data_30210 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30210 _Entry.Title ; Solution structure of the zinc fingers 1 and 2 of MBNL1 in complex with human cardiac troponin T pre-mRNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-12-15 _Entry.Accession_date 2016-12-15 _Entry.Last_release_date 2017-02-02 _Entry.Original_release_date 2017-02-02 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 P. Phukan P. D. . . 30210 2 S. Park S. . . . 30210 3 M. Martinez-Yamout M. M. . . 30210 4 M. Zeeb M. . . . 30210 5 H. Dyson H. J. . . 30210 6 P. Wright P. E. . . 30210 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Structure from MOLMOL' . 30210 'Zinc fingers RNA-binding' . 30210 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30210 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 300 30210 '15N chemical shifts' 85 30210 '1H chemical shifts' 554 30210 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 . . 2017-11-30 2016-12-15 update BMRB 'update entry citation' 30210 1 . . 2017-07-25 2016-12-15 original author 'original release' 30210 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30207 'Solution structure of the zinc fingers 1 and 2 of MBNL1' 30210 BMRB 30208 'Solution structure of the zinc fingers 3 and 4 of MBNL1' 30210 PDB 5U9B 'BMRB Entry Tracking System' 30210 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30210 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1021/acs.biochem.7b00484 _Citation.PubMed_ID 28718627 _Citation.Full_citation . _Citation.Title ; Structural basis for interaction of the tandem zinc finger domains of human muscleblind with cognate RNA from human cardiac troponin T ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 56 _Citation.Journal_issue 32 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-4995 _Citation.Journal_CSD 0353 _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 4154 _Citation.Page_last 4168 _Citation.Year 2017 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Sangho Park S. . . . 30210 1 2 'Priti Deka' Phukan P. D. . . 30210 1 3 Markus Zeeb M. . . . 30210 1 4 Maria Martinez-Yamout M. A. . . 30210 1 5 'Helen Jane' Dyson H. J. . . 30210 1 6 Peter Wright P. E. . . 30210 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30210 _Assembly.ID 1 _Assembly.Name 'Muscleblind-like protein 1/RNA Complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 30210 1 2 entity_2 2 $entity_2 B B no . . . . . . 30210 1 3 'ZINC ION, 1' 3 $entity_ZN C A no . . . . . . 30210 1 4 'ZINC ION, 2' 3 $entity_ZN D A no . . . . . . 30210 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30210 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Muscleblind-like protein 1' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAVSVTPIRDTKWLTLEVCR EFQRGTCSRPDTECKFAHPS KSCQVENGRVIACFDSLKGR CSRENCKYLHPPPHLKTQLE INGRNNLIQQKN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 92 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'zinc fingers 1 and 2 (UNP residues 1-92)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10577.180 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Triplet-expansion RNA-binding protein' na 30210 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 1 MET . 30210 1 2 2 ALA . 30210 1 3 3 VAL . 30210 1 4 4 SER . 30210 1 5 5 VAL . 30210 1 6 6 THR . 30210 1 7 7 PRO . 30210 1 8 8 ILE . 30210 1 9 9 ARG . 30210 1 10 10 ASP . 30210 1 11 11 THR . 30210 1 12 12 LYS . 30210 1 13 13 TRP . 30210 1 14 14 LEU . 30210 1 15 15 THR . 30210 1 16 16 LEU . 30210 1 17 17 GLU . 30210 1 18 18 VAL . 30210 1 19 19 CYS . 30210 1 20 20 ARG . 30210 1 21 21 GLU . 30210 1 22 22 PHE . 30210 1 23 23 GLN . 30210 1 24 24 ARG . 30210 1 25 25 GLY . 30210 1 26 26 THR . 30210 1 27 27 CYS . 30210 1 28 28 SER . 30210 1 29 29 ARG . 30210 1 30 30 PRO . 30210 1 31 31 ASP . 30210 1 32 32 THR . 30210 1 33 33 GLU . 30210 1 34 34 CYS . 30210 1 35 35 LYS . 30210 1 36 36 PHE . 30210 1 37 37 ALA . 30210 1 38 38 HIS . 30210 1 39 39 PRO . 30210 1 40 40 SER . 30210 1 41 41 LYS . 30210 1 42 42 SER . 30210 1 43 43 CYS . 30210 1 44 44 GLN . 30210 1 45 45 VAL . 30210 1 46 46 GLU . 30210 1 47 47 ASN . 30210 1 48 48 GLY . 30210 1 49 49 ARG . 30210 1 50 50 VAL . 30210 1 51 51 ILE . 30210 1 52 52 ALA . 30210 1 53 53 CYS . 30210 1 54 54 PHE . 30210 1 55 55 ASP . 30210 1 56 56 SER . 30210 1 57 57 LEU . 30210 1 58 58 LYS . 30210 1 59 59 GLY . 30210 1 60 60 ARG . 30210 1 61 61 CYS . 30210 1 62 62 SER . 30210 1 63 63 ARG . 30210 1 64 64 GLU . 30210 1 65 65 ASN . 30210 1 66 66 CYS . 30210 1 67 67 LYS . 30210 1 68 68 TYR . 30210 1 69 69 LEU . 30210 1 70 70 HIS . 30210 1 71 71 PRO . 30210 1 72 72 PRO . 30210 1 73 73 PRO . 30210 1 74 74 HIS . 30210 1 75 75 LEU . 30210 1 76 76 LYS . 30210 1 77 77 THR . 30210 1 78 78 GLN . 30210 1 79 79 LEU . 30210 1 80 80 GLU . 30210 1 81 81 ILE . 30210 1 82 82 ASN . 30210 1 83 83 GLY . 30210 1 84 84 ARG . 30210 1 85 85 ASN . 30210 1 86 86 ASN . 30210 1 87 87 LEU . 30210 1 88 88 ILE . 30210 1 89 89 GLN . 30210 1 90 90 GLN . 30210 1 91 91 LYS . 30210 1 92 92 ASN . 30210 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 30210 1 . ALA 2 2 30210 1 . VAL 3 3 30210 1 . SER 4 4 30210 1 . VAL 5 5 30210 1 . THR 6 6 30210 1 . PRO 7 7 30210 1 . ILE 8 8 30210 1 . ARG 9 9 30210 1 . ASP 10 10 30210 1 . THR 11 11 30210 1 . LYS 12 12 30210 1 . TRP 13 13 30210 1 . LEU 14 14 30210 1 . THR 15 15 30210 1 . LEU 16 16 30210 1 . GLU 17 17 30210 1 . VAL 18 18 30210 1 . CYS 19 19 30210 1 . ARG 20 20 30210 1 . GLU 21 21 30210 1 . PHE 22 22 30210 1 . GLN 23 23 30210 1 . ARG 24 24 30210 1 . GLY 25 25 30210 1 . THR 26 26 30210 1 . CYS 27 27 30210 1 . SER 28 28 30210 1 . ARG 29 29 30210 1 . PRO 30 30 30210 1 . ASP 31 31 30210 1 . THR 32 32 30210 1 . GLU 33 33 30210 1 . CYS 34 34 30210 1 . LYS 35 35 30210 1 . PHE 36 36 30210 1 . ALA 37 37 30210 1 . HIS 38 38 30210 1 . PRO 39 39 30210 1 . SER 40 40 30210 1 . LYS 41 41 30210 1 . SER 42 42 30210 1 . CYS 43 43 30210 1 . GLN 44 44 30210 1 . VAL 45 45 30210 1 . GLU 46 46 30210 1 . ASN 47 47 30210 1 . GLY 48 48 30210 1 . ARG 49 49 30210 1 . VAL 50 50 30210 1 . ILE 51 51 30210 1 . ALA 52 52 30210 1 . CYS 53 53 30210 1 . PHE 54 54 30210 1 . ASP 55 55 30210 1 . SER 56 56 30210 1 . LEU 57 57 30210 1 . LYS 58 58 30210 1 . GLY 59 59 30210 1 . ARG 60 60 30210 1 . CYS 61 61 30210 1 . SER 62 62 30210 1 . ARG 63 63 30210 1 . GLU 64 64 30210 1 . ASN 65 65 30210 1 . CYS 66 66 30210 1 . LYS 67 67 30210 1 . TYR 68 68 30210 1 . LEU 69 69 30210 1 . HIS 70 70 30210 1 . PRO 71 71 30210 1 . PRO 72 72 30210 1 . PRO 73 73 30210 1 . HIS 74 74 30210 1 . LEU 75 75 30210 1 . LYS 76 76 30210 1 . THR 77 77 30210 1 . GLN 78 78 30210 1 . LEU 79 79 30210 1 . GLU 80 80 30210 1 . ILE 81 81 30210 1 . ASN 82 82 30210 1 . GLY 83 83 30210 1 . ARG 84 84 30210 1 . ASN 85 85 30210 1 . ASN 86 86 30210 1 . LEU 87 87 30210 1 . ILE 88 88 30210 1 . GLN 89 89 30210 1 . GLN 90 90 30210 1 . LYS 91 91 30210 1 . ASN 92 92 30210 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 30210 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name "RNA (5'-R(P*GP*UP*CP*UP*CP*GP*CP*UP*UP*UP*UP*CP*CP*CP*C)-3')" _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GUCUCGCUUUUCCCC ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 15 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4618.721 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 G . 30210 2 2 2 U . 30210 2 3 3 C . 30210 2 4 4 U . 30210 2 5 5 C . 30210 2 6 6 G . 30210 2 7 7 C . 30210 2 8 8 U . 30210 2 9 9 U . 30210 2 10 10 U . 30210 2 11 11 U . 30210 2 12 12 C . 30210 2 13 13 C . 30210 2 14 14 C . 30210 2 15 15 C . 30210 2 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 . G 1 1 30210 2 . U 2 2 30210 2 . C 3 3 30210 2 . U 4 4 30210 2 . C 5 5 30210 2 . G 6 6 30210 2 . C 7 7 30210 2 . U 8 8 30210 2 . U 9 9 30210 2 . U 10 10 30210 2 . U 11 11 30210 2 . C 12 12 30210 2 . C 13 13 30210 2 . C 14 14 30210 2 . C 15 15 30210 2 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 30210 _Entity.ID 3 _Entity.BMRB_code ZN _Entity.Name 'ZINC ION' _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 30210 3 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 30210 3 ZN 'Three letter code' 30210 3 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 1 101 ZN $chem_comp_ZN 30210 3 2 102 ZN $chem_comp_ZN 30210 3 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 30210 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'MBNL1, EXP, KIAA0428, MBNL' . 30210 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 30210 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 30210 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30210 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . 30210 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 30210 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 30210 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 30210 ZN [Zn++] SMILES CACTVS 3.341 30210 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 30210 ZN [Zn+2] SMILES ACDLabs 10.04 30210 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 30210 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 30210 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 30210 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 30210 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 30210 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30210 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 1 and 2 of MBNL1, 0.4 mM unlabeled RNA (5'-R(P*GP*UP*CP*UP*CP*GP*CP*UP*UP*UP*UP*CP*CP*CP*C)-3'), 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 "RNA (5'-R(P*GP*UP*CP*UP*CP*GP*CP*UP*UP*UP*UP*CP*CP*CP*C)-3')" unlabeled 1 $assembly 2 $entity_2 . . 0.4 . . mM . . . . 30210 1 2 'Zinc fingers 1 and 2 of MBNL1' '[U-98% 13C; U-98% 15N]' 1 $assembly 1 $entity_1 . . 0.4 . . mM . . . . 30210 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 30210 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 30210 1 5 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 30210 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30210 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 30210 1 pH 7.0 . pH 30210 1 pressure 1 . atm 30210 1 temperature 298 . K 30210 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30210 _Software.ID 1 _Software.Type . _Software.Name AMBER _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 30210 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30210 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30210 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30210 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 30210 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30210 _Software.ID 3 _Software.Type . _Software.Name NMRDraw _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30210 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 30210 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30210 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30210 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30210 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30210 _Software.ID 5 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 30210 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30210 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 30210 _Software.ID 6 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 30210 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30210 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30210 _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_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30210 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 30210 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30210 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker Avance . 600 . . . 30210 1 2 NMR_spectrometer_2 Bruker Avance . 800 . . . 30210 1 3 NMR_spectrometer_3 Bruker Avance . 900 . . . 30210 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 30210 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30210 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30210 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 6 '3D 13C,15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 9 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30210 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30210 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.25144953 . . . . . 30210 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 external direct 1.0 . . . . . 30210 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.10132912 . . . . . 30210 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30210 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30210 1 2 '2D 1H-13C HSQC' . . . 30210 1 3 '3D 1H-15N NOESY' . . . 30210 1 4 '3D 1H-13C NOESY' . . . 30210 1 5 '3D HNCA' . . . 30210 1 6 '3D 13C,15N-filtered NOESY' . . . 30210 1 7 '3D HCCH-TOCSY' . . . 30210 1 8 '3D HNCACB' . . . 30210 1 9 '3D CBCA(CO)NH' . . . 30210 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ALA HA H 1 4.017 0.01 . . . . . . A 2 ALA HA . 30210 1 2 . 1 1 2 2 ALA HB1 H 1 1.385 0.01 . . . . . . A 2 ALA HB1 . 30210 1 3 . 1 1 2 2 ALA HB2 H 1 1.385 0.01 . . . . . . A 2 ALA HB2 . 30210 1 4 . 1 1 2 2 ALA HB3 H 1 1.385 0.01 . . . . . . A 2 ALA HB3 . 30210 1 5 . 1 1 2 2 ALA CA C 13 51.619 0.01 . . . . . . A 2 ALA CA . 30210 1 6 . 1 1 2 2 ALA CB C 13 19.477 0.01 . . . . . . A 2 ALA CB . 30210 1 7 . 1 1 3 3 VAL HA H 1 4.050 0.01 . . . . . . A 3 VAL HA . 30210 1 8 . 1 1 3 3 VAL HB H 1 1.941 0.01 . . . . . . A 3 VAL HB . 30210 1 9 . 1 1 3 3 VAL HG11 H 1 0.809 0.01 . . . . . . A 3 VAL HG11 . 30210 1 10 . 1 1 3 3 VAL HG12 H 1 0.809 0.01 . . . . . . A 3 VAL HG12 . 30210 1 11 . 1 1 3 3 VAL HG13 H 1 0.809 0.01 . . . . . . A 3 VAL HG13 . 30210 1 12 . 1 1 3 3 VAL HG21 H 1 0.769 0.01 . . . . . . A 3 VAL HG21 . 30210 1 13 . 1 1 3 3 VAL HG22 H 1 0.769 0.01 . . . . . . A 3 VAL HG22 . 30210 1 14 . 1 1 3 3 VAL HG23 H 1 0.769 0.01 . . . . . . A 3 VAL HG23 . 30210 1 15 . 1 1 3 3 VAL CA C 13 62.293 0.01 . . . . . . A 3 VAL CA . 30210 1 16 . 1 1 3 3 VAL CB C 13 32.893 0.01 . . . . . . A 3 VAL CB . 30210 1 17 . 1 1 3 3 VAL CG1 C 13 20.525 0.01 . . . . . . A 3 VAL CG1 . 30210 1 18 . 1 1 3 3 VAL CG2 C 13 21.220 0.01 . . . . . . A 3 VAL CG2 . 30210 1 19 . 1 1 4 4 SER H H 1 8.416 0.01 . . . . . . A 4 SER H . 30210 1 20 . 1 1 4 4 SER HA H 1 4.391 0.01 . . . . . . A 4 SER HA . 30210 1 21 . 1 1 4 4 SER HB2 H 1 3.690 0.01 . . . . . . A 4 SER HB2 . 30210 1 22 . 1 1 4 4 SER CA C 13 57.930 0.01 . . . . . . A 4 SER CA . 30210 1 23 . 1 1 4 4 SER CB C 13 63.827 0.01 . . . . . . A 4 SER CB . 30210 1 24 . 1 1 4 4 SER N N 15 120.025 0.01 . . . . . . A 4 SER N . 30210 1 25 . 1 1 5 5 VAL H H 1 8.237 0.01 . . . . . . A 5 VAL H . 30210 1 26 . 1 1 5 5 VAL HA H 1 4.081 0.01 . . . . . . A 5 VAL HA . 30210 1 27 . 1 1 5 5 VAL HB H 1 1.942 0.01 . . . . . . A 5 VAL HB . 30210 1 28 . 1 1 5 5 VAL HG11 H 1 0.777 0.01 . . . . . . A 5 VAL HG11 . 30210 1 29 . 1 1 5 5 VAL HG12 H 1 0.777 0.01 . . . . . . A 5 VAL HG12 . 30210 1 30 . 1 1 5 5 VAL HG13 H 1 0.777 0.01 . . . . . . A 5 VAL HG13 . 30210 1 31 . 1 1 5 5 VAL HG21 H 1 0.809 0.01 . . . . . . A 5 VAL HG21 . 30210 1 32 . 1 1 5 5 VAL HG22 H 1 0.809 0.01 . . . . . . A 5 VAL HG22 . 30210 1 33 . 1 1 5 5 VAL HG23 H 1 0.809 0.01 . . . . . . A 5 VAL HG23 . 30210 1 34 . 1 1 5 5 VAL CA C 13 62.008 0.01 . . . . . . A 5 VAL CA . 30210 1 35 . 1 1 5 5 VAL CB C 13 32.895 0.01 . . . . . . A 5 VAL CB . 30210 1 36 . 1 1 5 5 VAL CG1 C 13 20.343 0.01 . . . . . . A 5 VAL CG1 . 30210 1 37 . 1 1 5 5 VAL CG2 C 13 21.174 0.01 . . . . . . A 5 VAL CG2 . 30210 1 38 . 1 1 5 5 VAL N N 15 122.043 0.01 . . . . . . A 5 VAL N . 30210 1 39 . 1 1 6 6 THR H H 1 8.189 0.01 . . . . . . A 6 THR H . 30210 1 40 . 1 1 6 6 THR HA H 1 4.444 0.01 . . . . . . A 6 THR HA . 30210 1 41 . 1 1 6 6 THR HB H 1 3.962 0.01 . . . . . . A 6 THR HB . 30210 1 42 . 1 1 6 6 THR HG21 H 1 1.096 0.01 . . . . . . A 6 THR HG21 . 30210 1 43 . 1 1 6 6 THR HG22 H 1 1.096 0.01 . . . . . . A 6 THR HG22 . 30210 1 44 . 1 1 6 6 THR HG23 H 1 1.096 0.01 . . . . . . A 6 THR HG23 . 30210 1 45 . 1 1 6 6 THR CA C 13 59.728 0.01 . . . . . . A 6 THR CA . 30210 1 46 . 1 1 6 6 THR CB C 13 69.691 0.01 . . . . . . A 6 THR CB . 30210 1 47 . 1 1 6 6 THR CG2 C 13 21.530 0.01 . . . . . . A 6 THR CG2 . 30210 1 48 . 1 1 6 6 THR N N 15 120.978 0.01 . . . . . . A 6 THR N . 30210 1 49 . 1 1 7 7 PRO HA H 1 4.287 0.01 . . . . . . A 7 PRO HA . 30210 1 50 . 1 1 7 7 PRO HB2 H 1 2.129 0.01 . . . . . . A 7 PRO HB2 . 30210 1 51 . 1 1 7 7 PRO HB3 H 1 1.723 0.01 . . . . . . A 7 PRO HB3 . 30210 1 52 . 1 1 7 7 PRO HG2 H 1 1.878 0.01 . . . . . . A 7 PRO HG2 . 30210 1 53 . 1 1 7 7 PRO HG3 H 1 1.833 0.01 . . . . . . A 7 PRO HG3 . 30210 1 54 . 1 1 7 7 PRO HD2 H 1 3.726 0.01 . . . . . . A 7 PRO HD2 . 30210 1 55 . 1 1 7 7 PRO HD3 H 1 3.574 0.01 . . . . . . A 7 PRO HD3 . 30210 1 56 . 1 1 7 7 PRO CA C 13 63.091 0.01 . . . . . . A 7 PRO CA . 30210 1 57 . 1 1 7 7 PRO CB C 13 62.264 0.01 . . . . . . A 7 PRO CB . 30210 1 58 . 1 1 7 7 PRO CG C 13 27.453 0.01 . . . . . . A 7 PRO CG . 30210 1 59 . 1 1 7 7 PRO CD C 13 51.227 0.01 . . . . . . A 7 PRO CD . 30210 1 60 . 1 1 8 8 ILE H H 1 8.169 0.01 . . . . . . A 8 ILE H . 30210 1 61 . 1 1 8 8 ILE HA H 1 3.951 0.01 . . . . . . A 8 ILE HA . 30210 1 62 . 1 1 8 8 ILE HB H 1 1.682 0.01 . . . . . . A 8 ILE HB . 30210 1 63 . 1 1 8 8 ILE HG12 H 1 1.059 0.01 . . . . . . A 8 ILE HG12 . 30210 1 64 . 1 1 8 8 ILE HG13 H 1 1.315 0.01 . . . . . . A 8 ILE HG13 . 30210 1 65 . 1 1 8 8 ILE HG21 H 1 0.767 0.01 . . . . . . A 8 ILE HG21 . 30210 1 66 . 1 1 8 8 ILE HG22 H 1 0.767 0.01 . . . . . . A 8 ILE HG22 . 30210 1 67 . 1 1 8 8 ILE HG23 H 1 0.767 0.01 . . . . . . A 8 ILE HG23 . 30210 1 68 . 1 1 8 8 ILE HD11 H 1 0.722 0.01 . . . . . . A 8 ILE HD11 . 30210 1 69 . 1 1 8 8 ILE HD12 H 1 0.722 0.01 . . . . . . A 8 ILE HD12 . 30210 1 70 . 1 1 8 8 ILE HD13 H 1 0.722 0.01 . . . . . . A 8 ILE HD13 . 30210 1 71 . 1 1 8 8 ILE CA C 13 61.115 0.01 . . . . . . A 8 ILE CA . 30210 1 72 . 1 1 8 8 ILE CB C 13 38.711 0.01 . . . . . . A 8 ILE CB . 30210 1 73 . 1 1 8 8 ILE CG1 C 13 27.444 0.01 . . . . . . A 8 ILE CG1 . 30210 1 74 . 1 1 8 8 ILE CG2 C 13 17.594 0.01 . . . . . . A 8 ILE CG2 . 30210 1 75 . 1 1 8 8 ILE CD1 C 13 12.898 0.01 . . . . . . A 8 ILE CD1 . 30210 1 76 . 1 1 8 8 ILE N N 15 121.700 0.01 . . . . . . A 8 ILE N . 30210 1 77 . 1 1 9 9 ARG H H 1 8.328 0.01 . . . . . . A 9 ARG H . 30210 1 78 . 1 1 9 9 ARG HA H 1 4.193 0.01 . . . . . . A 9 ARG HA . 30210 1 79 . 1 1 9 9 ARG HB2 H 1 1.500 0.01 . . . . . . A 9 ARG HB2 . 30210 1 80 . 1 1 9 9 ARG HG2 H 1 1.328 0.01 . . . . . . A 9 ARG HG2 . 30210 1 81 . 1 1 9 9 ARG HD2 H 1 2.869 0.01 . . . . . . A 9 ARG HD2 . 30210 1 82 . 1 1 9 9 ARG HE H 1 7.249 0.01 . . . . . . A 9 ARG HE . 30210 1 83 . 1 1 9 9 ARG CA C 13 55.483 0.01 . . . . . . A 9 ARG CA . 30210 1 84 . 1 1 9 9 ARG CB C 13 31.075 0.01 . . . . . . A 9 ARG CB . 30210 1 85 . 1 1 9 9 ARG CG C 13 27.216 0.01 . . . . . . A 9 ARG CG . 30210 1 86 . 1 1 9 9 ARG CD C 13 43.441 0.01 . . . . . . A 9 ARG CD . 30210 1 87 . 1 1 9 9 ARG N N 15 126.017 0.01 . . . . . . A 9 ARG N . 30210 1 88 . 1 1 9 9 ARG NE N 15 84.434 0.01 . . . . . . A 9 ARG NE . 30210 1 89 . 1 1 10 10 ASP H H 1 8.603 0.01 . . . . . . A 10 ASP H . 30210 1 90 . 1 1 10 10 ASP HA H 1 4.701 0.01 . . . . . . A 10 ASP HA . 30210 1 91 . 1 1 10 10 ASP HB2 H 1 2.831 0.01 . . . . . . A 10 ASP HB2 . 30210 1 92 . 1 1 10 10 ASP HB3 H 1 2.674 0.01 . . . . . . A 10 ASP HB3 . 30210 1 93 . 1 1 10 10 ASP CA C 13 54.173 0.01 . . . . . . A 10 ASP CA . 30210 1 94 . 1 1 10 10 ASP CB C 13 42.650 0.01 . . . . . . A 10 ASP CB . 30210 1 95 . 1 1 10 10 ASP N N 15 122.918 0.01 . . . . . . A 10 ASP N . 30210 1 96 . 1 1 11 11 THR H H 1 8.312 0.01 . . . . . . A 11 THR H . 30210 1 97 . 1 1 11 11 THR HA H 1 4.274 0.01 . . . . . . A 11 THR HA . 30210 1 98 . 1 1 11 11 THR HB H 1 4.055 0.01 . . . . . . A 11 THR HB . 30210 1 99 . 1 1 11 11 THR HG21 H 1 1.103 0.01 . . . . . . A 11 THR HG21 . 30210 1 100 . 1 1 11 11 THR HG22 H 1 1.103 0.01 . . . . . . A 11 THR HG22 . 30210 1 101 . 1 1 11 11 THR HG23 H 1 1.103 0.01 . . . . . . A 11 THR HG23 . 30210 1 102 . 1 1 11 11 THR CA C 13 61.733 0.01 . . . . . . A 11 THR CA . 30210 1 103 . 1 1 11 11 THR CB C 13 69.909 0.01 . . . . . . A 11 THR CB . 30210 1 104 . 1 1 11 11 THR CG2 C 13 21.919 0.01 . . . . . . A 11 THR CG2 . 30210 1 105 . 1 1 11 11 THR N N 15 115.388 0.01 . . . . . . A 11 THR N . 30210 1 106 . 1 1 12 12 LYS H H 1 8.393 0.01 . . . . . . A 12 LYS H . 30210 1 107 . 1 1 12 12 LYS HA H 1 3.815 0.01 . . . . . . A 12 LYS HA . 30210 1 108 . 1 1 12 12 LYS HB2 H 1 2.023 0.01 . . . . . . A 12 LYS HB2 . 30210 1 109 . 1 1 12 12 LYS HB3 H 1 1.846 0.01 . . . . . . A 12 LYS HB3 . 30210 1 110 . 1 1 12 12 LYS HG2 H 1 1.453 0.01 . . . . . . A 12 LYS HG2 . 30210 1 111 . 1 1 12 12 LYS HG3 H 1 1.351 0.01 . . . . . . A 12 LYS HG3 . 30210 1 112 . 1 1 12 12 LYS HD2 H 1 1.617 0.01 . . . . . . A 12 LYS HD2 . 30210 1 113 . 1 1 12 12 LYS HE2 H 1 2.873 0.01 . . . . . . A 12 LYS HE2 . 30210 1 114 . 1 1 12 12 LYS CA C 13 60.435 0.01 . . . . . . A 12 LYS CA . 30210 1 115 . 1 1 12 12 LYS CB C 13 31.503 0.01 . . . . . . A 12 LYS CB . 30210 1 116 . 1 1 12 12 LYS CG C 13 25.100 0.01 . . . . . . A 12 LYS CG . 30210 1 117 . 1 1 12 12 LYS CD C 13 28.898 0.01 . . . . . . A 12 LYS CD . 30210 1 118 . 1 1 12 12 LYS CE C 13 41.799 0.01 . . . . . . A 12 LYS CE . 30210 1 119 . 1 1 12 12 LYS N N 15 125.034 0.01 . . . . . . A 12 LYS N . 30210 1 120 . 1 1 13 13 TRP H H 1 8.236 0.01 . . . . . . A 13 TRP H . 30210 1 121 . 1 1 13 13 TRP HA H 1 4.329 0.01 . . . . . . A 13 TRP HA . 30210 1 122 . 1 1 13 13 TRP HB2 H 1 3.269 0.01 . . . . . . A 13 TRP HB2 . 30210 1 123 . 1 1 13 13 TRP HB3 H 1 2.917 0.01 . . . . . . A 13 TRP HB3 . 30210 1 124 . 1 1 13 13 TRP HD1 H 1 7.265 0.01 . . . . . . A 13 TRP HD1 . 30210 1 125 . 1 1 13 13 TRP HE1 H 1 9.786 0.01 . . . . . . A 13 TRP HE1 . 30210 1 126 . 1 1 13 13 TRP HE3 H 1 7.420 0.01 . . . . . . A 13 TRP HE3 . 30210 1 127 . 1 1 13 13 TRP HZ2 H 1 6.754 0.01 . . . . . . A 13 TRP HZ2 . 30210 1 128 . 1 1 13 13 TRP HZ3 H 1 6.597 0.01 . . . . . . A 13 TRP HZ3 . 30210 1 129 . 1 1 13 13 TRP HH2 H 1 6.896 0.01 . . . . . . A 13 TRP HH2 . 30210 1 130 . 1 1 13 13 TRP CA C 13 59.019 0.01 . . . . . . A 13 TRP CA . 30210 1 131 . 1 1 13 13 TRP CB C 13 26.897 0.01 . . . . . . A 13 TRP CB . 30210 1 132 . 1 1 13 13 TRP CD1 C 13 127.122 0.01 . . . . . . A 13 TRP CD1 . 30210 1 133 . 1 1 13 13 TRP CD2 C 13 122.652 0.01 . . . . . . A 13 TRP CD2 . 30210 1 134 . 1 1 13 13 TRP CE3 C 13 122.282 0.01 . . . . . . A 13 TRP CE3 . 30210 1 135 . 1 1 13 13 TRP CZ2 C 13 112.696 0.01 . . . . . . A 13 TRP CZ2 . 30210 1 136 . 1 1 13 13 TRP CZ3 C 13 121.558 0.01 . . . . . . A 13 TRP CZ3 . 30210 1 137 . 1 1 13 13 TRP CH2 C 13 123.436 0.01 . . . . . . A 13 TRP CH2 . 30210 1 138 . 1 1 13 13 TRP NE1 N 15 130.121 0.01 . . . . . . A 13 TRP NE1 . 30210 1 139 . 1 1 14 14 LEU H H 1 6.202 0.01 . . . . . . A 14 LEU H . 30210 1 140 . 1 1 14 14 LEU HA H 1 3.674 0.01 . . . . . . A 14 LEU HA . 30210 1 141 . 1 1 14 14 LEU HB2 H 1 1.299 0.01 . . . . . . A 14 LEU HB2 . 30210 1 142 . 1 1 14 14 LEU HB3 H 1 0.663 0.01 . . . . . . A 14 LEU HB3 . 30210 1 143 . 1 1 14 14 LEU HG H 1 -0.937 0.01 . . . . . . A 14 LEU HG . 30210 1 144 . 1 1 14 14 LEU HD11 H 1 -0.054 0.01 . . . . . . A 14 LEU HD11 . 30210 1 145 . 1 1 14 14 LEU HD12 H 1 -0.054 0.01 . . . . . . A 14 LEU HD12 . 30210 1 146 . 1 1 14 14 LEU HD13 H 1 -0.054 0.01 . . . . . . A 14 LEU HD13 . 30210 1 147 . 1 1 14 14 LEU HD21 H 1 -0.265 0.01 . . . . . . A 14 LEU HD21 . 30210 1 148 . 1 1 14 14 LEU HD22 H 1 -0.265 0.01 . . . . . . A 14 LEU HD22 . 30210 1 149 . 1 1 14 14 LEU HD23 H 1 -0.265 0.01 . . . . . . A 14 LEU HD23 . 30210 1 150 . 1 1 14 14 LEU CA C 13 53.820 0.01 . . . . . . A 14 LEU CA . 30210 1 151 . 1 1 14 14 LEU CB C 13 42.928 0.01 . . . . . . A 14 LEU CB . 30210 1 152 . 1 1 14 14 LEU CG C 13 25.685 0.01 . . . . . . A 14 LEU CG . 30210 1 153 . 1 1 14 14 LEU CD1 C 13 24.710 0.01 . . . . . . A 14 LEU CD1 . 30210 1 154 . 1 1 14 14 LEU CD2 C 13 22.520 0.01 . . . . . . A 14 LEU CD2 . 30210 1 155 . 1 1 14 14 LEU N N 15 118.370 0.01 . . . . . . A 14 LEU N . 30210 1 156 . 1 1 15 15 THR H H 1 7.380 0.01 . . . . . . A 15 THR H . 30210 1 157 . 1 1 15 15 THR HA H 1 4.828 0.01 . . . . . . A 15 THR HA . 30210 1 158 . 1 1 15 15 THR HB H 1 3.912 0.01 . . . . . . A 15 THR HB . 30210 1 159 . 1 1 15 15 THR HG21 H 1 0.953 0.01 . . . . . . A 15 THR HG21 . 30210 1 160 . 1 1 15 15 THR HG22 H 1 0.953 0.01 . . . . . . A 15 THR HG22 . 30210 1 161 . 1 1 15 15 THR HG23 H 1 0.953 0.01 . . . . . . A 15 THR HG23 . 30210 1 162 . 1 1 15 15 THR CA C 13 62.040 0.01 . . . . . . A 15 THR CA . 30210 1 163 . 1 1 15 15 THR CB C 13 70.881 0.01 . . . . . . A 15 THR CB . 30210 1 164 . 1 1 15 15 THR CG2 C 13 21.731 0.01 . . . . . . A 15 THR CG2 . 30210 1 165 . 1 1 15 15 THR N N 15 112.240 0.01 . . . . . . A 15 THR N . 30210 1 166 . 1 1 16 16 LEU H H 1 8.826 0.01 . . . . . . A 16 LEU H . 30210 1 167 . 1 1 16 16 LEU HA H 1 4.653 0.01 . . . . . . A 16 LEU HA . 30210 1 168 . 1 1 16 16 LEU HB2 H 1 1.374 0.01 . . . . . . A 16 LEU HB2 . 30210 1 169 . 1 1 16 16 LEU HB3 H 1 1.189 0.01 . . . . . . A 16 LEU HB3 . 30210 1 170 . 1 1 16 16 LEU HG H 1 1.341 0.01 . . . . . . A 16 LEU HG . 30210 1 171 . 1 1 16 16 LEU HD11 H 1 0.561 0.01 . . . . . . A 16 LEU HD11 . 30210 1 172 . 1 1 16 16 LEU HD12 H 1 0.561 0.01 . . . . . . A 16 LEU HD12 . 30210 1 173 . 1 1 16 16 LEU HD13 H 1 0.561 0.01 . . . . . . A 16 LEU HD13 . 30210 1 174 . 1 1 16 16 LEU HD21 H 1 0.776 0.01 . . . . . . A 16 LEU HD21 . 30210 1 175 . 1 1 16 16 LEU HD22 H 1 0.776 0.01 . . . . . . A 16 LEU HD22 . 30210 1 176 . 1 1 16 16 LEU HD23 H 1 0.776 0.01 . . . . . . A 16 LEU HD23 . 30210 1 177 . 1 1 16 16 LEU CA C 13 53.136 0.01 . . . . . . A 16 LEU CA . 30210 1 178 . 1 1 16 16 LEU CB C 13 46.932 0.01 . . . . . . A 16 LEU CB . 30210 1 179 . 1 1 16 16 LEU CG C 13 26.950 0.01 . . . . . . A 16 LEU CG . 30210 1 180 . 1 1 16 16 LEU CD1 C 13 27.586 0.01 . . . . . . A 16 LEU CD1 . 30210 1 181 . 1 1 16 16 LEU CD2 C 13 24.182 0.01 . . . . . . A 16 LEU CD2 . 30210 1 182 . 1 1 16 16 LEU N N 15 123.829 0.01 . . . . . . A 16 LEU N . 30210 1 183 . 1 1 17 17 GLU H H 1 8.951 0.01 . . . . . . A 17 GLU H . 30210 1 184 . 1 1 17 17 GLU HA H 1 4.299 0.01 . . . . . . A 17 GLU HA . 30210 1 185 . 1 1 17 17 GLU HB2 H 1 1.995 0.01 . . . . . . A 17 GLU HB2 . 30210 1 186 . 1 1 17 17 GLU HG2 H 1 2.243 0.01 . . . . . . A 17 GLU HG2 . 30210 1 187 . 1 1 17 17 GLU CA C 13 56.819 0.01 . . . . . . A 17 GLU CA . 30210 1 188 . 1 1 17 17 GLU CB C 13 30.814 0.01 . . . . . . A 17 GLU CB . 30210 1 189 . 1 1 17 17 GLU CG C 13 36.399 0.01 . . . . . . A 17 GLU CG . 30210 1 190 . 1 1 17 17 GLU N N 15 121.574 0.01 . . . . . . A 17 GLU N . 30210 1 191 . 1 1 18 18 VAL H H 1 8.213 0.01 . . . . . . A 18 VAL H . 30210 1 192 . 1 1 18 18 VAL HA H 1 3.854 0.01 . . . . . . A 18 VAL HA . 30210 1 193 . 1 1 18 18 VAL HB H 1 1.576 0.01 . . . . . . A 18 VAL HB . 30210 1 194 . 1 1 18 18 VAL HG11 H 1 0.796 0.01 . . . . . . A 18 VAL HG11 . 30210 1 195 . 1 1 18 18 VAL HG12 H 1 0.796 0.01 . . . . . . A 18 VAL HG12 . 30210 1 196 . 1 1 18 18 VAL HG13 H 1 0.796 0.01 . . . . . . A 18 VAL HG13 . 30210 1 197 . 1 1 18 18 VAL HG21 H 1 0.694 0.01 . . . . . . A 18 VAL HG21 . 30210 1 198 . 1 1 18 18 VAL HG22 H 1 0.694 0.01 . . . . . . A 18 VAL HG22 . 30210 1 199 . 1 1 18 18 VAL HG23 H 1 0.694 0.01 . . . . . . A 18 VAL HG23 . 30210 1 200 . 1 1 18 18 VAL CA C 13 62.350 0.01 . . . . . . A 18 VAL CA . 30210 1 201 . 1 1 18 18 VAL CB C 13 32.622 0.01 . . . . . . A 18 VAL CB . 30210 1 202 . 1 1 18 18 VAL CG1 C 13 21.586 0.01 . . . . . . A 18 VAL CG1 . 30210 1 203 . 1 1 18 18 VAL CG2 C 13 23.879 0.01 . . . . . . A 18 VAL CG2 . 30210 1 204 . 1 1 18 18 VAL N N 15 123.708 0.01 . . . . . . A 18 VAL N . 30210 1 205 . 1 1 19 19 CYS H H 1 9.224 0.01 . . . . . . A 19 CYS H . 30210 1 206 . 1 1 19 19 CYS HB2 H 1 3.194 0.01 . . . . . . A 19 CYS HB2 . 30210 1 207 . 1 1 19 19 CYS HB3 H 1 3.071 0.01 . . . . . . A 19 CYS HB3 . 30210 1 208 . 1 1 19 19 CYS CB C 13 30.996 0.01 . . . . . . A 19 CYS CB . 30210 1 209 . 1 1 19 19 CYS N N 15 129.577 0.01 . . . . . . A 19 CYS N . 30210 1 210 . 1 1 20 20 ARG HA H 1 4.593 0.01 . . . . . . A 20 ARG HA . 30210 1 211 . 1 1 20 20 ARG HB2 H 1 1.666 0.01 . . . . . . A 20 ARG HB2 . 30210 1 212 . 1 1 20 20 ARG HG2 H 1 1.439 0.01 . . . . . . A 20 ARG HG2 . 30210 1 213 . 1 1 20 20 ARG HD2 H 1 3.036 0.01 . . . . . . A 20 ARG HD2 . 30210 1 214 . 1 1 20 20 ARG HE H 1 7.143 0.01 . . . . . . A 20 ARG HE . 30210 1 215 . 1 1 20 20 ARG CA C 13 54.129 0.01 . . . . . . A 20 ARG CA . 30210 1 216 . 1 1 20 20 ARG CB C 13 28.858 0.01 . . . . . . A 20 ARG CB . 30210 1 217 . 1 1 20 20 ARG CG C 13 27.136 0.01 . . . . . . A 20 ARG CG . 30210 1 218 . 1 1 20 20 ARG CD C 13 43.724 0.01 . . . . . . A 20 ARG CD . 30210 1 219 . 1 1 20 20 ARG NE N 15 84.277 0.01 . . . . . . A 20 ARG NE . 30210 1 220 . 1 1 21 21 GLU HA H 1 3.793 0.01 . . . . . . A 21 GLU HA . 30210 1 221 . 1 1 21 21 GLU HB2 H 1 1.812 0.01 . . . . . . A 21 GLU HB2 . 30210 1 222 . 1 1 21 21 GLU HG2 H 1 2.168 0.01 . . . . . . A 21 GLU HG2 . 30210 1 223 . 1 1 21 21 GLU CA C 13 59.751 0.01 . . . . . . A 21 GLU CA . 30210 1 224 . 1 1 21 21 GLU CB C 13 28.631 0.01 . . . . . . A 21 GLU CB . 30210 1 225 . 1 1 21 21 GLU CG C 13 37.353 0.01 . . . . . . A 21 GLU CG . 30210 1 226 . 1 1 22 22 PHE H H 1 9.818 0.01 . . . . . . A 22 PHE H . 30210 1 227 . 1 1 22 22 PHE HA H 1 3.949 0.01 . . . . . . A 22 PHE HA . 30210 1 228 . 1 1 22 22 PHE HB2 H 1 3.041 0.01 . . . . . . A 22 PHE HB2 . 30210 1 229 . 1 1 22 22 PHE HB3 H 1 2.821 0.01 . . . . . . A 22 PHE HB3 . 30210 1 230 . 1 1 22 22 PHE HD1 H 1 6.659 0.01 . . . . . . A 22 PHE HD1 . 30210 1 231 . 1 1 22 22 PHE HE1 H 1 7.105 0.01 . . . . . . A 22 PHE HE1 . 30210 1 232 . 1 1 22 22 PHE HZ H 1 7.223 0.01 . . . . . . A 22 PHE HZ . 30210 1 233 . 1 1 22 22 PHE CA C 13 60.705 0.01 . . . . . . A 22 PHE CA . 30210 1 234 . 1 1 22 22 PHE CB C 13 38.730 0.01 . . . . . . A 22 PHE CB . 30210 1 235 . 1 1 22 22 PHE CD1 C 13 130.871 0.01 . . . . . . A 22 PHE CD1 . 30210 1 236 . 1 1 22 22 PHE CE1 C 13 131.569 0.01 . . . . . . A 22 PHE CE1 . 30210 1 237 . 1 1 22 22 PHE CZ C 13 130.634 0.01 . . . . . . A 22 PHE CZ . 30210 1 238 . 1 1 22 22 PHE N N 15 128.400 0.01 . . . . . . A 22 PHE N . 30210 1 239 . 1 1 23 23 GLN H H 1 7.809 0.01 . . . . . . A 23 GLN H . 30210 1 240 . 1 1 23 23 GLN HA H 1 3.813 0.01 . . . . . . A 23 GLN HA . 30210 1 241 . 1 1 23 23 GLN HB2 H 1 1.938 0.01 . . . . . . A 23 GLN HB2 . 30210 1 242 . 1 1 23 23 GLN HG2 H 1 2.507 0.01 . . . . . . A 23 GLN HG2 . 30210 1 243 . 1 1 23 23 GLN HG3 H 1 2.196 0.01 . . . . . . A 23 GLN HG3 . 30210 1 244 . 1 1 23 23 GLN HE21 H 1 6.704 0.01 . . . . . . A 23 GLN HE21 . 30210 1 245 . 1 1 23 23 GLN HE22 H 1 7.487 0.01 . . . . . . A 23 GLN HE22 . 30210 1 246 . 1 1 23 23 GLN CA C 13 58.843 0.01 . . . . . . A 23 GLN CA . 30210 1 247 . 1 1 23 23 GLN CB C 13 29.757 0.01 . . . . . . A 23 GLN CB . 30210 1 248 . 1 1 23 23 GLN CG C 13 35.148 0.01 . . . . . . A 23 GLN CG . 30210 1 249 . 1 1 23 23 GLN N N 15 117.500 0.01 . . . . . . A 23 GLN N . 30210 1 250 . 1 1 23 23 GLN NE2 N 15 110.907 0.01 . . . . . . A 23 GLN NE2 . 30210 1 251 . 1 1 24 24 ARG H H 1 7.279 0.01 . . . . . . A 24 ARG H . 30210 1 252 . 1 1 24 24 ARG HA H 1 4.246 0.01 . . . . . . A 24 ARG HA . 30210 1 253 . 1 1 24 24 ARG HB2 H 1 1.774 0.01 . . . . . . A 24 ARG HB2 . 30210 1 254 . 1 1 24 24 ARG HG2 H 1 1.618 0.01 . . . . . . A 24 ARG HG2 . 30210 1 255 . 1 1 24 24 ARG HD2 H 1 3.026 0.01 . . . . . . A 24 ARG HD2 . 30210 1 256 . 1 1 24 24 ARG CA C 13 55.802 0.01 . . . . . . A 24 ARG CA . 30210 1 257 . 1 1 24 24 ARG CB C 13 31.077 0.01 . . . . . . A 24 ARG CB . 30210 1 258 . 1 1 24 24 ARG CG C 13 27.365 0.01 . . . . . . A 24 ARG CG . 30210 1 259 . 1 1 24 24 ARG CD C 13 43.686 0.01 . . . . . . A 24 ARG CD . 30210 1 260 . 1 1 24 24 ARG N N 15 115.693 0.01 . . . . . . A 24 ARG N . 30210 1 261 . 1 1 25 25 GLY H H 1 7.658 0.01 . . . . . . A 25 GLY H . 30210 1 262 . 1 1 25 25 GLY HA2 H 1 3.601 0.01 . . . . . . A 25 GLY HA2 . 30210 1 263 . 1 1 25 25 GLY HA3 H 1 3.915 0.01 . . . . . . A 25 GLY HA3 . 30210 1 264 . 1 1 25 25 GLY CA C 13 45.750 0.01 . . . . . . A 25 GLY CA . 30210 1 265 . 1 1 25 25 GLY N N 15 108.586 0.01 . . . . . . A 25 GLY N . 30210 1 266 . 1 1 26 26 THR H H 1 8.161 0.01 . . . . . . A 26 THR H . 30210 1 267 . 1 1 26 26 THR HA H 1 4.340 0.01 . . . . . . A 26 THR HA . 30210 1 268 . 1 1 26 26 THR HB H 1 4.365 0.01 . . . . . . A 26 THR HB . 30210 1 269 . 1 1 26 26 THR HG21 H 1 0.843 0.01 . . . . . . A 26 THR HG21 . 30210 1 270 . 1 1 26 26 THR HG22 H 1 0.843 0.01 . . . . . . A 26 THR HG22 . 30210 1 271 . 1 1 26 26 THR HG23 H 1 0.843 0.01 . . . . . . A 26 THR HG23 . 30210 1 272 . 1 1 26 26 THR CA C 13 60.809 0.01 . . . . . . A 26 THR CA . 30210 1 273 . 1 1 26 26 THR CB C 13 69.115 0.01 . . . . . . A 26 THR CB . 30210 1 274 . 1 1 26 26 THR CG2 C 13 21.134 0.01 . . . . . . A 26 THR CG2 . 30210 1 275 . 1 1 26 26 THR N N 15 109.213 0.01 . . . . . . A 26 THR N . 30210 1 276 . 1 1 27 27 CYS H H 1 7.741 0.01 . . . . . . A 27 CYS H . 30210 1 277 . 1 1 27 27 CYS HA H 1 4.004 0.01 . . . . . . A 27 CYS HA . 30210 1 278 . 1 1 27 27 CYS HB2 H 1 2.853 0.01 . . . . . . A 27 CYS HB2 . 30210 1 279 . 1 1 27 27 CYS HB3 H 1 2.648 0.01 . . . . . . A 27 CYS HB3 . 30210 1 280 . 1 1 27 27 CYS CA C 13 60.866 0.01 . . . . . . A 27 CYS CA . 30210 1 281 . 1 1 27 27 CYS CB C 13 29.341 0.01 . . . . . . A 27 CYS CB . 30210 1 282 . 1 1 27 27 CYS N N 15 124.504 0.01 . . . . . . A 27 CYS N . 30210 1 283 . 1 1 28 28 SER HA H 1 4.428 0.01 . . . . . . A 28 SER HA . 30210 1 284 . 1 1 28 28 SER HB2 H 1 3.955 0.01 . . . . . . A 28 SER HB2 . 30210 1 285 . 1 1 28 28 SER HB3 H 1 3.776 0.01 . . . . . . A 28 SER HB3 . 30210 1 286 . 1 1 28 28 SER CA C 13 58.453 0.01 . . . . . . A 28 SER CA . 30210 1 287 . 1 1 28 28 SER CB C 13 63.609 0.01 . . . . . . A 28 SER CB . 30210 1 288 . 1 1 29 29 ARG H H 1 8.880 0.01 . . . . . . A 29 ARG H . 30210 1 289 . 1 1 29 29 ARG HA H 1 4.542 0.01 . . . . . . A 29 ARG HA . 30210 1 290 . 1 1 29 29 ARG HB2 H 1 1.771 0.01 . . . . . . A 29 ARG HB2 . 30210 1 291 . 1 1 29 29 ARG HG2 H 1 1.552 0.01 . . . . . . A 29 ARG HG2 . 30210 1 292 . 1 1 29 29 ARG HD2 H 1 3.109 0.01 . . . . . . A 29 ARG HD2 . 30210 1 293 . 1 1 29 29 ARG HD3 H 1 2.878 0.01 . . . . . . A 29 ARG HD3 . 30210 1 294 . 1 1 29 29 ARG HE H 1 7.323 0.01 . . . . . . A 29 ARG HE . 30210 1 295 . 1 1 29 29 ARG CA C 13 54.403 0.01 . . . . . . A 29 ARG CA . 30210 1 296 . 1 1 29 29 ARG CB C 13 27.752 0.01 . . . . . . A 29 ARG CB . 30210 1 297 . 1 1 29 29 ARG CG C 13 27.245 0.01 . . . . . . A 29 ARG CG . 30210 1 298 . 1 1 29 29 ARG CD C 13 43.995 0.01 . . . . . . A 29 ARG CD . 30210 1 299 . 1 1 29 29 ARG N N 15 124.971 0.01 . . . . . . A 29 ARG N . 30210 1 300 . 1 1 29 29 ARG NE N 15 84.016 0.01 . . . . . . A 29 ARG NE . 30210 1 301 . 1 1 30 30 PRO HA H 1 4.581 0.01 . . . . . . A 30 PRO HA . 30210 1 302 . 1 1 30 30 PRO HB2 H 1 2.334 0.01 . . . . . . A 30 PRO HB2 . 30210 1 303 . 1 1 30 30 PRO HB3 H 1 1.766 0.01 . . . . . . A 30 PRO HB3 . 30210 1 304 . 1 1 30 30 PRO HG2 H 1 1.932 0.01 . . . . . . A 30 PRO HG2 . 30210 1 305 . 1 1 30 30 PRO HD2 H 1 3.782 0.01 . . . . . . A 30 PRO HD2 . 30210 1 306 . 1 1 30 30 PRO HD3 H 1 3.465 0.01 . . . . . . A 30 PRO HD3 . 30210 1 307 . 1 1 30 30 PRO CA C 13 62.264 0.01 . . . . . . A 30 PRO CA . 30210 1 308 . 1 1 30 30 PRO CB C 13 62.563 0.01 . . . . . . A 30 PRO CB . 30210 1 309 . 1 1 30 30 PRO CG C 13 27.524 0.01 . . . . . . A 30 PRO CG . 30210 1 310 . 1 1 30 30 PRO CD C 13 50.419 0.01 . . . . . . A 30 PRO CD . 30210 1 311 . 1 1 31 31 ASP H H 1 9.035 0.01 . . . . . . A 31 ASP H . 30210 1 312 . 1 1 31 31 ASP HA H 1 3.574 0.01 . . . . . . A 31 ASP HA . 30210 1 313 . 1 1 31 31 ASP HB2 H 1 2.612 0.01 . . . . . . A 31 ASP HB2 . 30210 1 314 . 1 1 31 31 ASP CA C 13 56.632 0.01 . . . . . . A 31 ASP CA . 30210 1 315 . 1 1 31 31 ASP CB C 13 39.180 0.01 . . . . . . A 31 ASP CB . 30210 1 316 . 1 1 31 31 ASP N N 15 123.444 0.01 . . . . . . A 31 ASP N . 30210 1 317 . 1 1 32 32 THR H H 1 7.156 0.01 . . . . . . A 32 THR H . 30210 1 318 . 1 1 32 32 THR HA H 1 3.793 0.01 . . . . . . A 32 THR HA . 30210 1 319 . 1 1 32 32 THR HB H 1 4.275 0.01 . . . . . . A 32 THR HB . 30210 1 320 . 1 1 32 32 THR HG21 H 1 1.226 0.01 . . . . . . A 32 THR HG21 . 30210 1 321 . 1 1 32 32 THR HG22 H 1 1.226 0.01 . . . . . . A 32 THR HG22 . 30210 1 322 . 1 1 32 32 THR HG23 H 1 1.226 0.01 . . . . . . A 32 THR HG23 . 30210 1 323 . 1 1 32 32 THR CA C 13 62.712 0.01 . . . . . . A 32 THR CA . 30210 1 324 . 1 1 32 32 THR CB C 13 68.740 0.01 . . . . . . A 32 THR CB . 30210 1 325 . 1 1 32 32 THR CG2 C 13 22.961 0.01 . . . . . . A 32 THR CG2 . 30210 1 326 . 1 1 32 32 THR N N 15 104.287 0.01 . . . . . . A 32 THR N . 30210 1 327 . 1 1 33 33 GLU H H 1 7.572 0.01 . . . . . . A 33 GLU H . 30210 1 328 . 1 1 33 33 GLU HA H 1 3.960 0.01 . . . . . . A 33 GLU HA . 30210 1 329 . 1 1 33 33 GLU HB2 H 1 1.553 0.01 . . . . . . A 33 GLU HB2 . 30210 1 330 . 1 1 33 33 GLU HB3 H 1 1.652 0.01 . . . . . . A 33 GLU HB3 . 30210 1 331 . 1 1 33 33 GLU HG2 H 1 1.952 0.01 . . . . . . A 33 GLU HG2 . 30210 1 332 . 1 1 33 33 GLU CA C 13 59.313 0.01 . . . . . . A 33 GLU CA . 30210 1 333 . 1 1 33 33 GLU CB C 13 33.045 0.01 . . . . . . A 33 GLU CB . 30210 1 334 . 1 1 33 33 GLU CG C 13 35.871 0.01 . . . . . . A 33 GLU CG . 30210 1 335 . 1 1 33 33 GLU N N 15 117.606 0.01 . . . . . . A 33 GLU N . 30210 1 336 . 1 1 34 34 CYS H H 1 7.270 0.01 . . . . . . A 34 CYS H . 30210 1 337 . 1 1 34 34 CYS HA H 1 4.042 0.01 . . . . . . A 34 CYS HA . 30210 1 338 . 1 1 34 34 CYS HB2 H 1 2.130 0.01 . . . . . . A 34 CYS HB2 . 30210 1 339 . 1 1 34 34 CYS CA C 13 59.422 0.01 . . . . . . A 34 CYS CA . 30210 1 340 . 1 1 34 34 CYS CB C 13 29.655 0.01 . . . . . . A 34 CYS CB . 30210 1 341 . 1 1 34 34 CYS N N 15 122.345 0.01 . . . . . . A 34 CYS N . 30210 1 342 . 1 1 35 35 LYS H H 1 8.101 0.01 . . . . . . A 35 LYS H . 30210 1 343 . 1 1 35 35 LYS HA H 1 3.753 0.01 . . . . . . A 35 LYS HA . 30210 1 344 . 1 1 35 35 LYS HG2 H 1 1.328 0.01 . . . . . . A 35 LYS HG2 . 30210 1 345 . 1 1 35 35 LYS HE2 H 1 2.707 0.01 . . . . . . A 35 LYS HE2 . 30210 1 346 . 1 1 35 35 LYS CA C 13 57.724 0.01 . . . . . . A 35 LYS CA . 30210 1 347 . 1 1 35 35 LYS CG C 13 28.927 0.01 . . . . . . A 35 LYS CG . 30210 1 348 . 1 1 35 35 LYS CE C 13 41.804 0.01 . . . . . . A 35 LYS CE . 30210 1 349 . 1 1 35 35 LYS N N 15 125.133 0.01 . . . . . . A 35 LYS N . 30210 1 350 . 1 1 36 36 PHE H H 1 8.220 0.01 . . . . . . A 36 PHE H . 30210 1 351 . 1 1 36 36 PHE HA H 1 4.749 0.01 . . . . . . A 36 PHE HA . 30210 1 352 . 1 1 36 36 PHE HB2 H 1 3.208 0.01 . . . . . . A 36 PHE HB2 . 30210 1 353 . 1 1 36 36 PHE HB3 H 1 2.621 0.01 . . . . . . A 36 PHE HB3 . 30210 1 354 . 1 1 36 36 PHE HD1 H 1 7.201 0.01 . . . . . . A 36 PHE HD1 . 30210 1 355 . 1 1 36 36 PHE HE1 H 1 7.189 0.01 . . . . . . A 36 PHE HE1 . 30210 1 356 . 1 1 36 36 PHE CA C 13 55.417 0.01 . . . . . . A 36 PHE CA . 30210 1 357 . 1 1 36 36 PHE CB C 13 41.595 0.01 . . . . . . A 36 PHE CB . 30210 1 358 . 1 1 36 36 PHE CD1 C 13 130.229 0.01 . . . . . . A 36 PHE CD1 . 30210 1 359 . 1 1 36 36 PHE CE1 C 13 131.916 0.01 . . . . . . A 36 PHE CE1 . 30210 1 360 . 1 1 36 36 PHE N N 15 118.013 0.01 . . . . . . A 36 PHE N . 30210 1 361 . 1 1 37 37 ALA H H 1 8.385 0.01 . . . . . . A 37 ALA H . 30210 1 362 . 1 1 37 37 ALA HA H 1 3.881 0.01 . . . . . . A 37 ALA HA . 30210 1 363 . 1 1 37 37 ALA HB1 H 1 0.982 0.01 . . . . . . A 37 ALA HB1 . 30210 1 364 . 1 1 37 37 ALA HB2 H 1 0.982 0.01 . . . . . . A 37 ALA HB2 . 30210 1 365 . 1 1 37 37 ALA HB3 H 1 0.982 0.01 . . . . . . A 37 ALA HB3 . 30210 1 366 . 1 1 37 37 ALA CA C 13 52.349 0.01 . . . . . . A 37 ALA CA . 30210 1 367 . 1 1 37 37 ALA CB C 13 21.350 0.01 . . . . . . A 37 ALA CB . 30210 1 368 . 1 1 37 37 ALA N N 15 117.082 0.01 . . . . . . A 37 ALA N . 30210 1 369 . 1 1 38 38 HIS H H 1 9.672 0.01 . . . . . . A 38 HIS H . 30210 1 370 . 1 1 38 38 HIS HA H 1 4.156 0.01 . . . . . . A 38 HIS HA . 30210 1 371 . 1 1 38 38 HIS HB2 H 1 2.596 0.01 . . . . . . A 38 HIS HB2 . 30210 1 372 . 1 1 38 38 HIS HB3 H 1 1.669 0.01 . . . . . . A 38 HIS HB3 . 30210 1 373 . 1 1 38 38 HIS HD2 H 1 6.414 0.01 . . . . . . A 38 HIS HD2 . 30210 1 374 . 1 1 38 38 HIS HE1 H 1 8.293 0.01 . . . . . . A 38 HIS HE1 . 30210 1 375 . 1 1 38 38 HIS CA C 13 51.434 0.01 . . . . . . A 38 HIS CA . 30210 1 376 . 1 1 38 38 HIS CB C 13 29.337 0.01 . . . . . . A 38 HIS CB . 30210 1 377 . 1 1 38 38 HIS CD2 C 13 124.042 0.01 . . . . . . A 38 HIS CD2 . 30210 1 378 . 1 1 38 38 HIS CE1 C 13 139.483 0.01 . . . . . . A 38 HIS CE1 . 30210 1 379 . 1 1 38 38 HIS N N 15 122.775 0.01 . . . . . . A 38 HIS N . 30210 1 380 . 1 1 39 39 PRO HA H 1 4.087 0.01 . . . . . . A 39 PRO HA . 30210 1 381 . 1 1 39 39 PRO HB2 H 1 2.043 0.01 . . . . . . A 39 PRO HB2 . 30210 1 382 . 1 1 39 39 PRO HB3 H 1 1.877 0.01 . . . . . . A 39 PRO HB3 . 30210 1 383 . 1 1 39 39 PRO HG2 H 1 2.034 0.01 . . . . . . A 39 PRO HG2 . 30210 1 384 . 1 1 39 39 PRO HG3 H 1 1.476 0.01 . . . . . . A 39 PRO HG3 . 30210 1 385 . 1 1 39 39 PRO HD2 H 1 3.579 0.01 . . . . . . A 39 PRO HD2 . 30210 1 386 . 1 1 39 39 PRO HD3 H 1 3.330 0.01 . . . . . . A 39 PRO HD3 . 30210 1 387 . 1 1 39 39 PRO CA C 13 62.854 0.01 . . . . . . A 39 PRO CA . 30210 1 388 . 1 1 39 39 PRO CB C 13 62.597 0.01 . . . . . . A 39 PRO CB . 30210 1 389 . 1 1 39 39 PRO CG C 13 27.929 0.01 . . . . . . A 39 PRO CG . 30210 1 390 . 1 1 39 39 PRO CD C 13 50.815 0.01 . . . . . . A 39 PRO CD . 30210 1 391 . 1 1 40 40 SER H H 1 7.525 0.01 . . . . . . A 40 SER H . 30210 1 392 . 1 1 40 40 SER HA H 1 4.507 0.01 . . . . . . A 40 SER HA . 30210 1 393 . 1 1 40 40 SER HB2 H 1 4.159 0.01 . . . . . . A 40 SER HB2 . 30210 1 394 . 1 1 40 40 SER HB3 H 1 3.922 0.01 . . . . . . A 40 SER HB3 . 30210 1 395 . 1 1 40 40 SER CA C 13 57.534 0.01 . . . . . . A 40 SER CA . 30210 1 396 . 1 1 40 40 SER CB C 13 64.263 0.01 . . . . . . A 40 SER CB . 30210 1 397 . 1 1 40 40 SER N N 15 116.428 0.01 . . . . . . A 40 SER N . 30210 1 398 . 1 1 41 41 LYS H H 1 8.737 0.01 . . . . . . A 41 LYS H . 30210 1 399 . 1 1 41 41 LYS HA H 1 4.040 0.01 . . . . . . A 41 LYS HA . 30210 1 400 . 1 1 41 41 LYS HB2 H 1 1.760 0.01 . . . . . . A 41 LYS HB2 . 30210 1 401 . 1 1 41 41 LYS HG2 H 1 1.407 0.01 . . . . . . A 41 LYS HG2 . 30210 1 402 . 1 1 41 41 LYS HD2 H 1 1.582 0.01 . . . . . . A 41 LYS HD2 . 30210 1 403 . 1 1 41 41 LYS HE2 H 1 2.845 0.01 . . . . . . A 41 LYS HE2 . 30210 1 404 . 1 1 41 41 LYS CA C 13 58.659 0.01 . . . . . . A 41 LYS CA . 30210 1 405 . 1 1 41 41 LYS CB C 13 32.211 0.01 . . . . . . A 41 LYS CB . 30210 1 406 . 1 1 41 41 LYS CG C 13 24.882 0.01 . . . . . . A 41 LYS CG . 30210 1 407 . 1 1 41 41 LYS CD C 13 28.951 0.01 . . . . . . A 41 LYS CD . 30210 1 408 . 1 1 41 41 LYS CE C 13 42.076 0.01 . . . . . . A 41 LYS CE . 30210 1 409 . 1 1 41 41 LYS N N 15 120.603 0.01 . . . . . . A 41 LYS N . 30210 1 410 . 1 1 42 42 SER H H 1 7.765 0.01 . . . . . . A 42 SER H . 30210 1 411 . 1 1 42 42 SER HA H 1 4.162 0.01 . . . . . . A 42 SER HA . 30210 1 412 . 1 1 42 42 SER HB2 H 1 3.645 0.01 . . . . . . A 42 SER HB2 . 30210 1 413 . 1 1 42 42 SER HB3 H 1 3.596 0.01 . . . . . . A 42 SER HB3 . 30210 1 414 . 1 1 42 42 SER CA C 13 58.972 0.01 . . . . . . A 42 SER CA . 30210 1 415 . 1 1 42 42 SER CB C 13 63.526 0.01 . . . . . . A 42 SER CB . 30210 1 416 . 1 1 42 42 SER N N 15 111.455 0.01 . . . . . . A 42 SER N . 30210 1 417 . 1 1 43 43 CYS H H 1 7.244 0.01 . . . . . . A 43 CYS H . 30210 1 418 . 1 1 43 43 CYS HA H 1 4.223 0.01 . . . . . . A 43 CYS HA . 30210 1 419 . 1 1 43 43 CYS HB2 H 1 2.675 0.01 . . . . . . A 43 CYS HB2 . 30210 1 420 . 1 1 43 43 CYS HB3 H 1 2.436 0.01 . . . . . . A 43 CYS HB3 . 30210 1 421 . 1 1 43 43 CYS CA C 13 59.835 0.01 . . . . . . A 43 CYS CA . 30210 1 422 . 1 1 43 43 CYS CB C 13 30.394 0.01 . . . . . . A 43 CYS CB . 30210 1 423 . 1 1 43 43 CYS N N 15 119.769 0.01 . . . . . . A 43 CYS N . 30210 1 424 . 1 1 44 44 GLN H H 1 8.765 0.01 . . . . . . A 44 GLN H . 30210 1 425 . 1 1 44 44 GLN HA H 1 4.234 0.01 . . . . . . A 44 GLN HA . 30210 1 426 . 1 1 44 44 GLN HB2 H 1 1.915 0.01 . . . . . . A 44 GLN HB2 . 30210 1 427 . 1 1 44 44 GLN HG2 H 1 2.140 0.01 . . . . . . A 44 GLN HG2 . 30210 1 428 . 1 1 44 44 GLN HG3 H 1 2.216 0.01 . . . . . . A 44 GLN HG3 . 30210 1 429 . 1 1 44 44 GLN CA C 13 55.806 0.01 . . . . . . A 44 GLN CA . 30210 1 430 . 1 1 44 44 GLN CB C 13 29.389 0.01 . . . . . . A 44 GLN CB . 30210 1 431 . 1 1 44 44 GLN CG C 13 34.009 0.01 . . . . . . A 44 GLN CG . 30210 1 432 . 1 1 44 44 GLN N N 15 125.096 0.01 . . . . . . A 44 GLN N . 30210 1 433 . 1 1 45 45 VAL H H 1 8.509 0.01 . . . . . . A 45 VAL H . 30210 1 434 . 1 1 45 45 VAL HA H 1 4.383 0.01 . . . . . . A 45 VAL HA . 30210 1 435 . 1 1 45 45 VAL HB H 1 1.807 0.01 . . . . . . A 45 VAL HB . 30210 1 436 . 1 1 45 45 VAL HG11 H 1 0.680 0.01 . . . . . . A 45 VAL HG11 . 30210 1 437 . 1 1 45 45 VAL HG12 H 1 0.680 0.01 . . . . . . A 45 VAL HG12 . 30210 1 438 . 1 1 45 45 VAL HG13 H 1 0.680 0.01 . . . . . . A 45 VAL HG13 . 30210 1 439 . 1 1 45 45 VAL HG21 H 1 0.666 0.01 . . . . . . A 45 VAL HG21 . 30210 1 440 . 1 1 45 45 VAL HG22 H 1 0.666 0.01 . . . . . . A 45 VAL HG22 . 30210 1 441 . 1 1 45 45 VAL HG23 H 1 0.666 0.01 . . . . . . A 45 VAL HG23 . 30210 1 442 . 1 1 45 45 VAL CA C 13 61.469 0.01 . . . . . . A 45 VAL CA . 30210 1 443 . 1 1 45 45 VAL CB C 13 33.400 0.01 . . . . . . A 45 VAL CB . 30210 1 444 . 1 1 45 45 VAL CG1 C 13 21.465 0.01 . . . . . . A 45 VAL CG1 . 30210 1 445 . 1 1 45 45 VAL CG2 C 13 21.316 0.01 . . . . . . A 45 VAL CG2 . 30210 1 446 . 1 1 45 45 VAL N N 15 127.150 0.01 . . . . . . A 45 VAL N . 30210 1 447 . 1 1 46 46 GLU H H 1 8.530 0.01 . . . . . . A 46 GLU H . 30210 1 448 . 1 1 46 46 GLU HA H 1 4.538 0.01 . . . . . . A 46 GLU HA . 30210 1 449 . 1 1 46 46 GLU HB2 H 1 1.828 0.01 . . . . . . A 46 GLU HB2 . 30210 1 450 . 1 1 46 46 GLU HG2 H 1 2.013 0.01 . . . . . . A 46 GLU HG2 . 30210 1 451 . 1 1 46 46 GLU CA C 13 54.868 0.01 . . . . . . A 46 GLU CA . 30210 1 452 . 1 1 46 46 GLU CB C 13 32.177 0.01 . . . . . . A 46 GLU CB . 30210 1 453 . 1 1 46 46 GLU CG C 13 35.848 0.01 . . . . . . A 46 GLU CG . 30210 1 454 . 1 1 46 46 GLU N N 15 126.553 0.01 . . . . . . A 46 GLU N . 30210 1 455 . 1 1 47 47 ASN H H 1 9.583 0.01 . . . . . . A 47 ASN H . 30210 1 456 . 1 1 47 47 ASN HA H 1 4.226 0.01 . . . . . . A 47 ASN HA . 30210 1 457 . 1 1 47 47 ASN HB2 H 1 2.897 0.01 . . . . . . A 47 ASN HB2 . 30210 1 458 . 1 1 47 47 ASN HB3 H 1 2.574 0.01 . . . . . . A 47 ASN HB3 . 30210 1 459 . 1 1 47 47 ASN CA C 13 54.105 0.01 . . . . . . A 47 ASN CA . 30210 1 460 . 1 1 47 47 ASN CB C 13 37.616 0.01 . . . . . . A 47 ASN CB . 30210 1 461 . 1 1 47 47 ASN N N 15 125.594 0.01 . . . . . . A 47 ASN N . 30210 1 462 . 1 1 48 48 GLY H H 1 8.550 0.01 . . . . . . A 48 GLY H . 30210 1 463 . 1 1 48 48 GLY HA2 H 1 3.377 0.01 . . . . . . A 48 GLY HA2 . 30210 1 464 . 1 1 48 48 GLY HA3 H 1 3.915 0.01 . . . . . . A 48 GLY HA3 . 30210 1 465 . 1 1 48 48 GLY CA C 13 46.027 0.01 . . . . . . A 48 GLY CA . 30210 1 466 . 1 1 48 48 GLY N N 15 102.215 0.01 . . . . . . A 48 GLY N . 30210 1 467 . 1 1 49 49 ARG H H 1 7.761 0.01 . . . . . . A 49 ARG H . 30210 1 468 . 1 1 49 49 ARG HA H 1 5.161 0.01 . . . . . . A 49 ARG HA . 30210 1 469 . 1 1 49 49 ARG HB2 H 1 1.650 0.01 . . . . . . A 49 ARG HB2 . 30210 1 470 . 1 1 49 49 ARG HB3 H 1 1.534 0.01 . . . . . . A 49 ARG HB3 . 30210 1 471 . 1 1 49 49 ARG HG2 H 1 1.311 0.01 . . . . . . A 49 ARG HG2 . 30210 1 472 . 1 1 49 49 ARG HG3 H 1 1.545 0.01 . . . . . . A 49 ARG HG3 . 30210 1 473 . 1 1 49 49 ARG HD2 H 1 3.027 0.01 . . . . . . A 49 ARG HD2 . 30210 1 474 . 1 1 49 49 ARG HD3 H 1 2.905 0.01 . . . . . . A 49 ARG HD3 . 30210 1 475 . 1 1 49 49 ARG CA C 13 54.868 0.01 . . . . . . A 49 ARG CA . 30210 1 476 . 1 1 49 49 ARG CB C 13 34.298 0.01 . . . . . . A 49 ARG CB . 30210 1 477 . 1 1 49 49 ARG CG C 13 27.877 0.01 . . . . . . A 49 ARG CG . 30210 1 478 . 1 1 49 49 ARG CD C 13 43.350 0.01 . . . . . . A 49 ARG CD . 30210 1 479 . 1 1 49 49 ARG N N 15 119.561 0.01 . . . . . . A 49 ARG N . 30210 1 480 . 1 1 50 50 VAL H H 1 8.891 0.01 . . . . . . A 50 VAL H . 30210 1 481 . 1 1 50 50 VAL HA H 1 4.709 0.01 . . . . . . A 50 VAL HA . 30210 1 482 . 1 1 50 50 VAL HB H 1 1.719 0.01 . . . . . . A 50 VAL HB . 30210 1 483 . 1 1 50 50 VAL HG11 H 1 0.864 0.01 . . . . . . A 50 VAL HG11 . 30210 1 484 . 1 1 50 50 VAL HG12 H 1 0.864 0.01 . . . . . . A 50 VAL HG12 . 30210 1 485 . 1 1 50 50 VAL HG13 H 1 0.864 0.01 . . . . . . A 50 VAL HG13 . 30210 1 486 . 1 1 50 50 VAL HG21 H 1 0.650 0.01 . . . . . . A 50 VAL HG21 . 30210 1 487 . 1 1 50 50 VAL HG22 H 1 0.650 0.01 . . . . . . A 50 VAL HG22 . 30210 1 488 . 1 1 50 50 VAL HG23 H 1 0.650 0.01 . . . . . . A 50 VAL HG23 . 30210 1 489 . 1 1 50 50 VAL CA C 13 58.312 0.01 . . . . . . A 50 VAL CA . 30210 1 490 . 1 1 50 50 VAL CB C 13 35.923 0.01 . . . . . . A 50 VAL CB . 30210 1 491 . 1 1 50 50 VAL CG1 C 13 21.650 0.01 . . . . . . A 50 VAL CG1 . 30210 1 492 . 1 1 50 50 VAL CG2 C 13 22.155 0.01 . . . . . . A 50 VAL CG2 . 30210 1 493 . 1 1 50 50 VAL N N 15 117.657 0.01 . . . . . . A 50 VAL N . 30210 1 494 . 1 1 51 51 ILE H H 1 8.212 0.01 . . . . . . A 51 ILE H . 30210 1 495 . 1 1 51 51 ILE HA H 1 3.947 0.01 . . . . . . A 51 ILE HA . 30210 1 496 . 1 1 51 51 ILE HB H 1 1.261 0.01 . . . . . . A 51 ILE HB . 30210 1 497 . 1 1 51 51 ILE HG12 H 1 0.696 0.01 . . . . . . A 51 ILE HG12 . 30210 1 498 . 1 1 51 51 ILE HG13 H 1 1.334 0.01 . . . . . . A 51 ILE HG13 . 30210 1 499 . 1 1 51 51 ILE HG21 H 1 0.017 0.01 . . . . . . A 51 ILE HG21 . 30210 1 500 . 1 1 51 51 ILE HG22 H 1 0.017 0.01 . . . . . . A 51 ILE HG22 . 30210 1 501 . 1 1 51 51 ILE HG23 H 1 0.017 0.01 . . . . . . A 51 ILE HG23 . 30210 1 502 . 1 1 51 51 ILE HD11 H 1 0.553 0.01 . . . . . . A 51 ILE HD11 . 30210 1 503 . 1 1 51 51 ILE HD12 H 1 0.553 0.01 . . . . . . A 51 ILE HD12 . 30210 1 504 . 1 1 51 51 ILE HD13 H 1 0.553 0.01 . . . . . . A 51 ILE HD13 . 30210 1 505 . 1 1 51 51 ILE CA C 13 61.115 0.01 . . . . . . A 51 ILE CA . 30210 1 506 . 1 1 51 51 ILE CB C 13 39.144 0.01 . . . . . . A 51 ILE CB . 30210 1 507 . 1 1 51 51 ILE CG1 C 13 28.556 0.01 . . . . . . A 51 ILE CG1 . 30210 1 508 . 1 1 51 51 ILE CG2 C 13 17.251 0.01 . . . . . . A 51 ILE CG2 . 30210 1 509 . 1 1 51 51 ILE CD1 C 13 13.336 0.01 . . . . . . A 51 ILE CD1 . 30210 1 510 . 1 1 51 51 ILE N N 15 127.024 0.01 . . . . . . A 51 ILE N . 30210 1 511 . 1 1 52 52 ALA H H 1 8.712 0.01 . . . . . . A 52 ALA H . 30210 1 512 . 1 1 52 52 ALA HA H 1 4.475 0.01 . . . . . . A 52 ALA HA . 30210 1 513 . 1 1 52 52 ALA HB1 H 1 0.926 0.01 . . . . . . A 52 ALA HB1 . 30210 1 514 . 1 1 52 52 ALA HB2 H 1 0.926 0.01 . . . . . . A 52 ALA HB2 . 30210 1 515 . 1 1 52 52 ALA HB3 H 1 0.926 0.01 . . . . . . A 52 ALA HB3 . 30210 1 516 . 1 1 52 52 ALA CA C 13 51.176 0.01 . . . . . . A 52 ALA CA . 30210 1 517 . 1 1 52 52 ALA CB C 13 20.820 0.01 . . . . . . A 52 ALA CB . 30210 1 518 . 1 1 52 52 ALA N N 15 127.663 0.01 . . . . . . A 52 ALA N . 30210 1 519 . 1 1 53 53 CYS H H 1 8.609 0.01 . . . . . . A 53 CYS H . 30210 1 520 . 1 1 53 53 CYS HA H 1 4.271 0.01 . . . . . . A 53 CYS HA . 30210 1 521 . 1 1 53 53 CYS HB2 H 1 2.921 0.01 . . . . . . A 53 CYS HB2 . 30210 1 522 . 1 1 53 53 CYS HB3 H 1 2.746 0.01 . . . . . . A 53 CYS HB3 . 30210 1 523 . 1 1 53 53 CYS CA C 13 58.356 0.01 . . . . . . A 53 CYS CA . 30210 1 524 . 1 1 53 53 CYS CB C 13 29.580 0.01 . . . . . . A 53 CYS CB . 30210 1 525 . 1 1 53 53 CYS N N 15 121.994 0.01 . . . . . . A 53 CYS N . 30210 1 526 . 1 1 54 54 PHE H H 1 11.177 0.01 . . . . . . A 54 PHE H . 30210 1 527 . 1 1 54 54 PHE HA H 1 3.576 0.01 . . . . . . A 54 PHE HA . 30210 1 528 . 1 1 54 54 PHE HB2 H 1 2.497 0.01 . . . . . . A 54 PHE HB2 . 30210 1 529 . 1 1 54 54 PHE HD1 H 1 6.978 0.01 . . . . . . A 54 PHE HD1 . 30210 1 530 . 1 1 54 54 PHE HE1 H 1 7.168 0.01 . . . . . . A 54 PHE HE1 . 30210 1 531 . 1 1 54 54 PHE HZ H 1 7.305 0.01 . . . . . . A 54 PHE HZ . 30210 1 532 . 1 1 54 54 PHE CA C 13 62.628 0.01 . . . . . . A 54 PHE CA . 30210 1 533 . 1 1 54 54 PHE CB C 13 37.600 0.01 . . . . . . A 54 PHE CB . 30210 1 534 . 1 1 54 54 PHE CD1 C 13 131.900 0.01 . . . . . . A 54 PHE CD1 . 30210 1 535 . 1 1 54 54 PHE CE1 C 13 131.502 0.01 . . . . . . A 54 PHE CE1 . 30210 1 536 . 1 1 54 54 PHE CZ C 13 130.034 0.01 . . . . . . A 54 PHE CZ . 30210 1 537 . 1 1 54 54 PHE N N 15 104.604 0.01 . . . . . . A 54 PHE N . 30210 1 538 . 1 1 55 55 ASP H H 1 9.065 0.01 . . . . . . A 55 ASP H . 30210 1 539 . 1 1 55 55 ASP HA H 1 4.048 0.01 . . . . . . A 55 ASP HA . 30210 1 540 . 1 1 55 55 ASP HB2 H 1 2.084 0.01 . . . . . . A 55 ASP HB2 . 30210 1 541 . 1 1 55 55 ASP HB3 H 1 2.578 0.01 . . . . . . A 55 ASP HB3 . 30210 1 542 . 1 1 55 55 ASP CA C 13 57.998 0.01 . . . . . . A 55 ASP CA . 30210 1 543 . 1 1 55 55 ASP CB C 13 39.400 0.01 . . . . . . A 55 ASP CB . 30210 1 544 . 1 1 55 55 ASP N N 15 121.422 0.01 . . . . . . A 55 ASP N . 30210 1 545 . 1 1 56 56 SER H H 1 9.339 0.01 . . . . . . A 56 SER H . 30210 1 546 . 1 1 56 56 SER HA H 1 3.924 0.01 . . . . . . A 56 SER HA . 30210 1 547 . 1 1 56 56 SER HB2 H 1 3.047 0.01 . . . . . . A 56 SER HB2 . 30210 1 548 . 1 1 56 56 SER HB3 H 1 2.950 0.01 . . . . . . A 56 SER HB3 . 30210 1 549 . 1 1 56 56 SER CA C 13 61.677 0.01 . . . . . . A 56 SER CA . 30210 1 550 . 1 1 56 56 SER CB C 13 61.425 0.01 . . . . . . A 56 SER CB . 30210 1 551 . 1 1 56 56 SER N N 15 121.716 0.01 . . . . . . A 56 SER N . 30210 1 552 . 1 1 57 57 LEU H H 1 7.747 0.01 . . . . . . A 57 LEU H . 30210 1 553 . 1 1 57 57 LEU HA H 1 3.694 0.01 . . . . . . A 57 LEU HA . 30210 1 554 . 1 1 57 57 LEU HB2 H 1 1.566 0.01 . . . . . . A 57 LEU HB2 . 30210 1 555 . 1 1 57 57 LEU HB3 H 1 1.258 0.01 . . . . . . A 57 LEU HB3 . 30210 1 556 . 1 1 57 57 LEU HG H 1 1.786 0.01 . . . . . . A 57 LEU HG . 30210 1 557 . 1 1 57 57 LEU HD11 H 1 0.562 0.01 . . . . . . A 57 LEU HD11 . 30210 1 558 . 1 1 57 57 LEU HD12 H 1 0.562 0.01 . . . . . . A 57 LEU HD12 . 30210 1 559 . 1 1 57 57 LEU HD13 H 1 0.562 0.01 . . . . . . A 57 LEU HD13 . 30210 1 560 . 1 1 57 57 LEU HD21 H 1 0.602 0.01 . . . . . . A 57 LEU HD21 . 30210 1 561 . 1 1 57 57 LEU HD22 H 1 0.602 0.01 . . . . . . A 57 LEU HD22 . 30210 1 562 . 1 1 57 57 LEU HD23 H 1 0.602 0.01 . . . . . . A 57 LEU HD23 . 30210 1 563 . 1 1 57 57 LEU CA C 13 57.707 0.01 . . . . . . A 57 LEU CA . 30210 1 564 . 1 1 57 57 LEU CB C 13 39.877 0.01 . . . . . . A 57 LEU CB . 30210 1 565 . 1 1 57 57 LEU CG C 13 26.338 0.01 . . . . . . A 57 LEU CG . 30210 1 566 . 1 1 57 57 LEU CD1 C 13 22.846 0.01 . . . . . . A 57 LEU CD1 . 30210 1 567 . 1 1 57 57 LEU CD2 C 13 25.227 0.01 . . . . . . A 57 LEU CD2 . 30210 1 568 . 1 1 57 57 LEU N N 15 125.288 0.01 . . . . . . A 57 LEU N . 30210 1 569 . 1 1 58 58 LYS H H 1 6.870 0.01 . . . . . . A 58 LYS H . 30210 1 570 . 1 1 58 58 LYS HA H 1 4.260 0.01 . . . . . . A 58 LYS HA . 30210 1 571 . 1 1 58 58 LYS HB2 H 1 1.334 0.01 . . . . . . A 58 LYS HB2 . 30210 1 572 . 1 1 58 58 LYS HB3 H 1 1.904 0.01 . . . . . . A 58 LYS HB3 . 30210 1 573 . 1 1 58 58 LYS HG2 H 1 1.148 0.01 . . . . . . A 58 LYS HG2 . 30210 1 574 . 1 1 58 58 LYS HD2 H 1 1.366 0.01 . . . . . . A 58 LYS HD2 . 30210 1 575 . 1 1 58 58 LYS HE2 H 1 2.611 0.01 . . . . . . A 58 LYS HE2 . 30210 1 576 . 1 1 58 58 LYS HE3 H 1 2.856 0.01 . . . . . . A 58 LYS HE3 . 30210 1 577 . 1 1 58 58 LYS CA C 13 53.187 0.01 . . . . . . A 58 LYS CA . 30210 1 578 . 1 1 58 58 LYS CB C 13 31.903 0.01 . . . . . . A 58 LYS CB . 30210 1 579 . 1 1 58 58 LYS CG C 13 24.230 0.01 . . . . . . A 58 LYS CG . 30210 1 580 . 1 1 58 58 LYS CD C 13 27.646 0.01 . . . . . . A 58 LYS CD . 30210 1 581 . 1 1 58 58 LYS CE C 13 41.954 0.01 . . . . . . A 58 LYS CE . 30210 1 582 . 1 1 58 58 LYS N N 15 113.723 0.01 . . . . . . A 58 LYS N . 30210 1 583 . 1 1 59 59 GLY H H 1 7.553 0.01 . . . . . . A 59 GLY H . 30210 1 584 . 1 1 59 59 GLY HA2 H 1 3.808 0.01 . . . . . . A 59 GLY HA2 . 30210 1 585 . 1 1 59 59 GLY HA3 H 1 3.740 0.01 . . . . . . A 59 GLY HA3 . 30210 1 586 . 1 1 59 59 GLY CA C 13 46.651 0.01 . . . . . . A 59 GLY CA . 30210 1 587 . 1 1 59 59 GLY N N 15 108.485 0.01 . . . . . . A 59 GLY N . 30210 1 588 . 1 1 60 60 ARG H H 1 8.001 0.01 . . . . . . A 60 ARG H . 30210 1 589 . 1 1 60 60 ARG HA H 1 4.537 0.01 . . . . . . A 60 ARG HA . 30210 1 590 . 1 1 60 60 ARG HB2 H 1 1.681 0.01 . . . . . . A 60 ARG HB2 . 30210 1 591 . 1 1 60 60 ARG HB3 H 1 1.601 0.01 . . . . . . A 60 ARG HB3 . 30210 1 592 . 1 1 60 60 ARG HG2 H 1 1.449 0.01 . . . . . . A 60 ARG HG2 . 30210 1 593 . 1 1 60 60 ARG HG3 H 1 1.305 0.01 . . . . . . A 60 ARG HG3 . 30210 1 594 . 1 1 60 60 ARG HD2 H 1 3.012 0.01 . . . . . . A 60 ARG HD2 . 30210 1 595 . 1 1 60 60 ARG HE H 1 7.233 0.01 . . . . . . A 60 ARG HE . 30210 1 596 . 1 1 60 60 ARG CA C 13 54.549 0.01 . . . . . . A 60 ARG CA . 30210 1 597 . 1 1 60 60 ARG CB C 13 31.395 0.01 . . . . . . A 60 ARG CB . 30210 1 598 . 1 1 60 60 ARG CG C 13 26.578 0.01 . . . . . . A 60 ARG CG . 30210 1 599 . 1 1 60 60 ARG N N 15 115.874 0.01 . . . . . . A 60 ARG N . 30210 1 600 . 1 1 60 60 ARG NE N 15 84.969 0.01 . . . . . . A 60 ARG NE . 30210 1 601 . 1 1 61 61 CYS H H 1 7.904 0.01 . . . . . . A 61 CYS H . 30210 1 602 . 1 1 61 61 CYS HA H 1 4.444 0.01 . . . . . . A 61 CYS HA . 30210 1 603 . 1 1 61 61 CYS HB2 H 1 2.671 0.01 . . . . . . A 61 CYS HB2 . 30210 1 604 . 1 1 61 61 CYS HB3 H 1 2.307 0.01 . . . . . . A 61 CYS HB3 . 30210 1 605 . 1 1 61 61 CYS CA C 13 59.728 0.01 . . . . . . A 61 CYS CA . 30210 1 606 . 1 1 61 61 CYS CB C 13 29.737 0.01 . . . . . . A 61 CYS CB . 30210 1 607 . 1 1 61 61 CYS N N 15 123.318 0.01 . . . . . . A 61 CYS N . 30210 1 608 . 1 1 62 62 SER H H 1 9.273 0.01 . . . . . . A 62 SER H . 30210 1 609 . 1 1 62 62 SER HA H 1 4.638 0.01 . . . . . . A 62 SER HA . 30210 1 610 . 1 1 62 62 SER HB2 H 1 3.644 0.01 . . . . . . A 62 SER HB2 . 30210 1 611 . 1 1 62 62 SER HB3 H 1 3.848 0.01 . . . . . . A 62 SER HB3 . 30210 1 612 . 1 1 62 62 SER CA C 13 56.979 0.01 . . . . . . A 62 SER CA . 30210 1 613 . 1 1 62 62 SER CB C 13 63.554 0.01 . . . . . . A 62 SER CB . 30210 1 614 . 1 1 62 62 SER N N 15 126.266 0.01 . . . . . . A 62 SER N . 30210 1 615 . 1 1 63 63 ARG H H 1 7.842 0.01 . . . . . . A 63 ARG H . 30210 1 616 . 1 1 63 63 ARG HA H 1 4.040 0.01 . . . . . . A 63 ARG HA . 30210 1 617 . 1 1 63 63 ARG HB2 H 1 1.320 0.01 . . . . . . A 63 ARG HB2 . 30210 1 618 . 1 1 63 63 ARG HB3 H 1 1.496 0.01 . . . . . . A 63 ARG HB3 . 30210 1 619 . 1 1 63 63 ARG HG2 H 1 1.360 0.01 . . . . . . A 63 ARG HG2 . 30210 1 620 . 1 1 63 63 ARG CA C 13 56.541 0.01 . . . . . . A 63 ARG CA . 30210 1 621 . 1 1 63 63 ARG CB C 13 31.474 0.01 . . . . . . A 63 ARG CB . 30210 1 622 . 1 1 63 63 ARG CG C 13 26.702 0.01 . . . . . . A 63 ARG CG . 30210 1 623 . 1 1 63 63 ARG N N 15 123.408 0.01 . . . . . . A 63 ARG N . 30210 1 624 . 1 1 64 64 GLU H H 1 8.883 0.01 . . . . . . A 64 GLU H . 30210 1 625 . 1 1 64 64 GLU HA H 1 3.967 0.01 . . . . . . A 64 GLU HA . 30210 1 626 . 1 1 64 64 GLU HB2 H 1 1.818 0.01 . . . . . . A 64 GLU HB2 . 30210 1 627 . 1 1 64 64 GLU HG2 H 1 2.188 0.01 . . . . . . A 64 GLU HG2 . 30210 1 628 . 1 1 64 64 GLU HG3 H 1 2.121 0.01 . . . . . . A 64 GLU HG3 . 30210 1 629 . 1 1 64 64 GLU CA C 13 57.871 0.01 . . . . . . A 64 GLU CA . 30210 1 630 . 1 1 64 64 GLU CB C 13 29.821 0.01 . . . . . . A 64 GLU CB . 30210 1 631 . 1 1 64 64 GLU CG C 13 36.019 0.01 . . . . . . A 64 GLU CG . 30210 1 632 . 1 1 64 64 GLU N N 15 124.375 0.01 . . . . . . A 64 GLU N . 30210 1 633 . 1 1 65 65 ASN H H 1 8.349 0.01 . . . . . . A 65 ASN H . 30210 1 634 . 1 1 65 65 ASN HA H 1 4.557 0.01 . . . . . . A 65 ASN HA . 30210 1 635 . 1 1 65 65 ASN HB2 H 1 2.534 0.01 . . . . . . A 65 ASN HB2 . 30210 1 636 . 1 1 65 65 ASN HB3 H 1 2.494 0.01 . . . . . . A 65 ASN HB3 . 30210 1 637 . 1 1 65 65 ASN HD21 H 1 7.540 0.01 . . . . . . A 65 ASN HD21 . 30210 1 638 . 1 1 65 65 ASN HD22 H 1 6.848 0.01 . . . . . . A 65 ASN HD22 . 30210 1 639 . 1 1 65 65 ASN CA C 13 52.020 0.01 . . . . . . A 65 ASN CA . 30210 1 640 . 1 1 65 65 ASN CB C 13 38.773 0.01 . . . . . . A 65 ASN CB . 30210 1 641 . 1 1 65 65 ASN N N 15 118.368 0.01 . . . . . . A 65 ASN N . 30210 1 642 . 1 1 65 65 ASN ND2 N 15 113.601 0.01 . . . . . . A 65 ASN ND2 . 30210 1 643 . 1 1 66 66 CYS H H 1 7.905 0.01 . . . . . . A 66 CYS H . 30210 1 644 . 1 1 66 66 CYS HA H 1 4.241 0.01 . . . . . . A 66 CYS HA . 30210 1 645 . 1 1 66 66 CYS HB2 H 1 2.656 0.01 . . . . . . A 66 CYS HB2 . 30210 1 646 . 1 1 66 66 CYS CA C 13 59.466 0.01 . . . . . . A 66 CYS CA . 30210 1 647 . 1 1 66 66 CYS CB C 13 30.439 0.01 . . . . . . A 66 CYS CB . 30210 1 648 . 1 1 66 66 CYS N N 15 123.316 0.01 . . . . . . A 66 CYS N . 30210 1 649 . 1 1 67 67 LYS H H 1 8.459 0.01 . . . . . . A 67 LYS H . 30210 1 650 . 1 1 67 67 LYS HA H 1 4.352 0.01 . . . . . . A 67 LYS HA . 30210 1 651 . 1 1 67 67 LYS HB2 H 1 1.397 0.01 . . . . . . A 67 LYS HB2 . 30210 1 652 . 1 1 67 67 LYS HB3 H 1 1.333 0.01 . . . . . . A 67 LYS HB3 . 30210 1 653 . 1 1 67 67 LYS HG2 H 1 0.387 0.01 . . . . . . A 67 LYS HG2 . 30210 1 654 . 1 1 67 67 LYS HG3 H 1 0.791 0.01 . . . . . . A 67 LYS HG3 . 30210 1 655 . 1 1 67 67 LYS HD2 H 1 1.282 0.01 . . . . . . A 67 LYS HD2 . 30210 1 656 . 1 1 67 67 LYS HD3 H 1 1.171 0.01 . . . . . . A 67 LYS HD3 . 30210 1 657 . 1 1 67 67 LYS HE2 H 1 2.512 0.01 . . . . . . A 67 LYS HE2 . 30210 1 658 . 1 1 67 67 LYS HE3 H 1 2.405 0.01 . . . . . . A 67 LYS HE3 . 30210 1 659 . 1 1 67 67 LYS CA C 13 56.411 0.01 . . . . . . A 67 LYS CA . 30210 1 660 . 1 1 67 67 LYS CB C 13 33.008 0.01 . . . . . . A 67 LYS CB . 30210 1 661 . 1 1 67 67 LYS CG C 13 22.875 0.01 . . . . . . A 67 LYS CG . 30210 1 662 . 1 1 67 67 LYS CD C 13 29.706 0.01 . . . . . . A 67 LYS CD . 30210 1 663 . 1 1 67 67 LYS CE C 13 41.631 0.01 . . . . . . A 67 LYS CE . 30210 1 664 . 1 1 67 67 LYS N N 15 128.340 0.01 . . . . . . A 67 LYS N . 30210 1 665 . 1 1 68 68 TYR H H 1 8.310 0.01 . . . . . . A 68 TYR H . 30210 1 666 . 1 1 68 68 TYR HA H 1 5.194 0.01 . . . . . . A 68 TYR HA . 30210 1 667 . 1 1 68 68 TYR HB2 H 1 2.993 0.01 . . . . . . A 68 TYR HB2 . 30210 1 668 . 1 1 68 68 TYR HB3 H 1 2.373 0.01 . . . . . . A 68 TYR HB3 . 30210 1 669 . 1 1 68 68 TYR HD1 H 1 6.701 0.01 . . . . . . A 68 TYR HD1 . 30210 1 670 . 1 1 68 68 TYR HE1 H 1 5.975 0.01 . . . . . . A 68 TYR HE1 . 30210 1 671 . 1 1 68 68 TYR CA C 13 53.331 0.01 . . . . . . A 68 TYR CA . 30210 1 672 . 1 1 68 68 TYR CB C 13 40.246 0.01 . . . . . . A 68 TYR CB . 30210 1 673 . 1 1 68 68 TYR CD1 C 13 131.325 0.01 . . . . . . A 68 TYR CD1 . 30210 1 674 . 1 1 68 68 TYR CE1 C 13 116.543 0.01 . . . . . . A 68 TYR CE1 . 30210 1 675 . 1 1 68 68 TYR N N 15 123.116 0.01 . . . . . . A 68 TYR N . 30210 1 676 . 1 1 69 69 LEU H H 1 8.963 0.01 . . . . . . A 69 LEU H . 30210 1 677 . 1 1 69 69 LEU HA H 1 4.021 0.01 . . . . . . A 69 LEU HA . 30210 1 678 . 1 1 69 69 LEU HB2 H 1 1.344 0.01 . . . . . . A 69 LEU HB2 . 30210 1 679 . 1 1 69 69 LEU HB3 H 1 1.222 0.01 . . . . . . A 69 LEU HB3 . 30210 1 680 . 1 1 69 69 LEU HG H 1 1.034 0.01 . . . . . . A 69 LEU HG . 30210 1 681 . 1 1 69 69 LEU HD11 H 1 0.604 0.01 . . . . . . A 69 LEU HD11 . 30210 1 682 . 1 1 69 69 LEU HD12 H 1 0.604 0.01 . . . . . . A 69 LEU HD12 . 30210 1 683 . 1 1 69 69 LEU HD13 H 1 0.604 0.01 . . . . . . A 69 LEU HD13 . 30210 1 684 . 1 1 69 69 LEU HD21 H 1 0.797 0.01 . . . . . . A 69 LEU HD21 . 30210 1 685 . 1 1 69 69 LEU HD22 H 1 0.797 0.01 . . . . . . A 69 LEU HD22 . 30210 1 686 . 1 1 69 69 LEU HD23 H 1 0.797 0.01 . . . . . . A 69 LEU HD23 . 30210 1 687 . 1 1 69 69 LEU CA C 13 55.806 0.01 . . . . . . A 69 LEU CA . 30210 1 688 . 1 1 69 69 LEU CB C 13 44.412 0.01 . . . . . . A 69 LEU CB . 30210 1 689 . 1 1 69 69 LEU CG C 13 27.150 0.01 . . . . . . A 69 LEU CG . 30210 1 690 . 1 1 69 69 LEU CD1 C 13 27.699 0.01 . . . . . . A 69 LEU CD1 . 30210 1 691 . 1 1 69 69 LEU CD2 C 13 24.325 0.01 . . . . . . A 69 LEU CD2 . 30210 1 692 . 1 1 69 69 LEU N N 15 122.316 0.01 . . . . . . A 69 LEU N . 30210 1 693 . 1 1 70 70 HIS H H 1 9.112 0.01 . . . . . . A 70 HIS H . 30210 1 694 . 1 1 70 70 HIS HA H 1 5.342 0.01 . . . . . . A 70 HIS HA . 30210 1 695 . 1 1 70 70 HIS HB2 H 1 3.174 0.01 . . . . . . A 70 HIS HB2 . 30210 1 696 . 1 1 70 70 HIS HB3 H 1 2.896 0.01 . . . . . . A 70 HIS HB3 . 30210 1 697 . 1 1 70 70 HIS HD2 H 1 7.014 0.01 . . . . . . A 70 HIS HD2 . 30210 1 698 . 1 1 70 70 HIS HE1 H 1 7.777 0.01 . . . . . . A 70 HIS HE1 . 30210 1 699 . 1 1 70 70 HIS CA C 13 52.482 0.01 . . . . . . A 70 HIS CA . 30210 1 700 . 1 1 70 70 HIS CB C 13 27.258 0.01 . . . . . . A 70 HIS CB . 30210 1 701 . 1 1 70 70 HIS CD2 C 13 125.336 0.01 . . . . . . A 70 HIS CD2 . 30210 1 702 . 1 1 70 70 HIS CE1 C 13 138.311 0.01 . . . . . . A 70 HIS CE1 . 30210 1 703 . 1 1 70 70 HIS N N 15 130.191 0.01 . . . . . . A 70 HIS N . 30210 1 704 . 1 1 71 71 PRO HA H 1 4.212 0.01 . . . . . . A 71 PRO HA . 30210 1 705 . 1 1 71 71 PRO HG2 H 1 1.477 0.01 . . . . . . A 71 PRO HG2 . 30210 1 706 . 1 1 71 71 PRO HD2 H 1 4.116 0.01 . . . . . . A 71 PRO HD2 . 30210 1 707 . 1 1 71 71 PRO HD3 H 1 3.521 0.01 . . . . . . A 71 PRO HD3 . 30210 1 708 . 1 1 71 71 PRO CA C 13 60.926 0.01 . . . . . . A 71 PRO CA . 30210 1 709 . 1 1 71 71 PRO CG C 13 27.142 0.01 . . . . . . A 71 PRO CG . 30210 1 710 . 1 1 71 71 PRO CD C 13 51.198 0.01 . . . . . . A 71 PRO CD . 30210 1 711 . 1 1 72 72 PRO HA H 1 4.784 0.01 . . . . . . A 72 PRO HA . 30210 1 712 . 1 1 72 72 PRO HB2 H 1 2.249 0.01 . . . . . . A 72 PRO HB2 . 30210 1 713 . 1 1 72 72 PRO HB3 H 1 2.135 0.01 . . . . . . A 72 PRO HB3 . 30210 1 714 . 1 1 72 72 PRO HG2 H 1 1.967 0.01 . . . . . . A 72 PRO HG2 . 30210 1 715 . 1 1 72 72 PRO HG3 H 1 1.558 0.01 . . . . . . A 72 PRO HG3 . 30210 1 716 . 1 1 72 72 PRO HD2 H 1 3.229 0.01 . . . . . . A 72 PRO HD2 . 30210 1 717 . 1 1 72 72 PRO HD3 H 1 3.758 0.01 . . . . . . A 72 PRO HD3 . 30210 1 718 . 1 1 72 72 PRO CA C 13 61.448 0.01 . . . . . . A 72 PRO CA . 30210 1 719 . 1 1 72 72 PRO CB C 13 30.388 0.01 . . . . . . A 72 PRO CB . 30210 1 720 . 1 1 72 72 PRO CG C 13 27.354 0.01 . . . . . . A 72 PRO CG . 30210 1 721 . 1 1 72 72 PRO CD C 13 50.897 0.01 . . . . . . A 72 PRO CD . 30210 1 722 . 1 1 73 73 PRO HA H 1 3.964 0.01 . . . . . . A 73 PRO HA . 30210 1 723 . 1 1 73 73 PRO HB2 H 1 2.334 0.01 . . . . . . A 73 PRO HB2 . 30210 1 724 . 1 1 73 73 PRO HB3 H 1 1.954 0.01 . . . . . . A 73 PRO HB3 . 30210 1 725 . 1 1 73 73 PRO HG2 H 1 1.929 0.01 . . . . . . A 73 PRO HG2 . 30210 1 726 . 1 1 73 73 PRO HG3 H 1 1.951 0.01 . . . . . . A 73 PRO HG3 . 30210 1 727 . 1 1 73 73 PRO HD2 H 1 3.826 0.01 . . . . . . A 73 PRO HD2 . 30210 1 728 . 1 1 73 73 PRO HD3 H 1 3.682 0.01 . . . . . . A 73 PRO HD3 . 30210 1 729 . 1 1 73 73 PRO CA C 13 67.047 0.01 . . . . . . A 73 PRO CA . 30210 1 730 . 1 1 73 73 PRO CB C 13 62.563 0.01 . . . . . . A 73 PRO CB . 30210 1 731 . 1 1 73 73 PRO CG C 13 27.676 0.01 . . . . . . A 73 PRO CG . 30210 1 732 . 1 1 73 73 PRO CD C 13 50.432 0.01 . . . . . . A 73 PRO CD . 30210 1 733 . 1 1 74 74 HIS HA H 1 4.404 0.01 . . . . . . A 74 HIS HA . 30210 1 734 . 1 1 74 74 HIS HB2 H 1 2.992 0.01 . . . . . . A 74 HIS HB2 . 30210 1 735 . 1 1 74 74 HIS HD2 H 1 6.679 0.01 . . . . . . A 74 HIS HD2 . 30210 1 736 . 1 1 74 74 HIS HE2 H 1 7.978 0.01 . . . . . . A 74 HIS HE2 . 30210 1 737 . 1 1 74 74 HIS CA C 13 59.050 0.01 . . . . . . A 74 HIS CA . 30210 1 738 . 1 1 74 74 HIS CB C 13 28.675 0.01 . . . . . . A 74 HIS CB . 30210 1 739 . 1 1 74 74 HIS CD2 C 13 117.399 0.01 . . . . . . A 74 HIS CD2 . 30210 1 740 . 1 1 74 74 HIS CE1 C 13 139.259 0.01 . . . . . . A 74 HIS CE1 . 30210 1 741 . 1 1 75 75 LEU H H 1 6.487 0.01 . . . . . . A 75 LEU H . 30210 1 742 . 1 1 75 75 LEU HA H 1 3.985 0.01 . . . . . . A 75 LEU HA . 30210 1 743 . 1 1 75 75 LEU HB2 H 1 1.192 0.01 . . . . . . A 75 LEU HB2 . 30210 1 744 . 1 1 75 75 LEU HB3 H 1 1.011 0.01 . . . . . . A 75 LEU HB3 . 30210 1 745 . 1 1 75 75 LEU HG H 1 0.133 0.01 . . . . . . A 75 LEU HG . 30210 1 746 . 1 1 75 75 LEU HD11 H 1 0.406 0.01 . . . . . . A 75 LEU HD11 . 30210 1 747 . 1 1 75 75 LEU HD12 H 1 0.406 0.01 . . . . . . A 75 LEU HD12 . 30210 1 748 . 1 1 75 75 LEU HD13 H 1 0.406 0.01 . . . . . . A 75 LEU HD13 . 30210 1 749 . 1 1 75 75 LEU HD21 H 1 0.347 0.01 . . . . . . A 75 LEU HD21 . 30210 1 750 . 1 1 75 75 LEU HD22 H 1 0.347 0.01 . . . . . . A 75 LEU HD22 . 30210 1 751 . 1 1 75 75 LEU HD23 H 1 0.347 0.01 . . . . . . A 75 LEU HD23 . 30210 1 752 . 1 1 75 75 LEU CA C 13 56.001 0.01 . . . . . . A 75 LEU CA . 30210 1 753 . 1 1 75 75 LEU CB C 13 41.242 0.01 . . . . . . A 75 LEU CB . 30210 1 754 . 1 1 75 75 LEU CD1 C 13 24.604 0.01 . . . . . . A 75 LEU CD1 . 30210 1 755 . 1 1 75 75 LEU CD2 C 13 22.220 0.01 . . . . . . A 75 LEU CD2 . 30210 1 756 . 1 1 75 75 LEU N N 15 121.751 0.01 . . . . . . A 75 LEU N . 30210 1 757 . 1 1 76 76 LYS H H 1 8.064 0.01 . . . . . . A 76 LYS H . 30210 1 758 . 1 1 76 76 LYS HA H 1 3.568 0.01 . . . . . . A 76 LYS HA . 30210 1 759 . 1 1 76 76 LYS HB2 H 1 1.831 0.01 . . . . . . A 76 LYS HB2 . 30210 1 760 . 1 1 76 76 LYS HG2 H 1 1.246 0.01 . . . . . . A 76 LYS HG2 . 30210 1 761 . 1 1 76 76 LYS HG3 H 1 1.038 0.01 . . . . . . A 76 LYS HG3 . 30210 1 762 . 1 1 76 76 LYS HD2 H 1 1.540 0.01 . . . . . . A 76 LYS HD2 . 30210 1 763 . 1 1 76 76 LYS HE2 H 1 2.769 0.01 . . . . . . A 76 LYS HE2 . 30210 1 764 . 1 1 76 76 LYS HE3 H 1 2.880 0.01 . . . . . . A 76 LYS HE3 . 30210 1 765 . 1 1 76 76 LYS CA C 13 60.837 0.01 . . . . . . A 76 LYS CA . 30210 1 766 . 1 1 76 76 LYS CB C 13 31.958 0.01 . . . . . . A 76 LYS CB . 30210 1 767 . 1 1 76 76 LYS CG C 13 25.649 0.01 . . . . . . A 76 LYS CG . 30210 1 768 . 1 1 76 76 LYS CD C 13 29.832 0.01 . . . . . . A 76 LYS CD . 30210 1 769 . 1 1 76 76 LYS CE C 13 41.863 0.01 . . . . . . A 76 LYS CE . 30210 1 770 . 1 1 76 76 LYS N N 15 122.096 0.01 . . . . . . A 76 LYS N . 30210 1 771 . 1 1 77 77 THR H H 1 7.894 0.01 . . . . . . A 77 THR H . 30210 1 772 . 1 1 77 77 THR HA H 1 3.833 0.01 . . . . . . A 77 THR HA . 30210 1 773 . 1 1 77 77 THR HB H 1 4.011 0.01 . . . . . . A 77 THR HB . 30210 1 774 . 1 1 77 77 THR HG21 H 1 1.141 0.01 . . . . . . A 77 THR HG21 . 30210 1 775 . 1 1 77 77 THR HG22 H 1 1.141 0.01 . . . . . . A 77 THR HG22 . 30210 1 776 . 1 1 77 77 THR HG23 H 1 1.141 0.01 . . . . . . A 77 THR HG23 . 30210 1 777 . 1 1 77 77 THR CA C 13 66.495 0.01 . . . . . . A 77 THR CA . 30210 1 778 . 1 1 77 77 THR CB C 13 68.814 0.01 . . . . . . A 77 THR CB . 30210 1 779 . 1 1 77 77 THR CG2 C 13 22.049 0.01 . . . . . . A 77 THR CG2 . 30210 1 780 . 1 1 77 77 THR N N 15 114.313 0.01 . . . . . . A 77 THR N . 30210 1 781 . 1 1 78 78 GLN H H 1 6.968 0.01 . . . . . . A 78 GLN H . 30210 1 782 . 1 1 78 78 GLN HA H 1 3.835 0.01 . . . . . . A 78 GLN HA . 30210 1 783 . 1 1 78 78 GLN HB2 H 1 2.037 0.01 . . . . . . A 78 GLN HB2 . 30210 1 784 . 1 1 78 78 GLN HG2 H 1 2.237 0.01 . . . . . . A 78 GLN HG2 . 30210 1 785 . 1 1 78 78 GLN HG3 H 1 2.180 0.01 . . . . . . A 78 GLN HG3 . 30210 1 786 . 1 1 78 78 GLN CA C 13 58.959 0.01 . . . . . . A 78 GLN CA . 30210 1 787 . 1 1 78 78 GLN CB C 13 29.128 0.01 . . . . . . A 78 GLN CB . 30210 1 788 . 1 1 78 78 GLN CG C 13 33.818 0.01 . . . . . . A 78 GLN CG . 30210 1 789 . 1 1 78 78 GLN N N 15 119.518 0.01 . . . . . . A 78 GLN N . 30210 1 790 . 1 1 79 79 LEU H H 1 8.056 0.01 . . . . . . A 79 LEU H . 30210 1 791 . 1 1 79 79 LEU HA H 1 4.167 0.01 . . . . . . A 79 LEU HA . 30210 1 792 . 1 1 79 79 LEU HB2 H 1 2.001 0.01 . . . . . . A 79 LEU HB2 . 30210 1 793 . 1 1 79 79 LEU HB3 H 1 1.363 0.01 . . . . . . A 79 LEU HB3 . 30210 1 794 . 1 1 79 79 LEU HG H 1 1.802 0.01 . . . . . . A 79 LEU HG . 30210 1 795 . 1 1 79 79 LEU HD11 H 1 0.539 0.01 . . . . . . A 79 LEU HD11 . 30210 1 796 . 1 1 79 79 LEU HD12 H 1 0.539 0.01 . . . . . . A 79 LEU HD12 . 30210 1 797 . 1 1 79 79 LEU HD13 H 1 0.539 0.01 . . . . . . A 79 LEU HD13 . 30210 1 798 . 1 1 79 79 LEU HD21 H 1 0.721 0.01 . . . . . . A 79 LEU HD21 . 30210 1 799 . 1 1 79 79 LEU HD22 H 1 0.721 0.01 . . . . . . A 79 LEU HD22 . 30210 1 800 . 1 1 79 79 LEU HD23 H 1 0.721 0.01 . . . . . . A 79 LEU HD23 . 30210 1 801 . 1 1 79 79 LEU CA C 13 58.280 0.01 . . . . . . A 79 LEU CA . 30210 1 802 . 1 1 79 79 LEU CB C 13 42.400 0.01 . . . . . . A 79 LEU CB . 30210 1 803 . 1 1 79 79 LEU CG C 13 26.844 0.01 . . . . . . A 79 LEU CG . 30210 1 804 . 1 1 79 79 LEU CD1 C 13 27.791 0.01 . . . . . . A 79 LEU CD1 . 30210 1 805 . 1 1 79 79 LEU CD2 C 13 24.412 0.01 . . . . . . A 79 LEU CD2 . 30210 1 806 . 1 1 79 79 LEU N N 15 119.568 0.01 . . . . . . A 79 LEU N . 30210 1 807 . 1 1 80 80 GLU H H 1 8.144 0.01 . . . . . . A 80 GLU H . 30210 1 808 . 1 1 80 80 GLU HA H 1 4.042 0.01 . . . . . . A 80 GLU HA . 30210 1 809 . 1 1 80 80 GLU HB2 H 1 2.202 0.01 . . . . . . A 80 GLU HB2 . 30210 1 810 . 1 1 80 80 GLU HB3 H 1 1.931 0.01 . . . . . . A 80 GLU HB3 . 30210 1 811 . 1 1 80 80 GLU HG2 H 1 2.505 0.01 . . . . . . A 80 GLU HG2 . 30210 1 812 . 1 1 80 80 GLU HG3 H 1 2.071 0.01 . . . . . . A 80 GLU HG3 . 30210 1 813 . 1 1 80 80 GLU CA C 13 59.422 0.01 . . . . . . A 80 GLU CA . 30210 1 814 . 1 1 80 80 GLU CB C 13 29.012 0.01 . . . . . . A 80 GLU CB . 30210 1 815 . 1 1 80 80 GLU CG C 13 36.352 0.01 . . . . . . A 80 GLU CG . 30210 1 816 . 1 1 80 80 GLU N N 15 118.557 0.01 . . . . . . A 80 GLU N . 30210 1 817 . 1 1 81 81 ILE H H 1 8.069 0.01 . . . . . . A 81 ILE H . 30210 1 818 . 1 1 81 81 ILE HA H 1 3.584 0.01 . . . . . . A 81 ILE HA . 30210 1 819 . 1 1 81 81 ILE HB H 1 1.832 0.01 . . . . . . A 81 ILE HB . 30210 1 820 . 1 1 81 81 ILE HG12 H 1 0.987 0.01 . . . . . . A 81 ILE HG12 . 30210 1 821 . 1 1 81 81 ILE HG13 H 1 1.624 0.01 . . . . . . A 81 ILE HG13 . 30210 1 822 . 1 1 81 81 ILE HG21 H 1 0.694 0.01 . . . . . . A 81 ILE HG21 . 30210 1 823 . 1 1 81 81 ILE HG22 H 1 0.694 0.01 . . . . . . A 81 ILE HG22 . 30210 1 824 . 1 1 81 81 ILE HG23 H 1 0.694 0.01 . . . . . . A 81 ILE HG23 . 30210 1 825 . 1 1 81 81 ILE HD11 H 1 0.798 0.01 . . . . . . A 81 ILE HD11 . 30210 1 826 . 1 1 81 81 ILE HD12 H 1 0.798 0.01 . . . . . . A 81 ILE HD12 . 30210 1 827 . 1 1 81 81 ILE HD13 H 1 0.798 0.01 . . . . . . A 81 ILE HD13 . 30210 1 828 . 1 1 81 81 ILE CA C 13 65.032 0.01 . . . . . . A 81 ILE CA . 30210 1 829 . 1 1 81 81 ILE CB C 13 38.257 0.01 . . . . . . A 81 ILE CB . 30210 1 830 . 1 1 81 81 ILE CG1 C 13 29.090 0.01 . . . . . . A 81 ILE CG1 . 30210 1 831 . 1 1 81 81 ILE CG2 C 13 17.162 0.01 . . . . . . A 81 ILE CG2 . 30210 1 832 . 1 1 81 81 ILE CD1 C 13 13.606 0.01 . . . . . . A 81 ILE CD1 . 30210 1 833 . 1 1 81 81 ILE N N 15 121.327 0.01 . . . . . . A 81 ILE N . 30210 1 834 . 1 1 82 82 ASN H H 1 8.450 0.01 . . . . . . A 82 ASN H . 30210 1 835 . 1 1 82 82 ASN HA H 1 4.439 0.01 . . . . . . A 82 ASN HA . 30210 1 836 . 1 1 82 82 ASN HB2 H 1 3.243 0.01 . . . . . . A 82 ASN HB2 . 30210 1 837 . 1 1 82 82 ASN HB3 H 1 2.948 0.01 . . . . . . A 82 ASN HB3 . 30210 1 838 . 1 1 82 82 ASN CA C 13 55.507 0.01 . . . . . . A 82 ASN CA . 30210 1 839 . 1 1 82 82 ASN CB C 13 37.823 0.01 . . . . . . A 82 ASN CB . 30210 1 840 . 1 1 82 82 ASN N N 15 120.010 0.01 . . . . . . A 82 ASN N . 30210 1 841 . 1 1 83 83 GLY H H 1 8.994 0.01 . . . . . . A 83 GLY H . 30210 1 842 . 1 1 83 83 GLY HA2 H 1 3.274 0.01 . . . . . . A 83 GLY HA2 . 30210 1 843 . 1 1 83 83 GLY HA3 H 1 3.116 0.01 . . . . . . A 83 GLY HA3 . 30210 1 844 . 1 1 83 83 GLY CA C 13 47.582 0.01 . . . . . . A 83 GLY CA . 30210 1 845 . 1 1 83 83 GLY N N 15 109.194 0.01 . . . . . . A 83 GLY N . 30210 1 846 . 1 1 84 84 ARG H H 1 7.792 0.01 . . . . . . A 84 ARG H . 30210 1 847 . 1 1 84 84 ARG HA H 1 3.874 0.01 . . . . . . A 84 ARG HA . 30210 1 848 . 1 1 84 84 ARG HB2 H 1 1.766 0.01 . . . . . . A 84 ARG HB2 . 30210 1 849 . 1 1 84 84 ARG HG2 H 1 1.575 0.01 . . . . . . A 84 ARG HG2 . 30210 1 850 . 1 1 84 84 ARG HD2 H 1 2.984 0.01 . . . . . . A 84 ARG HD2 . 30210 1 851 . 1 1 84 84 ARG HD3 H 1 3.029 0.01 . . . . . . A 84 ARG HD3 . 30210 1 852 . 1 1 84 84 ARG CA C 13 58.410 0.01 . . . . . . A 84 ARG CA . 30210 1 853 . 1 1 84 84 ARG CB C 13 29.789 0.01 . . . . . . A 84 ARG CB . 30210 1 854 . 1 1 84 84 ARG CG C 13 27.592 0.01 . . . . . . A 84 ARG CG . 30210 1 855 . 1 1 84 84 ARG CD C 13 43.394 0.01 . . . . . . A 84 ARG CD . 30210 1 856 . 1 1 84 84 ARG N N 15 122.607 0.01 . . . . . . A 84 ARG N . 30210 1 857 . 1 1 85 85 ASN H H 1 8.072 0.01 . . . . . . A 85 ASN H . 30210 1 858 . 1 1 85 85 ASN HA H 1 4.428 0.01 . . . . . . A 85 ASN HA . 30210 1 859 . 1 1 85 85 ASN HB2 H 1 2.734 0.01 . . . . . . A 85 ASN HB2 . 30210 1 860 . 1 1 85 85 ASN CA C 13 54.868 0.01 . . . . . . A 85 ASN CA . 30210 1 861 . 1 1 85 85 ASN CB C 13 38.041 0.01 . . . . . . A 85 ASN CB . 30210 1 862 . 1 1 85 85 ASN N N 15 118.095 0.01 . . . . . . A 85 ASN N . 30210 1 863 . 1 1 86 86 ASN H H 1 7.703 0.01 . . . . . . A 86 ASN H . 30210 1 864 . 1 1 86 86 ASN HA H 1 4.425 0.01 . . . . . . A 86 ASN HA . 30210 1 865 . 1 1 86 86 ASN HB2 H 1 2.648 0.01 . . . . . . A 86 ASN HB2 . 30210 1 866 . 1 1 86 86 ASN HB3 H 1 2.605 0.01 . . . . . . A 86 ASN HB3 . 30210 1 867 . 1 1 86 86 ASN CA C 13 54.648 0.01 . . . . . . A 86 ASN CA . 30210 1 868 . 1 1 86 86 ASN CB C 13 38.974 0.01 . . . . . . A 86 ASN CB . 30210 1 869 . 1 1 86 86 ASN N N 15 117.520 0.01 . . . . . . A 86 ASN N . 30210 1 870 . 1 1 87 87 LEU H H 1 7.351 0.01 . . . . . . A 87 LEU H . 30210 1 871 . 1 1 87 87 LEU HA H 1 4.017 0.01 . . . . . . A 87 LEU HA . 30210 1 872 . 1 1 87 87 LEU HB2 H 1 1.566 0.01 . . . . . . A 87 LEU HB2 . 30210 1 873 . 1 1 87 87 LEU HB3 H 1 1.321 0.01 . . . . . . A 87 LEU HB3 . 30210 1 874 . 1 1 87 87 LEU HD11 H 1 0.544 0.01 . . . . . . A 87 LEU HD11 . 30210 1 875 . 1 1 87 87 LEU HD12 H 1 0.544 0.01 . . . . . . A 87 LEU HD12 . 30210 1 876 . 1 1 87 87 LEU HD13 H 1 0.544 0.01 . . . . . . A 87 LEU HD13 . 30210 1 877 . 1 1 87 87 LEU HD21 H 1 0.480 0.01 . . . . . . A 87 LEU HD21 . 30210 1 878 . 1 1 87 87 LEU HD22 H 1 0.480 0.01 . . . . . . A 87 LEU HD22 . 30210 1 879 . 1 1 87 87 LEU HD23 H 1 0.480 0.01 . . . . . . A 87 LEU HD23 . 30210 1 880 . 1 1 87 87 LEU CA C 13 55.444 0.01 . . . . . . A 87 LEU CA . 30210 1 881 . 1 1 87 87 LEU CB C 13 42.099 0.01 . . . . . . A 87 LEU CB . 30210 1 882 . 1 1 87 87 LEU CD1 C 13 25.264 0.01 . . . . . . A 87 LEU CD1 . 30210 1 883 . 1 1 87 87 LEU CD2 C 13 22.849 0.01 . . . . . . A 87 LEU CD2 . 30210 1 884 . 1 1 87 87 LEU N N 15 118.648 0.01 . . . . . . A 87 LEU N . 30210 1 885 . 1 1 88 88 ILE H H 1 7.614 0.01 . . . . . . A 88 ILE H . 30210 1 886 . 1 1 88 88 ILE HA H 1 3.879 0.01 . . . . . . A 88 ILE HA . 30210 1 887 . 1 1 88 88 ILE HB H 1 1.756 0.01 . . . . . . A 88 ILE HB . 30210 1 888 . 1 1 88 88 ILE HG12 H 1 1.365 0.01 . . . . . . A 88 ILE HG12 . 30210 1 889 . 1 1 88 88 ILE HG13 H 1 1.058 0.01 . . . . . . A 88 ILE HG13 . 30210 1 890 . 1 1 88 88 ILE HG21 H 1 0.744 0.01 . . . . . . A 88 ILE HG21 . 30210 1 891 . 1 1 88 88 ILE HG22 H 1 0.744 0.01 . . . . . . A 88 ILE HG22 . 30210 1 892 . 1 1 88 88 ILE HG23 H 1 0.744 0.01 . . . . . . A 88 ILE HG23 . 30210 1 893 . 1 1 88 88 ILE HD11 H 1 0.707 0.01 . . . . . . A 88 ILE HD11 . 30210 1 894 . 1 1 88 88 ILE HD12 H 1 0.707 0.01 . . . . . . A 88 ILE HD12 . 30210 1 895 . 1 1 88 88 ILE HD13 H 1 0.707 0.01 . . . . . . A 88 ILE HD13 . 30210 1 896 . 1 1 88 88 ILE CA C 13 62.050 0.01 . . . . . . A 88 ILE CA . 30210 1 897 . 1 1 88 88 ILE CB C 13 38.495 0.01 . . . . . . A 88 ILE CB . 30210 1 898 . 1 1 88 88 ILE CG1 C 13 27.704 0.01 . . . . . . A 88 ILE CG1 . 30210 1 899 . 1 1 88 88 ILE CG2 C 13 17.518 0.01 . . . . . . A 88 ILE CG2 . 30210 1 900 . 1 1 88 88 ILE CD1 C 13 13.027 0.01 . . . . . . A 88 ILE CD1 . 30210 1 901 . 1 1 88 88 ILE N N 15 119.320 0.01 . . . . . . A 88 ILE N . 30210 1 902 . 1 1 89 89 GLN H H 1 8.062 0.01 . . . . . . A 89 GLN H . 30210 1 903 . 1 1 89 89 GLN HA H 1 4.150 0.01 . . . . . . A 89 GLN HA . 30210 1 904 . 1 1 89 89 GLN HB2 H 1 1.865 0.01 . . . . . . A 89 GLN HB2 . 30210 1 905 . 1 1 89 89 GLN HB3 H 1 1.945 0.01 . . . . . . A 89 GLN HB3 . 30210 1 906 . 1 1 89 89 GLN HG2 H 1 2.241 0.01 . . . . . . A 89 GLN HG2 . 30210 1 907 . 1 1 89 89 GLN CA C 13 55.975 0.01 . . . . . . A 89 GLN CA . 30210 1 908 . 1 1 89 89 GLN CB C 13 29.109 0.01 . . . . . . A 89 GLN CB . 30210 1 909 . 1 1 89 89 GLN CG C 13 33.722 0.01 . . . . . . A 89 GLN CG . 30210 1 910 . 1 1 89 89 GLN N N 15 122.180 0.01 . . . . . . A 89 GLN N . 30210 1 911 . 1 1 90 90 GLN H H 1 8.116 0.01 . . . . . . A 90 GLN H . 30210 1 912 . 1 1 90 90 GLN HA H 1 4.640 0.01 . . . . . . A 90 GLN HA . 30210 1 913 . 1 1 90 90 GLN HB2 H 1 1.916 0.01 . . . . . . A 90 GLN HB2 . 30210 1 914 . 1 1 90 90 GLN HG2 H 1 2.237 0.01 . . . . . . A 90 GLN HG2 . 30210 1 915 . 1 1 90 90 GLN HG3 H 1 1.910 0.01 . . . . . . A 90 GLN HG3 . 30210 1 916 . 1 1 90 90 GLN CA C 13 62.583 0.01 . . . . . . A 90 GLN CA . 30210 1 917 . 1 1 90 90 GLN CG C 13 34.633 0.01 . . . . . . A 90 GLN CG . 30210 1 918 . 1 1 90 90 GLN N N 15 120.869 0.01 . . . . . . A 90 GLN N . 30210 1 919 . 1 1 91 91 LYS H H 1 8.141 0.01 . . . . . . A 91 LYS H . 30210 1 920 . 1 1 91 91 LYS HA H 1 4.204 0.01 . . . . . . A 91 LYS HA . 30210 1 921 . 1 1 91 91 LYS HB2 H 1 1.734 0.01 . . . . . . A 91 LYS HB2 . 30210 1 922 . 1 1 91 91 LYS HB3 H 1 1.613 0.01 . . . . . . A 91 LYS HB3 . 30210 1 923 . 1 1 91 91 LYS HG2 H 1 1.320 0.01 . . . . . . A 91 LYS HG2 . 30210 1 924 . 1 1 91 91 LYS HG3 H 1 1.283 0.01 . . . . . . A 91 LYS HG3 . 30210 1 925 . 1 1 91 91 LYS HD2 H 1 1.540 0.01 . . . . . . A 91 LYS HD2 . 30210 1 926 . 1 1 91 91 LYS HE2 H 1 2.868 0.01 . . . . . . A 91 LYS HE2 . 30210 1 927 . 1 1 91 91 LYS CA C 13 56.203 0.01 . . . . . . A 91 LYS CA . 30210 1 928 . 1 1 91 91 LYS CB C 13 33.134 0.01 . . . . . . A 91 LYS CB . 30210 1 929 . 1 1 91 91 LYS CG C 13 24.703 0.01 . . . . . . A 91 LYS CG . 30210 1 930 . 1 1 91 91 LYS CD C 13 28.943 0.01 . . . . . . A 91 LYS CD . 30210 1 931 . 1 1 91 91 LYS CE C 13 41.929 0.01 . . . . . . A 91 LYS CE . 30210 1 932 . 1 1 91 91 LYS N N 15 122.610 0.01 . . . . . . A 91 LYS N . 30210 1 933 . 1 1 92 92 ASN H H 1 7.951 0.01 . . . . . . A 92 ASN H . 30210 1 934 . 1 1 92 92 ASN HA H 1 4.340 0.01 . . . . . . A 92 ASN HA . 30210 1 935 . 1 1 92 92 ASN HB2 H 1 2.621 0.01 . . . . . . A 92 ASN HB2 . 30210 1 936 . 1 1 92 92 ASN HB3 H 1 2.520 0.01 . . . . . . A 92 ASN HB3 . 30210 1 937 . 1 1 92 92 ASN CA C 13 54.766 0.01 . . . . . . A 92 ASN CA . 30210 1 938 . 1 1 92 92 ASN CB C 13 40.451 0.01 . . . . . . A 92 ASN CB . 30210 1 939 . 1 1 92 92 ASN N N 15 125.402 0.01 . . . . . . A 92 ASN N . 30210 1 stop_ save_