 15 120.60 0.2 . 1 . . . . 70 Leu N . 6943 1 857 . 1 1 71 71 ILE H H 1 8.29 0.02 . 1 . . . . 71 Ile H . 6943 1 858 . 1 1 71 71 ILE HA H 1 2.90 0.02 . 1 . . . . 71 Ile HA . 6943 1 859 . 1 1 71 71 ILE HB H 1 1.12 0.02 . 1 . . . . 71 Ile HB . 6943 1 860 . 1 1 71 71 ILE HG12 H 1 0.45 0.02 . 2 . . . . 71 Ile HG12 . 6943 1 861 . 1 1 71 71 ILE HG13 H 1 -1.20 0.02 . 2 . . . . 71 Ile HG13 . 6943 1 862 . 1 1 71 71 ILE HG21 H 1 0.40 0.02 . 1 . . . . 71 Ile HG2 . 6943 1 863 . 1 1 71 71 ILE HG22 H 1 0.40 0.02 . 1 . . . . 71 Ile HG2 . 6943 1 864 . 1 1 71 71 ILE HG23 H 1 0.40 0.02 . 1 . . . . 71 Ile HG2 . 6943 1 865 . 1 1 71 71 ILE HD11 H 1 -0.04 0.02 . 1 . . . . 71 Ile HD1 . 6943 1 866 . 1 1 71 71 ILE HD12 H 1 -0.04 0.02 . 1 . . . . 71 Ile HD1 . 6943 1 867 . 1 1 71 71 ILE HD13 H 1 -0.04 0.02 . 1 . . . . 71 Ile HD1 . 6943 1 868 . 1 1 71 71 ILE C C 13 176.10 0.2 . 1 . . . . 71 Ile C . 6943 1 869 . 1 1 71 71 ILE CA C 13 65.80 0.2 . 1 . . . . 71 Ile CA . 6943 1 870 . 1 1 71 71 ILE CB C 13 37.90 0.2 . 1 . . . . 71 Ile CB . 6943 1 871 . 1 1 71 71 ILE CG1 C 13 27.90 0.2 . 1 . . . . 71 Ile CG1 . 6943 1 872 . 1 1 71 71 ILE CG2 C 13 17.90 0.2 . 1 . . . . 71 Ile CG2 . 6943 1 873 . 1 1 71 71 ILE CD1 C 13 14.60 0.2 . 1 . . . . 71 Ile CD1 . 6943 1 874 . 1 1 71 71 ILE N N 15 117.70 0.2 . 1 . . . . 71 Ile N . 6943 1 875 . 1 1 72 72 LYS H H 1 7.35 0.02 . 1 . . . . 72 Lys H . 6943 1 876 . 1 1 72 72 LYS HA H 1 3.79 0.02 . 1 . . . . 72 Lys HA . 6943 1 877 . 1 1 72 72 LYS HB2 H 1 1.58 0.02 . 1 . . . . 72 Lys HB2 . 6943 1 878 . 1 1 72 72 LYS HB3 H 1 1.58 0.02 . 1 . . . . 72 Lys HB3 . 6943 1 879 . 1 1 72 72 LYS HG2 H 1 1.33 0.02 . 2 . . . . 72 Lys HG2 . 6943 1 880 . 1 1 72 72 LYS HG3 H 1 1.17 0.02 . 2 . . . . 72 Lys HG3 . 6943 1 881 . 1 1 72 72 LYS HD2 H 1 1.54 0.02 . 1 . . . . 72 Lys HD2 . 6943 1 882 . 1 1 72 72 LYS HD3 H 1 1.54 0.02 . 1 . . . . 72 Lys HD3 . 6943 1 883 . 1 1 72 72 LYS HE2 H 1 2.91 0.02 . 1 . . . . 72 Lys HE2 . 6943 1 884 . 1 1 72 72 LYS HE3 H 1 2.91 0.02 . 1 . . . . 72 Lys HE3 . 6943 1 885 . 1 1 72 72 LYS C C 13 178.20 0.2 . 1 . . . . 72 Lys C . 6943 1 886 . 1 1 72 72 LYS CA C 13 59.00 0.2 . 1 . . . . 72 Lys CA . 6943 1 887 . 1 1 72 72 LYS CB C 13 34.10 0.2 . 1 . . . . 72 Lys CB . 6943 1 888 . 1 1 72 72 LYS CG C 13 25.00 0.2 . 1 . . . . 72 Lys CG . 6943 1 889 . 1 1 72 72 LYS CD C 13 29.20 0.2 . 1 . . . . 72 Lys CD . 6943 1 890 . 1 1 72 72 LYS CE C 13 42.10 0.2 . 1 . . . . 72 Lys CE . 6943 1 891 . 1 1 72 72 LYS N N 15 113.30 0.2 . 1 . . . . 72 Lys N . 6943 1 892 . 1 1 73 73 ASN H H 1 8.04 0.02 . 1 . . . . 73 Asn H . 6943 1 893 . 1 1 73 73 ASN HA H 1 4.72 0.02 . 1 . . . . 73 Asn HA . 6943 1 894 . 1 1 73 73 ASN HB2 H 1 2.53 0.02 . 2 . . . . 73 Asn HB2 . 6943 1 895 . 1 1 73 73 ASN HB3 H 1 2.48 0.02 . 2 . . . . 73 Asn HB3 . 6943 1 896 . 1 1 73 73 ASN HD21 H 1 7.52 0.02 . 2 . . . . 73 Asn HD21 . 6943 1 897 . 1 1 73 73 ASN HD22 H 1 6.79 0.02 . 2 . . . . 73 Asn HD22 . 6943 1 898 . 1 1 73 73 ASN C C 13 174.60 0.2 . 1 . . . . 73 Asn C . 6943 1 899 . 1 1 73 73 ASN CA C 13 54.50 0.2 . 1 . . . . 73 Asn CA . 6943 1 900 . 1 1 73 73 ASN CB C 13 41.80 0.2 . 1 . . . . 73 Asn CB . 6943 1 901 . 1 1 73 73 ASN N N 15 111.70 0.2 . 1 . . . . 73 Asn N . 6943 1 902 . 1 1 73 73 ASN ND2 N 15 112.80 0.2 . 1 . . . . 73 Asn ND2 . 6943 1 903 . 1 1 74 74 GLU H H 1 8.51 0.02 . 1 . . . . 74 Glu H . 6943 1 904 . 1 1 74 74 GLU HA H 1 5.03 0.02 . 1 . . . . 74 Glu HA . 6943 1 905 . 1 1 74 74 GLU HB2 H 1 1.94 0.02 . 2 . . . . 74 Glu HB2 . 6943 1 906 . 1 1 74 74 GLU HG2 H 1 2.26 0.02 . 2 . . . . 74 Glu HG2 . 6943 1 907 . 1 1 74 74 GLU C C 13 176.10 0.2 . 1 . . . . 74 Glu C . 6943 1 908 . 1 1 74 74 GLU CA C 13 52.70 0.2 . 1 . . . . 74 Glu CA . 6943 1 909 . 1 1 74 74 GLU CB C 13 30.10 0.2 . 1 . . . . 74 Glu CB . 6943 1 910 . 1 1 74 74 GLU CG C 13 37.10 0.2 . 1 . . . . 74 Glu CG . 6943 1 911 . 1 1 74 74 GLU N N 15 122.50 0.2 . 1 . . . . 74 Glu N . 6943 1 912 . 1 1 75 75 LEU H H 1 8.16 0.02 . 1 . . . . 75 Leu H . 6943 1 913 . 1 1 75 75 LEU HA H 1 4.16 0.02 . 1 . . . . 75 Leu HA . 6943 1 914 . 1 1 75 75 LEU HB2 H 1 1.75 0.02 . 2 . . . . 75 Leu HB2 . 6943 1 915 . 1 1 75 75 LEU HB3 H 1 1.72 0.02 . 2 . . . . 75 Leu HB3 . 6943 1 916 . 1 1 75 75 LEU HG H 1 1.71 0.02 . 1 . . . . 75 Leu HG . 6943 1 917 . 1 1 75 75 LEU HD11 H 1 1.21 0.02 . 2 . . . . 75 Leu HD1 . 6943 1 918 . 1 1 75 75 LEU HD12 H 1 1.21 0.02 . 2 . . . . 75 Leu HD1 . 6943 1 919 . 1 1 75 75 LEU HD13 H 1 1.21 0.02 . 2 . . . . 75 Leu HD1 . 6943 1 920 . 1 1 75 75 LEU HD21 H 1 1.04 0.02 . 2 . . . . 75 Leu HD2 . 6943 1 921 . 1 1 75 75 LEU HD22 H 1 1.04 0.02 . 2 . . . . 75 Leu HD2 . 6943 1 922 . 1 1 75 75 LEU HD23 H 1 1.04 0.02 . 2 . . . . 75 Leu HD2 . 6943 1 923 . 1 1 75 75 LEU C C 13 178.80 0.2 . 1 . . . . 75 Leu C . 6943 1 924 . 1 1 75 75 LEU CA C 13 58.70 0.2 . 1 . . . . 75 Leu CA . 6943 1 925 . 1 1 75 75 LEU CB C 13 41.60 0.2 . 1 . . . . 75 Leu CB . 6943 1 926 . 1 1 75 75 LEU CG C 13 27.40 0.2 . 1 . . . . 75 Leu CG . 6943 1 927 . 1 1 75 75 LEU CD1 C 13 23.60 0.2 . 2 . . . . 75 Leu CD1 . 6943 1 928 . 1 1 75 75 LEU CD2 C 13 25.90 0.2 . 2 . . . . 75 Leu CD2 . 6943 1 929 . 1 1 75 75 LEU N N 15 122.60 0.2 . 1 . . . . 75 Leu N . 6943 1 930 . 1 1 76 76 GLU H H 1 8.50 0.02 . 1 . . . . 76 Glu H . 6943 1 931 . 1 1 76 76 GLU HA H 1 4.05 0.02 . 1 . . . . 76 Glu HA . 6943 1 932 . 1 1 76 76 GLU HB2 H 1 2.08 0.02 . 2 . . . . 76 Glu HB2 . 6943 1 933 . 1 1 76 76 GLU HB3 H 1 2.01 0.02 . 2 . . . . 76 Glu HB3 . 6943 1 934 . 1 1 76 76 GLU HG2 H 1 2.37 0.02 . 2 . . . . 76 Glu HG2 . 6943 1 935 . 1 1 76 76 GLU HG3 H 1 2.21 0.02 . 2 . . . . 76 Glu HG3 . 6943 1 936 . 1 1 76 76 GLU C C 13 180.10 0.2 . 1 . . . . 76 Glu C . 6943 1 937 . 1 1 76 76 GLU CA C 13 60.10 0.2 . 1 . . . . 76 Glu CA . 6943 1 938 . 1 1 76 76 GLU CB C 13 28.50 0.2 . 1 . . . . 76 Glu CB . 6943 1 939 . 1 1 76 76 GLU CG C 13 36.50 0.2 . 1 . . . . 76 Glu CG . 6943 1 940 . 1 1 76 76 GLU N N 15 115.20 0.2 . 1 . . . . 76 Glu N . 6943 1 941 . 1 1 77 77 ILE H H 1 7.85 0.02 . 1 . . . . 77 Ile H . 6943 1 942 . 1 1 77 77 ILE HA H 1 3.91 0.02 . 1 . . . . 77 Ile HA . 6943 1 943 . 1 1 77 77 ILE HB H 1 2.25 0.02 . 1 . . . . 77 Ile HB . 6943 1 944 . 1 1 77 77 ILE HG12 H 1 1.85 0.02 . 2 . . . . 77 Ile HG12 . 6943 1 945 . 1 1 77 77 ILE HG13 H 1 1.24 0.02 . 2 . . . . 77 Ile HG13 . 6943 1 946 . 1 1 77 77 ILE HG21 H 1 1.04 0.02 . 1 . . . . 77 Ile HG2 . 6943 1 947 . 1 1 77 77 ILE HG22 H 1 1.04 0.02 . 1 . . . . 77 Ile HG2 . 6943 1 948 . 1 1 77 77 ILE HG23 H 1 1.04 0.02 . 1 . . . . 77 Ile HG2 . 6943 1 949 . 1 1 77 77 ILE HD11 H 1 0.91 0.02 . 1 . . . . 77 Ile HD1 . 6943 1 950 . 1 1 77 77 ILE HD12 H 1 0.91 0.02 . 1 . . . . 77 Ile HD1 . 6943 1 951 . 1 1 77 77 ILE HD13 H 1 0.91 0.02 . 1 . . . . 77 Ile HD1 . 6943 1 952 . 1 1 77 77 ILE C C 13 178.10 0.2 . 1 . . . . 77 Ile C . 6943 1 953 . 1 1 77 77 ILE CA C 13 65.30 0.2 . 1 . . . . 77 Ile CA . 6943 1 954 . 1 1 77 77 ILE CB C 13 37.50 0.2 . 1 . . . . 77 Ile CB . 6943 1 955 . 1 1 77 77 ILE CG1 C 13 29.70 0.2 . 1 . . . . 77 Ile CG1 . 6943 1 956 . 1 1 77 77 ILE CG2 C 13 17.40 0.2 . 1 . . . . 77 Ile CG2 . 6943 1 957 . 1 1 77 77 ILE CD1 C 13 12.60 0.2 . 1 . . . . 77 Ile CD1 . 6943 1 958 . 1 1 77 77 ILE N N 15 122.60 0.2 . 1 . . . . 77 Ile N . 6943 1 959 . 1 1 78 78 TRP H H 1 8.94 0.02 . 1 . . . . 78 Trp H . 6943 1 960 . 1 1 78 78 TRP HA H 1 4.54 0.02 . 1 . . . . 78 Trp HA . 6943 1 961 . 1 1 78 78 TRP HB2 H 1 3.85 0.02 . 2 . . . . 78 Trp HB2 . 6943 1 962 . 1 1 78 78 TRP HB3 H 1 3.03 0.02 . 2 . . . . 78 Trp HB3 . 6943 1 963 . 1 1 78 78 TRP HD1 H 1 7.13 0.02 . 1 . . . . 78 Trp HD . 6943 1 964 . 1 1 78 78 TRP HE1 H 1 9.66 0.02 . 1 . . . . 78 Trp HE1 . 6943 1 965 . 1 1 78 78 TRP HZ2 H 1 7.33 0.02 . 1 . . . . 78 Trp HZ2 . 6943 1 966 . 1 1 78 78 TRP HZ3 H 1 7.00 0.02 . 1 . . . . 78 Trp HZ3 . 6943 1 967 . 1 1 78 78 TRP HH2 H 1 7.13 0.02 . 1 . . . . 78 Trp HH2 . 6943 1 968 . 1 1 78 78 TRP C C 13 178.10 0.2 . 1 . . . . 78 Trp C . 6943 1 969 . 1 1 78 78 TRP CA C 13 60.30 0.2 . 1 . . . . 78 Trp CA . 6943 1 970 . 1 1 78 78 TRP CB C 13 29.20 0.2 . 1 . . . . 78 Trp CB . 6943 1 971 . 1 1 78 78 TRP CD1 C 13 128.10 0.2 . 1 . . . . 78 Trp CD . 6943 1 972 . 1 1 78 78 TRP CZ2 C 13 114.50 0.2 . 1 . . . . 78 Trp CZ2 . 6943 1 973 . 1 1 78 78 TRP CZ3 C 13 121.20 0.2 . 1 . . . . 78 Trp CZ3 . 6943 1 974 . 1 1 78 78 TRP CH2 C 13 124.30 0.2 . 1 . . . . 78 Trp CH2 . 6943 1 975 . 1 1 78 78 TRP N N 15 122.00 0.2 . 1 . . . . 78 Trp N . 6943 1 976 . 1 1 78 78 TRP NE1 N 15 127.50 0.2 . 1 . . . . 78 Trp NE1 . 6943 1 977 . 1 1 79 79 LYS H H 1 8.60 0.02 . 1 . . . . 79 Lys H . 6943 1 978 . 1 1 79 79 LYS HA H 1 3.87 0.02 . 1 . . . . 79 Lys HA . 6943 1 979 . 1 1 79 79 LYS HB2 H 1 1.87 0.02 . 2 . . . . 79 Lys HB2 . 6943 1 980 . 1 1 79 79 LYS HB3 H 1 1.85 0.02 . 2 . . . . 79 Lys HB3 . 6943 1 981 . 1 1 79 79 LYS HG2 H 1 1.41 0.02 . 2 . . . . 79 Lys HG2 . 6943 1 982 . 1 1 79 79 LYS HG3 H 1 1.43 0.02 . 2 . . . . 79 Lys HG3 . 6943 1 983 . 1 1 79 79 LYS HD2 H 1 1.68 0.02 . 1 . . . . 79 Lys HD2 . 6943 1 984 . 1 1 79 79 LYS HD3 H 1 1.68 0.02 . 1 . . . . 79 Lys HD3 . 6943 1 985 . 1 1 79 79 LYS HE2 H 1 2.97 0.02 . 1 . . . . 79 Lys HE2 . 6943 1 986 . 1 1 79 79 LYS HE3 H 1 2.97 0.02 . 1 . . . . 79 Lys HE3 . 6943 1 987 . 1 1 79 79 LYS C C 13 178.90 0.2 . 1 . . . . 79 Lys C . 6943 1 988 . 1 1 79 79 LYS CA C 13 60.20 0.2 . 1 . . . . 79 Lys CA . 6943 1 989 . 1 1 79 79 LYS CB C 13 32.30 0.2 . 1 . . . . 79 Lys CB . 6943 1 990 . 1 1 79 79 LYS CG C 13 24.00 0.2 . 1 . . . . 79 Lys CG . 6943 1 991 . 1 1 79 79 LYS CD C 13 29.10 0.2 . 1 . . . . 79 Lys CD . 6943 1 992 . 1 1 79 79 LYS CE C 13 42.40 0.2 . 1 . . . . 79 Lys CE . 6943 1 993 . 1 1 79 79 LYS N N 15 117.70 0.2 . 1 . . . . 79 Lys N . 6943 1 994 . 1 1 80 80 GLU H H 1 7.64 0.02 . 1 . . . . 80 Glu H . 6943 1 995 . 1 1 80 80 GLU HA H 1 4.01 0.02 . 1 . . . . 80 Glu HA . 6943 1 996 . 1 1 80 80 GLU HB2 H 1 2.16 0.02 . 2 . . . . 80 Glu HB2 . 6943 1 997 . 1 1 80 80 GLU HB3 H 1 2.02 0.02 . 2 . . . . 80 Glu HB3 . 6943 1 998 . 1 1 80 80 GLU HG2 H 1 2.38 0.02 . 2 . . . . 80 Glu HG2 . 6943 1 999 . 1 1 80 80 GLU HG3 H 1 2.17 0.02 . 2 . . . . 80 Glu HG3 . 6943 1 1000 . 1 1 80 80 GLU C C 13 179.70 0.2 . 1 . . . . 80 Glu C . 6943 1 1001 . 1 1 80 80 GLU CA C 13 59.40 0.2 . 1 . . . . 80 Glu CA . 6943 1 1002 . 1 1 80 80 GLU CB C 13 29.70 0.2 . 1 . . . . 80 Glu CB . 6943 1 1003 . 1 1 80 80 GLU CG C 13 36.10 0.2 . 1 . . . . 80 Glu CG . 6943 1 1004 . 1 1 80 80 GLU N N 15 119.70 0.2 . 1 . . . . 80 Glu N . 6943 1 1005 . 1 1 81 81 LEU H H 1 8.97 0.02 . 1 . . . . 81 Leu H . 6943 1 1006 . 1 1 81 81 LEU HA H 1 3.88 0.02 . 1 . . . . 81 Leu HA . 6943 1 1007 . 1 1 81 81 LEU HB2 H 1 2.01 0.02 . 2 . . . . 81 Leu HB2 . 6943 1 1008 . 1 1 81 81 LEU HB3 H 1 1.31 0.02 . 2 . . . . 81 Leu HB3 . 6943 1 1009 . 1 1 81 81 LEU HG H 1 2.01 0.02 . 1 . . . . 81 Leu HG . 6943 1 1010 . 1 1 81 81 LEU HD11 H 1 0.97 0.02 . 2 . . . . 81 Leu HD1 . 6943 1 1011 . 1 1 81 81 LEU HD12 H 1 0.97 0.02 . 2 . . . . 81 Leu HD1 . 6943 1 1012 . 1 1 81 81 LEU HD13 H 1 0.97 0.02 . 2 . . . . 81 Leu HD1 . 6943 1 1013 . 1 1 81 81 LEU HD21 H 1 0.93 0.02 . 2 . . . . 81 Leu HD2 . 6943 1 1014 . 1 1 81 81 LEU HD22 H 1 0.93 0.02 . 2 . . . . 81 Leu HD2 . 6943 1 1015 . 1 1 81 81 LEU HD23 H 1 0.93 0.02 . 2 . . . . 81 Leu HD2 . 6943 1 1016 . 1 1 81 81 LEU C C 13 179.50 0.2 . 1 . . . . 81 Leu C . 6943 1 1017 . 1 1 81 81 LEU CA C 13 58.00 0.2 . 1 . . . . 81 Leu CA . 6943 1 1018 . 1 1 81 81 LEU CB C 13 43.10 0.2 . 1 . . . . 81 Leu CB . 6943 1 1019 . 1 1 81 81 LEU CG C 13 26.40 0.2 . 1 . . . . 81 Leu CG . 6943 1 1020 . 1 1 81 81 LEU CD1 C 13 28.30 0.2 . 2 . . . . 81 Leu CD1 . 6943 1 1021 . 1 1 81 81 LEU CD2 C 13 24.80 0.2 . 2 . . . . 81 Leu CD2 . 6943 1 1022 . 1 1 81 81 LEU N N 15 119.30 0.2 . 1 . . . . 81 Leu N . 6943 1 1023 . 1 1 82 82 THR H H 1 8.16 0.02 . 1 . . . . 82 Thr H . 6943 1 1024 . 1 1 82 82 THR HA H 1 3.73 0.02 . 1 . . . . 82 Thr HA . 6943 1 1025 . 1 1 82 82 THR HB H 1 3.53 0.02 . 1 . . . . 82 Thr HB . 6943 1 1026 . 1 1 82 82 THR HG21 H 1 0.22 0.02 . 1 . . . . 82 Thr HG2 . 6943 1 1027 . 1 1 82 82 THR HG22 H 1 0.22 0.02 . 1 . . . . 82 Thr HG2 . 6943 1 1028 . 1 1 82 82 THR HG23 H 1 0.22 0.02 . 1 . . . . 82 Thr HG2 . 6943 1 1029 . 1 1 82 82 THR C C 13 176.30 0.2 . 1 . . . . 82 Thr C . 6943 1 1030 . 1 1 82 82 THR CA C 13 65.50 0.2 . 1 . . . . 82 Thr CA . 6943 1 1031 . 1 1 82 82 THR CB C 13 68.00 0.2 . 1 . . . . 82 Thr CB . 6943 1 1032 . 1 1 82 82 THR CG2 C 13 20.80 0.2 . 1 . . . . 82 Thr CG2 . 6943 1 1033 . 1 1 82 82 THR N N 15 111.00 0.2 . 1 . . . . 82 Thr N . 6943 1 1034 . 1 1 83 83 ALA H H 1 7.40 0.02 . 1 . . . . 83 Ala H . 6943 1 1035 . 1 1 83 83 ALA HA H 1 3.96 0.02 . 1 . . . . 83 Ala HA . 6943 1 1036 . 1 1 83 83 ALA HB1 H 1 1.40 0.02 . 1 . . . . 83 Ala HB . 6943 1 1037 . 1 1 83 83 ALA HB2 H 1 1.40 0.02 . 1 . . . . 83 Ala HB . 6943 1 1038 . 1 1 83 83 ALA HB3 H 1 1.40 0.02 . 1 . . . . 83 Ala HB . 6943 1 1039 . 1 1 83 83 ALA C C 13 178.70 0.2 . 1 . . . . 83 Ala C . 6943 1 1040 . 1 1 83 83 ALA CA C 13 55.00 0.2 . 1 . . . . 83 Ala CA . 6943 1 1041 . 1 1 83 83 ALA CB C 13 18.00 0.2 . 1 . . . . 83 Ala CB . 6943 1 1042 . 1 1 83 83 ALA N N 15 123.20 0.2 . 1 . . . . 83 Ala N . 6943 1 1043 . 1 1 84 84 HIS H H 1 7.25 0.02 . 1 . . . . 84 His H . 6943 1 1044 . 1 1 84 84 HIS HA H 1 4.27 0.02 . 1 . . . . 84 His HA . 6943 1 1045 . 1 1 84 84 HIS HB2 H 1 2.96 0.02 . 2 . . . . 84 His HB2 . 6943 1 1046 . 1 1 84 84 HIS HB3 H 1 2.69 0.02 . 2 . . . . 84 His HB3 . 6943 1 1047 . 1 1 84 84 HIS C C 13 176.00 0.2 . 1 . . . . 84 His C . 6943 1 1048 . 1 1 84 84 HIS CA C 13 58.50 0.2 . 1 . . . . 84 His CA . 6943 1 1049 . 1 1 84 84 HIS CB C 13 30.00 0.2 . 1 . . . . 84 His CB . 6943 1 1050 . 1 1 84 84 HIS N N 15 112.40 0.2 . 1 . . . . 84 His N . 6943 1 1051 . 1 1 85 85 PHE H H 1 8.20 0.02 . 1 . . . . 85 Phe H . 6943 1 1052 . 1 1 85 85 PHE HA H 1 4.49 0.02 . 1 . . . . 85 Phe HA . 6943 1 1053 . 1 1 85 85 PHE HB2 H 1 3.08 0.02 . 2 . . . . 85 Phe HB2 . 6943 1 1054 . 1 1 85 85 PHE HB3 H 1 2.58 0.02 . 2 . . . . 85 Phe HB3 . 6943 1 1055 . 1 1 85 85 PHE HD1 H 1 7.28 0.02 . 3 . . . . 85 Phe HD1 . 6943 1 1056 . 1 1 85 85 PHE HD2 H 1 7.27 0.02 . 3 . . . . 85 Phe HD2 . 6943 1 1057 . 1 1 85 85 PHE HE1 H 1 7.32 0.02 . 1 . . . . 85 Phe HE1 . 6943 1 1058 . 1 1 85 85 PHE HE2 H 1 7.32 0.02 . 1 . . . . 85 Phe HE2 . 6943 1 1059 . 1 1 85 85 PHE HZ H 1 7.37 0.02 . 1 . . . . 85 Phe HZ . 6943 1 1060 . 1 1 85 85 PHE C C 13 174.70 0.2 . 1 . . . . 85 Phe C . 6943 1 1061 . 1 1 85 85 PHE CA C 13 59.90 0.2 . 1 . . . . 85 Phe CA . 6943 1 1062 . 1 1 85 85 PHE CB C 13 41.30 0.2 . 1 . . . . 85 Phe CB . 6943 1 1063 . 1 1 85 85 PHE CD1 C 13 131.70 0.2 . 1 . . . . 85 Phe CD . 6943 1 1064 . 1 1 85 85 PHE CD2 C 13 131.70 0.2 . 1 . . . . 85 Phe CD . 6943 1 1065 . 1 1 85 85 PHE CE1 C 13 130.00 0.2 . 1 . . . . 85 Phe CE . 6943 1 1066 . 1 1 85 85 PHE CE2 C 13 130.00 0.2 . 1 . . . . 85 Phe CE . 6943 1 1067 . 1 1 85 85 PHE CZ C 13 131.70 0.2 . 1 . . . . 85 Phe CZ . 6943 1 1068 . 1 1 85 85 PHE N N 15 113.00 0.2 . 1 . . . . 85 Phe N . 6943 1 1069 . 1 1 86 86 ASP H H 1 8.35 0.02 . 1 . . . . 86 Asp H . 6943 1 1070 . 1 1 86 86 ASP HA H 1 5.39 0.02 . 1 . . . . 86 Asp HA . 6943 1 1071 . 1 1 86 86 ASP HB2 H 1 2.98 0.02 . 2 . . . . 86 Asp HB2 . 6943 1 1072 . 1 1 86 86 ASP HB3 H 1 2.91 0.02 . 2 . . . . 86 Asp HB3 . 6943 1 1073 . 1 1 86 86 ASP CA C 13 52.10 0.2 . 1 . . . . 86 Asp CA . 6943 1 1074 . 1 1 86 86 ASP CB C 13 42.50 0.2 . 1 . . . . 86 Asp CB . 6943 1 1075 . 1 1 86 86 ASP N N 15 117.90 0.2 . 1 . . . . 86 Asp N . 6943 1 1076 . 1 1 87 87 PRO HA H 1 4.28 0.02 . 1 . . . . 87 Pro HA . 6943 1 1077 . 1 1 87 87 PRO HB2 H 1 2.38 0.02 . 2 . . . . 87 Pro HB2 . 6943 1 1078 . 1 1 87 87 PRO HB3 H 1 1.94 0.02 . 2 . . . . 87 Pro HB3 . 6943 1 1079 . 1 1 87 87 PRO HG2 H 1 2.01 0.02 . 2 . . . . 87 Pro HG2 . 6943 1 1080 . 1 1 87 87 PRO HG3 H 1 1.97 0.02 . 2 . . . . 87 Pro HG3 . 6943 1 1081 . 1 1 87 87 PRO HD2 H 1 3.23 0.02 . 2 . . . . 87 Pro HD2 . 6943 1 1082 . 1 1 87 87 PRO HD3 H 1 3.25 0.02 . 2 . . . . 87 Pro HD3 . 6943 1 1083 . 1 1 87 87 PRO C C 13 178.40 0.2 . 1 . . . . 87 Pro C . 6943 1 1084 . 1 1 87 87 PRO CA C 13 65.30 0.2 . 1 . . . . 87 Pro CA . 6943 1 1085 . 1 1 87 87 PRO CB C 13 31.50 0.2 . 1 . . . . 87 Pro CB . 6943 1 1086 . 1 1 87 87 PRO CG C 13 27.80 0.2 . 1 . . . . 87 Pro CG . 6943 1 1087 . 1 1 87 87 PRO CD C 13 50.50 0.2 . 1 . . . . 87 Pro CD . 6943 1 1088 . 1 1 88 88 ASP H H 1 8.73 0.02 . 1 . . . . 88 Asp H . 6943 1 1089 . 1 1 88 88 ASP HA H 1 4.65 0.02 . 1 . . . . 88 Asp HA . 6943 1 1090 . 1 1 88 88 ASP HB2 H 1 2.67 0.02 . 1 . . . . 88 Asp HB2 . 6943 1 1091 . 1 1 88 88 ASP HB3 H 1 2.67 0.02 . 1 . . . . 88 Asp HB3 . 6943 1 1092 . 1 1 88 88 ASP C C 13 177.50 0.2 . 1 . . . . 88 Asp C . 6943 1 1093 . 1 1 88 88 ASP CA C 13 54.60 0.2 . 1 . . . . 88 Asp CA . 6943 1 1094 . 1 1 88 88 ASP CB C 13 40.90 0.2 . 1 . . . . 88 Asp CB . 6943 1 1095 . 1 1 88 88 ASP N N 15 116.00 0.2 . 1 . . . . 88 Asp N . 6943 1 1096 . 1 1 89 89 GLY H H 1 8.23 0.02 . 1 . . . . 89 Gly H . 6943 1 1097 . 1 1 89 89 GLY HA2 H 1 3.83 0.02 . 2 . . . . 89 Gly HA2 . 6943 1 1098 . 1 1 89 89 GLY HA3 H 1 3.81 0.02 . 2 . . . . 89 Gly HA3 . 6943 1 1099 . 1 1 89 89 GLY C C 13 175.90 0.2 . 1 . . . . 89 Gly C . 6943 1 1100 . 1 1 89 89 GLY CA C 13 47.40 0.2 . 1 . . . . 89 Gly CA . 6943 1 1101 . 1 1 89 89 GLY N N 15 111.00 0.2 . 1 . . . . 89 Gly N . 6943 1 1102 . 1 1 90 90 LYS H H 1 9.23 0.02 . 1 . . . . 90 Lys H . 6943 1 1103 . 1 1 90 90 LYS HA H 1 3.68 0.02 . 1 . . . . 90 Lys HA . 6943 1 1104 . 1 1 90 90 LYS HB2 H 1 0.98 0.02 . 1 . . . . 90 Lys HB2 . 6943 1 1105 . 1 1 90 90 LYS HB3 H 1 0.98 0.02 . 1 . . . . 90 Lys HB3 . 6943 1 1106 . 1 1 90 90 LYS HG2 H 1 0.78 0.02 . 2 . . . . 90 Lys HG2 . 6943 1 1107 . 1 1 90 90 LYS HG3 H 1 0.54 0.02 . 2 . . . . 90 Lys HG3 . 6943 1 1108 . 1 1 90 90 LYS HD2 H 1 1.34 0.02 . 2 . . . . 90 Lys HD2 . 6943 1 1109 . 1 1 90 90 LYS HD3 H 1 1.29 0.02 . 2 . . . . 90 Lys HD3 . 6943 1 1110 . 1 1 90 90 LYS HE2 H 1 2.66 0.02 . 1 . . . . 90 Lys HE2 . 6943 1 1111 . 1 1 90 90 LYS HE3 H 1 2.66 0.02 . 1 . . . . 90 Lys HE3 . 6943 1 1112 . 1 1 90 90 LYS C C 13 178.40 0.2 . 1 . . . . 90 Lys C . 6943 1 1113 . 1 1 90 90 LYS CA C 13 59.20 0.2 . 1 . . . . 90 Lys CA . 6943 1 1114 . 1 1 90 90 LYS CB C 13 32.60 0.2 . 1 . . . . 90 Lys CB . 6943 1 1115 . 1 1 90 90 LYS CG C 13 24.50 0.2 . 1 . . . . 90 Lys CG . 6943 1 1116 . 1 1 90 90 LYS CD C 13 29.10 0.2 . 1 . . . . 90 Lys CD . 6943 1 1117 . 1 1 90 90 LYS CE C 13 41.90 0.2 . 1 . . . . 90 Lys CE . 6943 1 1118 . 1 1 90 90 LYS N N 15 124.00 0.2 . 1 . . . . 90 Lys N . 6943 1 1119 . 1 1 91 91 TRP H H 1 9.73 0.02 . 1 . . . . 91 Trp H . 6943 1 1120 . 1 1 91 91 TRP HA H 1 4.88 0.02 . 1 . . . . 91 Trp HA . 6943 1 1121 . 1 1 91 91 TRP HB2 H 1 3.27 0.02 . 2 . . . . 91 Trp HB2 . 6943 1 1122 . 1 1 91 91 TRP HB3 H 1 3.23 0.02 . 2 . . . . 91 Trp HB3 . 6943 1 1123 . 1 1 91 91 TRP C C 13 177.60 0.2 . 1 . . . . 91 Trp C . 6943 1 1124 . 1 1 91 91 TRP CA C 13 57.00 0.2 . 1 . . . . 91 Trp CA . 6943 1 1125 . 1 1 91 91 TRP CB C 13 29.80 0.2 . 1 . . . . 91 Trp CB . 6943 1 1126 . 1 1 91 91 TRP N N 15 121.30 0.2 . 1 . . . . 91 Trp N . 6943 1 1127 . 1 1 92 92 ARG H H 1 8.53 0.02 . 1 . . . . 92 Arg H . 6943 1 1128 . 1 1 92 92 ARG HA H 1 4.23 0.02 . 1 . . . . 92 Arg HA . 6943 1 1129 . 1 1 92 92 ARG HB2 H 1 1.93 0.02 . 2 . . . . 92 Arg HB2 . 6943 1 1130 . 1 1 92 92 ARG HG2 H 1 1.65 0.02 . 2 . . . . 92 Arg HG2 . 6943 1 1131 . 1 1 92 92 ARG HG3 H 1 1.60 0.02 . 2 . . . . 92 Arg HG3 . 6943 1 1132 . 1 1 92 92 ARG HD2 H 1 3.09 0.02 . 1 . . . . 92 Arg HD2 . 6943 1 1133 . 1 1 92 92 ARG HD3 H 1 3.09 0.02 . 1 . . . . 92 Arg HD3 . 6943 1 1134 . 1 1 92 92 ARG HE H 1 7.93 0.02 . 1 . . . . 92 Arg HE . 6943 1 1135 . 1 1 92 92 ARG C C 13 177.80 0.2 . 1 . . . . 92 Arg C . 6943 1 1136 . 1 1 92 92 ARG CA C 13 60.70 0.2 . 1 . . . . 92 Arg CA . 6943 1 1137 . 1 1 92 92 ARG CB C 13 30.50 0.2 . 1 . . . . 92 Arg CB . 6943 1 1138 . 1 1 92 92 ARG CG C 13 26.50 0.2 . 1 . . . . 92 Arg CG . 6943 1 1139 . 1 1 92 92 ARG CD C 13 43.80 0.2 . 1 . . . . 92 Arg CD . 6943 1 1140 . 1 1 92 92 ARG N N 15 121.60 0.2 . 1 . . . . 92 Arg N . 6943 1 1141 . 1 1 92 92 ARG NE N 15 84.30 0.2 . 1 . . . . 92 Arg NE . 6943 1 1142 . 1 1 93 93 LYS H H 1 7.89 0.02 . 1 . . . . 93 Lys H . 6943 1 1143 . 1 1 93 93 LYS HA H 1 4.14 0.02 . 1 . . . . 93 Lys HA . 6943 1 1144 . 1 1 93 93 LYS HB2 H 1 1.81 0.02 . 1 . . . . 93 Lys HB2 . 6943 1 1145 . 1 1 93 93 LYS HB3 H 1 1.81 0.02 . 1 . . . . 93 Lys HB3 . 6943 1 1146 . 1 1 93 93 LYS HG2 H 1 1.46 0.02 . 2 . . . . 93 Lys HG2 . 6943 1 1147 . 1 1 93 93 LYS HG3 H 1 1.41 0.02 . 2 . . . . 93 Lys HG3 . 6943 1 1148 . 1 1 93 93 LYS HD2 H 1 1.66 0.02 . 1 . . . . 93 Lys HD2 . 6943 1 1149 . 1 1 93 93 LYS HD3 H 1 1.66 0.02 . 1 . . . . 93 Lys HD3 . 6943 1 1150 . 1 1 93 93 LYS HE2 H 1 3.00 0.02 . 1 . . . . 93 Lys HE2 . 6943 1 1151 . 1 1 93 93 LYS HE3 H 1 3.00 0.02 . 1 . . . . 93 Lys HE3 . 6943 1 1152 . 1 1 93 93 LYS C C 13 177.90 0.2 . 1 . . . . 93 Lys C . 6943 1 1153 . 1 1 93 93 LYS CA C 13 59.30 0.2 . 1 . . . . 93 Lys CA . 6943 1 1154 . 1 1 93 93 LYS CB C 13 31.90 0.2 . 1 . . . . 93 Lys CB . 6943 1 1155 . 1 1 93 93 LYS CG C 13 24.70 0.2 . 1 . . . . 93 Lys CG . 6943 1 1156 . 1 1 93 93 LYS CD C 13 29.10 0.2 . 1 . . . . 93 Lys CD . 6943 1 1157 . 1 1 93 93 LYS CE C 13 42.10 0.2 . 1 . . . . 93 Lys CE . 6943 1 1158 . 1 1 93 93 LYS N N 15 116.90 0.2 . 1 . . . . 93 Lys N . 6943 1 1159 . 1 1 94 94 LYS H H 1 7.40 0.02 . 1 . . . . 94 Lys H . 6943 1 1160 . 1 1 94 94 LYS HA H 1 4.08 0.02 . 1 . . . . 94 Lys HA . 6943 1 1161 . 1 1 94 94 LYS HB2 H 1 1.96 0.02 . 2 . . . . 94 Lys HB2 . 6943 1 1162 . 1 1 94 94 LYS HB3 H 1 1.91 0.02 . 2 . . . . 94 Lys HB3 . 6943 1 1163 . 1 1 94 94 LYS HG2 H 1 1.38 0.02 . 1 . . . . 94 Lys HG2 . 6943 1 1164 . 1 1 94 94 LYS HG3 H 1 1.38 0.02 . 1 . . . . 94 Lys HG3 . 6943 1 1165 . 1 1 94 94 LYS HD2 H 1 1.64 0.02 . 2 . . . . 94 Lys HD2 . 6943 1 1166 . 1 1 94 94 LYS HD3 H 1 1.42 0.02 . 2 . . . . 94 Lys HD3 . 6943 1 1167 . 1 1 94 94 LYS HE2 H 1 2.76 0.02 . 1 . . . . 94 Lys HE2 . 6943 1 1168 . 1 1 94 94 LYS HE3 H 1 2.76 0.02 . 1 . . . . 94 Lys HE3 . 6943 1 1169 . 1 1 94 94 LYS C C 13 180.20 0.2 . 1 . . . . 94 Lys C . 6943 1 1170 . 1 1 94 94 LYS CA C 13 59.50 0.2 . 1 . . . . 94 Lys CA . 6943 1 1171 . 1 1 94 94 LYS CB C 13 32.10 0.2 . 1 . . . . 94 Lys CB . 6943 1 1172 . 1 1 94 94 LYS CG C 13 25.20 0.2 . 1 . . . . 94 Lys CG . 6943 1 1173 . 1 1 94 94 LYS CD C 13 30.10 0.2 . 1 . . . . 94 Lys CD . 6943 1 1174 . 1 1 94 94 LYS CE C 13 42.20 0.2 . 1 . . . . 94 Lys CE . 6943 1 1175 . 1 1 94 94 LYS N N 15 118.90 0.2 . 1 . . . . 94 Lys N . 6943 1 1176 . 1 1 95 95 TYR H H 1 8.13 0.02 . 1 . . . . 95 Tyr H . 6943 1 1177 . 1 1 95 95 TYR HA H 1 4.41 0.02 . 1 . . . . 95 Tyr HA . 6943 1 1178 . 1 1 95 95 TYR HB2 H 1 3.15 0.02 . 2 . . . . 95 Tyr HB2 . 6943 1 1179 . 1 1 95 95 TYR HB3 H 1 3.17 0.02 . 2 . . . . 95 Tyr HB3 . 6943 1 1180 . 1 1 95 95 TYR HD1 H 1 7.24 0.02 . 1 . . . . 95 Tyr HD1 . 6943 1 1181 . 1 1 95 95 TYR HD2 H 1 7.24 0.02 . 1 . . . . 95 Tyr HD2 . 6943 1 1182 . 1 1 95 95 TYR HE1 H 1 6.79 0.02 . 1 . . . . 95 Tyr HE1 . 6943 1 1183 . 1 1 95 95 TYR HE2 H 1 6.79 0.02 . 1 . . . . 95 Tyr HE2 . 6943 1 1184 . 1 1 95 95 TYR C C 13 179.50 0.2 . 1 . . . . 95 Tyr C . 6943 1 1185 . 1 1 95 95 TYR CA C 13 61.00 0.2 . 1 . . . . 95 Tyr CA . 6943 1 1186 . 1 1 95 95 TYR CB C 13 38.20 0.2 . 1 . . . . 95 Tyr CB . 6943 1 1187 . 1 1 95 95 TYR CD1 C 13 132.60 0.2 . 1 . . . . 95 Tyr CD . 6943 1 1188 . 1 1 95 95 TYR CD2 C 13 132.60 0.2 . 1 . . . . 95 Tyr CD . 6943 1 1189 . 1 1 95 95 TYR CE1 C 13 117.70 0.2 . 1 . . . . 95 Tyr CE . 6943 1 1190 . 1 1 95 95 TYR CE2 C 13 117.70 0.2 . 1 . . . . 95 Tyr CE . 6943 1 1191 . 1 1 95 95 TYR N N 15 117.30 0.2 . 1 . . . . 95 Tyr N . 6943 1 1192 . 1 1 96 96 GLU H H 1 9.14 0.02 . 1 . . . . 96 Glu H . 6943 1 1193 . 1 1 96 96 GLU HA H 1 4.11 0.02 . 1 . . . . 96 Glu HA . 6943 1 1194 . 1 1 96 96 GLU HB2 H 1 2.01 0.02 . 1 . . . . 96 Glu HB2 . 6943 1 1195 . 1 1 96 96 GLU HB3 H 1 2.01 0.02 . 1 . . . . 96 Glu HB3 . 6943 1 1196 . 1 1 96 96 GLU HG2 H 1 2.21 0.02 . 1 . . . . 96 Glu HG2 . 6943 1 1197 . 1 1 96 96 GLU HG3 H 1 2.21 0.02 . 1 . . . . 96 Glu HG3 . 6943 1 1198 . 1 1 96 96 GLU C C 13 178.80 0.2 . 1 . . . . 96 Glu C . 6943 1 1199 . 1 1 96 96 GLU CA C 13 60.50 0.2 . 1 . . . . 96 Glu CA . 6943 1 1200 . 1 1 96 96 GLU CB C 13 29.00 0.2 . 1 . . . . 96 Glu CB . 6943 1 1201 . 1 1 96 96 GLU CG C 13 36.70 0.2 . 1 . . . . 96 Glu CG . 6943 1 1202 . 1 1 96 96 GLU N N 15 121.90 0.2 . 1 . . . . 96 Glu N . 6943 1 1203 . 1 1 97 97 ASP H H 1 9.11 0.02 . 1 . . . . 97 Asp H . 6943 1 1204 . 1 1 97 97 ASP HA H 1 4.42 0.02 . 1 . . . . 97 Asp HA . 6943 1 1205 . 1 1 97 97 ASP HB2 H 1 2.89 0.02 . 2 . . . . 97 Asp HB2 . 6943 1 1206 . 1 1 97 97 ASP HB3 H 1 2.57 0.02 . 2 . . . . 97 Asp HB3 . 6943 1 1207 . 1 1 97 97 ASP C C 13 179.90 0.2 . 1 . . . . 97 Asp C . 6943 1 1208 . 1 1 97 97 ASP CA C 13 57.70 0.2 . 1 . . . . 97 Asp CA . 6943 1 1209 . 1 1 97 97 ASP CB C 13 39.50 0.2 . 1 . . . . 97 Asp CB . 6943 1 1210 . 1 1 97 97 ASP N N 15 120.60 0.2 . 1 . . . . 97 Asp N . 6943 1 1211 . 1 1 98 98 ARG H H 1 7.64 0.02 . 1 . . . . 98 Arg H . 6943 1 1212 . 1 1 98 98 ARG HA H 1 4.11 0.02 . 1 . . . . 98 Arg HA . 6943 1 1213 . 1 1 98 98 ARG HB2 H 1 2.08 0.02 . 2 . . . . 98 Arg HB2 . 6943 1 1214 . 1 1 98 98 ARG HB3 H 1 1.96 0.02 . 2 . . . . 98 Arg HB3 . 6943 1 1215 . 1 1 98 98 ARG HG2 H 1 1.88 0.02 . 2 . . . . 98 Arg HG2 . 6943 1 1216 . 1 1 98 98 ARG HG3 H 1 1.61 0.02 . 2 . . . . 98 Arg HG3 . 6943 1 1217 . 1 1 98 98 ARG HD2 H 1 3.17 0.02 . 1 . . . . 98 Arg HD2 . 6943 1 1218 . 1 1 98 98 ARG HD3 H 1 3.17 0.02 . 1 . . . . 98 Arg HD3 . 6943 1 1219 . 1 1 98 98 ARG HE H 1 7.86 0.02 . 1 . . . . 98 Arg HE . 6943 1 1220 . 1 1 98 98 ARG C C 13 178.50 0.2 . 1 . . . . 98 Arg C . 6943 1 1221 . 1 1 98 98 ARG CA C 13 59.20 0.2 . 1 . . . . 98 Arg CA . 6943 1 1222 . 1 1 98 98 ARG CB C 13 30.50 0.2 . 1 . . . . 98 Arg CB . 6943 1 1223 . 1 1 98 98 ARG CG C 13 26.80 0.2 . 1 . . . . 98 Arg CG . 6943 1 1224 . 1 1 98 98 ARG CD C 13 43.80 0.2 . 1 . . . . 98 Arg CD . 6943 1 1225 . 1 1 98 98 ARG N N 15 120.80 0.2 . 1 . . . . 98 Arg N . 6943 1 1226 . 1 1 98 98 ARG NE N 15 84.90 0.2 . 1 . . . . 98 Arg NE . 6943 1 1227 . 1 1 99 99 ALA H H 1 7.89 0.02 . 1 . . . . 99 Ala H . 6943 1 1228 . 1 1 99 99 ALA HA H 1 4.00 0.02 . 1 . . . . 99 Ala HA . 6943 1 1229 . 1 1 99 99 ALA HB1 H 1 1.39 0.02 . 1 . . . . 99 Ala HB . 6943 1 1230 . 1 1 99 99 ALA HB2 H 1 1.39 0.02 . 1 . . . . 99 Ala HB . 6943 1 1231 . 1 1 99 99 ALA HB3 H 1 1.39 0.02 . 1 . . . . 99 Ala HB . 6943 1 1232 . 1 1 99 99 ALA C C 13 180.20 0.2 . 1 . . . . 99 Ala C . 6943 1 1233 . 1 1 99 99 ALA CA C 13 55.30 0.2 . 1 . . . . 99 Ala CA . 6943 1 1234 . 1 1 99 99 ALA CB C 13 17.80 0.2 . 1 . . . . 99 Ala CB . 6943 1 1235 . 1 1 99 99 ALA N N 15 123.30 0.2 . 1 . . . . 99 Ala N . 6943 1 1236 . 1 1 100 100 LYS H H 1 8.62 0.02 . 1 . . . . 100 Lys H . 6943 1 1237 . 1 1 100 100 LYS HA H 1 4.44 0.02 . 1 . . . . 100 Lys HA . 6943 1 1238 . 1 1 100 100 LYS HB2 H 1 1.93 0.02 . 2 . . . . 100 Lys HB2 . 6943 1 1239 . 1 1 100 100 LYS HB3 H 1 1.88 0.02 . 2 . . . . 100 Lys HB3 . 6943 1 1240 . 1 1 100 100 LYS HG2 H 1 1.57 0.02 . 2 . . . . 100 Lys HG2 . 6943 1 1241 . 1 1 100 100 LYS HD2 H 1 1.65 0.02 . 2 . . . . 100 Lys HD2 . 6943 1 1242 . 1 1 100 100 LYS HD3 H 1 1.68 0.02 . 2 . . . . 100 Lys HD3 . 6943 1 1243 . 1 1 100 100 LYS HE2 H 1 2.96 0.02 . 1 . . . . 100 Lys HE2 . 6943 1 1244 . 1 1 100 100 LYS HE3 H 1 2.96 0.02 . 1 . . . . 100 Lys HE3 . 6943 1 1245 . 1 1 100 100 LYS C C 13 181.10 0.2 . 1 . . . . 100 Lys C . 6943 1 1246 . 1 1 100 100 LYS CA C 13 59.20 0.2 . 1 . . . . 100 Lys CA . 6943 1 1247 . 1 1 100 100 LYS CB C 13 32.20 0.2 . 1 . . . . 100 Lys CB . 6943 1 1248 . 1 1 100 100 LYS CG C 13 25.10 0.2 . 1 . . . . 100 Lys CG . 6943 1 1249 . 1 1 100 100 LYS CD C 13 29.30 0.2 . 1 . . . . 100 Lys CD . 6943 1 1250 . 1 1 100 100 LYS CE C 13 42.30 0.2 . 1 . . . . 100 Lys CE . 6943 1 1251 . 1 1 100 100 LYS N N 15 120.10 0.2 . 1 . . . . 100 Lys N . 6943 1 1252 . 1 1 101 101 ALA H H 1 7.79 0.02 . 1 . . . . 101 Ala H . 6943 1 1253 . 1 1 101 101 ALA HA H 1 4.19 0.02 . 1 . . . . 101 Ala HA . 6943 1 1254 . 1 1 101 101 ALA HB1 H 1 1.51 0.02 . 1 . . . . 101 Ala HB . 6943 1 1255 . 1 1 101 101 ALA HB2 H 1 1.51 0.02 . 1 . . . . 101 Ala HB . 6943 1 1256 . 1 1 101 101 ALA HB3 H 1 1.51 0.02 . 1 . . . . 101 Ala HB . 6943 1 1257 . 1 1 101 101 ALA C C 13 178.80 0.2 . 1 . . . . 101 Ala C . 6943 1 1258 . 1 1 101 101 ALA CA C 13 54.20 0.2 . 1 . . . . 101 Ala CA . 6943 1 1259 . 1 1 101 101 ALA CB C 13 17.80 0.2 . 1 . . . . 101 Ala CB . 6943 1 1260 . 1 1 101 101 ALA N N 15 122.00 0.2 . 1 . . . . 101 Ala N . 6943 1 1261 . 1 1 102 102 LYS H H 1 7.46 0.02 . 1 . . . . 102 Lys H . 6943 1 1262 . 1 1 102 102 LYS HA H 1 4.44 0.02 . 1 . . . . 102 Lys HA . 6943 1 1263 . 1 1 102 102 LYS HB2 H 1 1.99 0.02 . 2 . . . . 102 Lys HB2 . 6943 1 1264 . 1 1 102 102 LYS HB3 H 1 1.88 0.02 . 2 . . . . 102 Lys HB3 . 6943 1 1265 . 1 1 102 102 LYS HG2 H 1 1.61 0.02 . 2 . . . . 102 Lys HG2 . 6943 1 1266 . 1 1 102 102 LYS HG3 H 1 1.49 0.02 . 2 . . . . 102 Lys HG3 . 6943 1 1267 . 1 1 102 102 LYS HD2 H 1 1.53 0.02 . 1 . . . . 102 Lys HD2 . 6943 1 1268 . 1 1 102 102 LYS HD3 H 1 1.53 0.02 . 1 . . . . 102 Lys HD3 . 6943 1 1269 . 1 1 102 102 LYS HE2 H 1 2.87 0.02 . 1 . . . . 102 Lys HE2 . 6943 1 1270 . 1 1 102 102 LYS HE3 H 1 2.87 0.02 . 1 . . . . 102 Lys HE3 . 6943 1 1271 . 1 1 102 102 LYS C C 13 176.80 0.2 . 1 . . . . 102 Lys C . 6943 1 1272 . 1 1 102 102 LYS CA C 13 55.90 0.2 . 1 . . . . 102 Lys CA . 6943 1 1273 . 1 1 102 102 LYS CB C 13 32.50 0.2 . 1 . . . . 102 Lys CB . 6943 1 1274 . 1 1 102 102 LYS CG C 13 24.80 0.2 . 1 . . . . 102 Lys CG . 6943 1 1275 . 1 1 102 102 LYS CD C 13 29.20 0.2 . 1 . . . . 102 Lys CD . 6943 1 1276 . 1 1 102 102 LYS CE C 13 42.00 0.2 . 1 . . . . 102 Lys CE . 6943 1 1277 . 1 1 102 102 LYS N N 15 116.00 0.2 . 1 . . . . 102 Lys N . 6943 1 1278 . 1 1 103 103 GLY H H 1 7.93 0.02 . 1 . . . . 103 Gly H . 6943 1 1279 . 1 1 103 103 GLY HA2 H 1 3.67 0.02 . 2 . . . . 103 Gly HA2 . 6943 1 1280 . 1 1 103 103 GLY HA3 H 1 4.21 0.02 . 2 . . . . 103 Gly HA3 . 6943 1 1281 . 1 1 103 103 GLY C C 13 174.10 0.2 . 1 . . . . 103 Gly C . 6943 1 1282 . 1 1 103 103 GLY CA C 13 45.00 0.2 . 1 . . . . 103 Gly CA . 6943 1 1283 . 1 1 103 103 GLY N N 15 107.50 0.2 . 1 . . . . 103 Gly N . 6943 1 1284 . 1 1 104 104 ILE H H 1 7.50 0.02 . 1 . . . . 104 Ile H . 6943 1 1285 . 1 1 104 104 ILE HA H 1 3.86 0.02 . 1 . . . . 104 Ile HA . 6943 1 1286 . 1 1 104 104 ILE HB H 1 1.43 0.02 . 1 . . . . 104 Ile HB . 6943 1 1287 . 1 1 104 104 ILE HG12 H 1 1.45 0.02 . 2 . . . . 104 Ile HG12 . 6943 1 1288 . 1 1 104 104 ILE HG13 H 1 0.80 0.02 . 2 . . . . 104 Ile HG13 . 6943 1 1289 . 1 1 104 104 ILE HG21 H 1 0.60 0.02 . 1 . . . . 104 Ile HG2 . 6943 1 1290 . 1 1 104 104 ILE HG22 H 1 0.60 0.02 . 1 . . . . 104 Ile HG2 . 6943 1 1291 . 1 1 104 104 ILE HG23 H 1 0.60 0.02 . 1 . . . . 104 Ile HG2 . 6943 1 1292 . 1 1 104 104 ILE HD11 H 1 0.79 0.02 . 1 . . . . 104 Ile HD1 . 6943 1 1293 . 1 1 104 104 ILE HD12 H 1 0.79 0.02 . 1 . . . . 104 Ile HD1 . 6943 1 1294 . 1 1 104 104 ILE HD13 H 1 0.79 0.02 . 1 . . . . 104 Ile HD1 . 6943 1 1295 . 1 1 104 104 ILE C C 13 174.90 0.2 . 1 . . . . 104 Ile C . 6943 1 1296 . 1 1 104 104 ILE CA C 13 61.80 0.2 . 1 . . . . 104 Ile CA . 6943 1 1297 . 1 1 104 104 ILE CB C 13 37.30 0.2 . 1 . . . . 104 Ile CB . 6943 1 1298 . 1 1 104 104 ILE CG1 C 13 28.60 0.2 . 1 . . . . 104 Ile CG1 . 6943 1 1299 . 1 1 104 104 ILE CG2 C 13 16.90 0.2 . 1 . . . . 104 Ile CG2 . 6943 1 1300 . 1 1 104 104 ILE CD1 C 13 13.00 0.2 . 1 . . . . 104 Ile CD1 . 6943 1 1301 . 1 1 104 104 ILE N N 15 122.60 0.2 . 1 . . . . 104 Ile N . 6943 1 1302 . 1 1 105 105 VAL H H 1 8.35 0.02 . 1 . . . . 105 Val H . 6943 1 1303 . 1 1 105 105 VAL HA H 1 3.97 0.02 . 1 . . . . 105 Val HA . 6943 1 1304 . 1 1 105 105 VAL HB H 1 1.89 0.02 . 1 . . . . 105 Val HB . 6943 1 1305 . 1 1 105 105 VAL HG11 H 1 0.89 0.02 . 2 . . . . 105 Val HG1 . 6943 1 1306 . 1 1 105 105 VAL HG12 H 1 0.89 0.02 . 2 . . . . 105 Val HG1 . 6943 1 1307 . 1 1 105 105 VAL HG13 H 1 0.89 0.02 . 2 . . . . 105 Val HG1 . 6943 1 1308 . 1 1 105 105 VAL HG21 H 1 0.79 0.02 . 2 . . . . 105 Val HG2 . 6943 1 1309 . 1 1 105 105 VAL HG22 H 1 0.79 0.02 . 2 . . . . 105 Val HG2 . 6943 1 1310 . 1 1 105 105 VAL HG23 H 1 0.79 0.02 . 2 . . . . 105 Val HG2 . 6943 1 1311 . 1 1 105 105 VAL C C 13 175.70 0.2 . 1 . . . . 105 Val C . 6943 1 1312 . 1 1 105 105 VAL CA C 13 62.00 0.2 . 1 . . . . 105 Val CA . 6943 1 1313 . 1 1 105 105 VAL CB C 13 32.70 0.2 . 1 . . . . 105 Val CB . 6943 1 1314 . 1 1 105 105 VAL CG1 C 13 21.10 0.2 . 2 . . . . 105 Val CG1 . 6943 1 1315 . 1 1 105 105 VAL CG2 C 13 21.00 0.2 . 2 . . . . 105 Val CG2 . 6943 1 1316 . 1 1 105 105 VAL N N 15 127.90 0.2 . 1 . . . . 105 Val N . 6943 1 1317 . 1 1 106 106 ILE H H 1 8.51 0.02 . 1 . . . . 106 Ile H . 6943 1 1318 . 1 1 106 106 ILE HA H 1 4.48 0.02 . 1 . . . . 106 Ile HA . 6943 1 1319 . 1 1 106 106 ILE HB H 1 1.76 0.02 . 1 . . . . 106 Ile HB . 6943 1 1320 . 1 1 106 106 ILE HG12 H 1 1.44 0.02 . 2 . . . . 106 Ile HG12 . 6943 1 1321 . 1 1 106 106 ILE HG13 H 1 0.80 0.02 . 2 . . . . 106 Ile HG13 . 6943 1 1322 . 1 1 106 106 ILE HG21 H 1 0.88 0.02 . 1 . . . . 106 Ile HG2 . 6943 1 1323 . 1 1 106 106 ILE HG22 H 1 0.88 0.02 . 1 . . . . 106 Ile HG2 . 6943 1 1324 . 1 1 106 106 ILE HG23 H 1 0.88 0.02 . 1 . . . . 106 Ile HG2 . 6943 1 1325 . 1 1 106 106 ILE HD11 H 1 0.81 0.02 . 1 . . . . 106 Ile HD1 . 6943 1 1326 . 1 1 106 106 ILE HD12 H 1 0.81 0.02 . 1 . . . . 106 Ile HD1 . 6943 1 1327 . 1 1 106 106 ILE HD13 H 1 0.81 0.02 . 1 . . . . 106 Ile HD1 . 6943 1 1328 . 1 1 106 106 ILE CA C 13 58.50 0.2 . 1 . . . . 106 Ile CA . 6943 1 1329 . 1 1 106 106 ILE CB C 13 38.90 0.2 . 1 . . . . 106 Ile CB . 6943 1 1330 . 1 1 106 106 ILE CG1 C 13 26.70 0.2 . 1 . . . . 106 Ile CG1 . 6943 1 1331 . 1 1 106 106 ILE CG2 C 13 17.10 0.2 . 1 . . . . 106 Ile CG2 . 6943 1 1332 . 1 1 106 106 ILE CD1 C 13 14.00 0.2 . 1 . . . . 106 Ile CD1 . 6943 1 1333 . 1 1 106 106 ILE N N 15 128.10 0.2 . 1 . . . . 106 Ile N . 6943 1 1334 . 1 1 107 107 PRO HA H 1 4.40 0.02 . 1 . . . . 107 Pro HA . 6943 1 1335 . 1 1 107 107 PRO HB2 H 1 2.25 0.02 . 2 . . . . 107 Pro HB2 . 6943 1 1336 . 1 1 107 107 PRO HB3 H 1 1.90 0.02 . 2 . . . . 107 Pro HB3 . 6943 1 1337 . 1 1 107 107 PRO HG2 H 1 2.00 0.02 . 2 . . . . 107 Pro HG2 . 6943 1 1338 . 1 1 107 107 PRO HG3 H 1 1.96 0.02 . 2 . . . . 107 Pro HG3 . 6943 1 1339 . 1 1 107 107 PRO HD2 H 1 3.73 0.02 . 1 . . . . 107 Pro HD2 . 6943 1 1340 . 1 1 107 107 PRO HD3 H 1 3.73 0.02 . 1 . . . . 107 Pro HD3 . 6943 1 1341 . 1 1 107 107 PRO C C 13 175.70 0.2 . 1 . . . . 107 Pro C . 6943 1 1342 . 1 1 107 107 PRO CA C 13 63.30 0.2 . 1 . . . . 107 Pro CA . 6943 1 1343 . 1 1 107 107 PRO CB C 13 32.00 0.2 . 1 . . . . 107 Pro CB . 6943 1 1344 . 1 1 107 107 PRO CG C 13 27.30 0.2 . 1 . . . . 107 Pro CG . 6943 1 1345 . 1 1 107 107 PRO CD C 13 50.80 0.2 . 1 . . . . 107 Pro CD . 6943 1 1346 . 1 1 108 108 GLU H H 1 8.05 0.02 . 1 . . . . 108 Glu H . 6943 1 1347 . 1 1 108 108 GLU HA H 1 4.08 0.02 . 1 . . . . 108 Glu HA . 6943 1 1348 . 1 1 108 108 GLU HB2 H 1 2.01 0.02 . 2 . . . . 108 Glu HB2 . 6943 1 1349 . 1 1 108 108 GLU HB3 H 1 1.86 0.02 . 2 . . . . 108 Glu HB3 . 6943 1 1350 . 1 1 108 108 GLU HG2 H 1 2.22 0.02 . 1 . . . . 108 Glu HG2 . 6943 1 1351 . 1 1 108 108 GLU HG3 H 1 2.22 0.02 . 1 . . . . 108 Glu HG3 . 6943 1 1352 . 1 1 108 108 GLU CA C 13 58.10 0.2 . 1 . . . . 108 Glu CA . 6943 1 1353 . 1 1 108 108 GLU CB C 13 31.20 0.2 . 1 . . . . 108 Glu CB . 6943 1 1354 . 1 1 108 108 GLU CG C 13 36.70 0.2 . 1 . . . . 108 Glu CG . 6943 1 1355 . 1 1 108 108 GLU N N 15 126.70 0.2 . 1 . . . . 108 Glu N . 6943 1 stop_ save_