data_7384 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7384 _Entry.Title ; Solution Structure of Human Immunodificiency Virus Type-2 Nucleocapsid Protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-03-21 _Entry.Accession_date 2007-04-20 _Entry.Last_release_date 2008-08-14 _Entry.Original_release_date 2008-08-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.78 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 T. Matsui T. . . 7384 2 Y. Kodera Y. . . 7384 3 T. Tanaka T. . . 7384 4 H. Endoh H. . . 7384 5 H. Tanaka H. . . 7384 6 E. Miyauchi E. . . 7384 7 H. Komatsu H. . . 7384 8 T. Kohno T. . . 7384 9 T. Maeda T. . . 7384 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID HIV-2 HIV-2 7384 'NUCLEOCAPSID PROTEIN' 'NUCLEOCAPSID PROTEIN' 7384 'RNA RECOGNITION' 'RNA RECOGNITION' 7384 'ZINC FINGER' 'ZINC FINGER' 7384 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7384 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 163 7384 '15N chemical shifts' 54 7384 '1H chemical shifts' 300 7384 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2008-08-14 2007-03-21 original author . 7384 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 7384 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17511966 _Citation.Full_citation . _Citation.Title 'Structural role of the secondary active domain of HIV-2 NCp8 in multi-functionality.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochem. Biophys. Res. Commun.' _Citation.Journal_name_full 'Biochemical and Biophysical Research Communications' _Citation.Journal_volume 358 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _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 673 _Citation.Page_last 678 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Takashi Matsui . . . 7384 1 2 Yoshio Kodera . . . 7384 1 3 Emi Miyauchi . . . 7384 1 4 Hidekazu Tanaka . . . 7384 1 5 Hiroshi Endoh . . . 7384 1 6 Hiroyoshi Komatsu . . . 7384 1 7 Takeshi Tanaka . . . 7384 1 8 Toshiyuki Kohno . . . 7384 1 9 Tadakazu Maeda . . . 7384 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7384 _Assembly.ID 1 _Assembly.Name Gag_polyprotein_(Pr55Gag) _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 ; _struct_conn.id _struct_conn.conn_type_id _struct_conn.ndb_PDB_id _struct_conn.ndb_ptnr1_mod_name _struct_conn.ndb_ptnr1_replaced_atom _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.ndb_ptnr1_label_alt_loc _struct_conn.ndb_ptnr1_label_ins_code _struct_conn.ndb_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.ndb_ptnr2_label_alt_loc _struct_conn.ndb_ptnr2_label_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.ndb_ptnr3_label_atom_id _struct_conn.ndb_ptnr3_label_seq_id _struct_conn.ndb_ptnr3_label_comp_id _struct_conn.ndb_ptnr3_label_asym_id _struct_conn.ndb_ptnr3_label_alt_loc _struct_conn.ndb_ptnr3_label_ins_code _struct_conn.details disulf1 disulf ? ? ? A CYS 9 SG ? ? ? 1_555 A CYS 22 SG ? ? A CYS 9 A CYS 22 1_555 ? ? ? ? ? ? ? disulf2 disulf ? ? ? A CYS 12 SG ? ? ? 1_555 A CYS 22 SG ? ? A CYS 12 A CYS 22 1_555 ? ? ? ? ? ? ? disulf3 disulf ? ? ? A CYS 30 SG ? ? ? 1_555 A CYS 33 SG ? ? A CYS 30 A CYS 33 1_555 ? ? ? ? ? ? ? disulf4 disulf ? ? ? A CYS 33 SG ? ? ? 1_555 A CYS 43 SG ? ? A CYS 33 A CYS 43 1_555 ? ? ? ? ? ? ? covale1 covale ? ? ? B ZN . ZN ? ? ? 1_555 A CYS 9 SG ? ? A ZN 50 A CYS 9 1_555 ? ? ? ? ? ? ? covale2 covale ? ? ? B ZN . ZN ? ? ? 1_555 A CYS 12 SG ? ? A ZN 50 A CYS 12 1_555 ? ? ? ? ? ? ? covale3 covale ? ? ? B ZN . ZN ? ? ? 1_555 A HIS 17 NE2 ? ? A ZN 50 A HIS 17 1_555 ? ? ? ? ? ? ? covale4 covale ? ? ? B ZN . ZN ? ? ? 1_555 A CYS 22 SG ? ? A ZN 50 A CYS 22 1_555 ? ? ? ? ? ? ? covale5 covale ? ? ? C ZN . ZN ? ? ? 1_555 A CYS 30 SG ? ? A ZN 51 A CYS 30 1_555 ? ? ? ? ? ? ? covale6 covale ? ? ? C ZN . ZN ? ? ? 1_555 A CYS 33 SG ? ? A ZN 51 A CYS 33 1_555 ? ? ? ? ? ? ? covale7 covale ? ? ? C ZN . ZN ? ? ? 1_555 A HIS 38 NE2 ? ? A ZN 51 A HIS 38 1_555 ? ? ? ? ? ? ? covale8 covale ? ? ? C ZN . ZN ? ? ? 1_555 A CYS 43 SG ? ? A ZN 51 A CYS 43 1_555 ? ? ? ? ? ? ? ; _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 Gag_polyprotein_(Pr55Gag) 1 $Gag_polyprotein_(Pr55Gag) A . yes native no no . . . 7384 1 2 'ZINC 1' 2 $ZN B . no native no no . . . 7384 1 3 'ZINC 2' 2 $ZN C . no native no no . . . 7384 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulphide single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 9 9 SG . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 22 22 SG . Gag_polyprotein_(Pr55Gag) 9 cys SG . Gag_polyprotein_(Pr55Gag) 22 cys SG 7384 1 2 disulphide single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 12 12 SG . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 22 22 SG . Gag_polyprotein_(Pr55Gag) 12 cys SG . Gag_polyprotein_(Pr55Gag) 22 cys SG 7384 1 3 disulphide single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 30 30 SG . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 33 33 SG . Gag_polyprotein_(Pr55Gag) 30 cys SG . Gag_polyprotein_(Pr55Gag) 33 cys SG 7384 1 4 disulphide single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 33 33 SG . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 43 43 SG . Gag_polyprotein_(Pr55Gag) 33 cys SG . Gag_polyprotein_(Pr55Gag) 43 cys SG 7384 1 5 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 9 9 SG . 2 'ZN 1' 2 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 9 CYS SG . 'ZN 1' . . . 7384 1 6 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 12 12 SG . 2 'ZN 1' 2 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 12 CYS SG . 'ZN 1' . . . 7384 1 7 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 HIS 17 17 NE2 . 2 'ZN 1' 2 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 17 HIS NE2 . 'ZN 1' . . . 7384 1 8 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 22 22 SG . 2 'ZN 1' 2 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 22 CYS SG . 'ZN 1' . . . 7384 1 9 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 30 30 SG . 3 'ZN 2' 3 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 30 CYS SG . 'ZN 2' . . . 7384 1 10 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 33 33 SG . 3 'ZN 2' 3 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 33 CYS SG . 'ZN 2' . . . 7384 1 11 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 HIS 38 38 NE2 . 3 'ZN 2' 3 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 38 HIS NE2 . 'ZN 2' . . . 7384 1 12 coordination single . 1 Gag_polyprotein_(Pr55Gag) 1 CYS 43 43 SG . 3 'ZN 2' 3 ZN 1 1 ZN . Gag_polyprotein_(Pr55Gag) 43 CYS SG . 'ZN 2' . . . 7384 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Gag_polyprotein_(Pr55Gag) _Entity.Sf_category entity _Entity.Sf_framecode Gag_polyprotein_(Pr55Gag) _Entity.Entry_ID 7384 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Gag_polyprotein_(Pr55Gag) _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 ; AQQRKVIRCWNCGKEGHSAR QCRAPRRQGCWKCGKTGHVM AKCPERQAG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers 49 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'CCHC-type 1, CCHC-type 2' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 3D-structure SWS-KEYWORD 7384 1 AIDS SWS-KEYWORD 7384 1 'Capsid protein' SWS-KEYWORD 7384 1 'Gag polyprotein (Pr55Gag) [Contains: Matrix protein p17 (MA); Capsid protein p24 (CA); Spacer peptide p2; Nucleocapsid protein p7 (NC); Spacer peptide p1; p6-gag]' RCSB_NAME 7384 1 'Host-virus interaction' SWS-KEYWORD 7384 1 Lipoprotein SWS-KEYWORD 7384 1 Membrane SWS-KEYWORD 7384 1 Metal-binding SWS-KEYWORD 7384 1 Myristate SWS-KEYWORD 7384 1 'Nucleocapsid Protein (NCp8)' . 7384 1 Repeat SWS-KEYWORD 7384 1 RNA-binding SWS-KEYWORD 7384 1 'Viral nucleoprotein' SWS-KEYWORD 7384 1 'Virion protein' SWS-KEYWORD 7384 1 Zinc SWS-KEYWORD 7384 1 Zinc-finger SWS-KEYWORD 7384 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 . ALA . 7384 1 2 . GLN . 7384 1 3 . GLN . 7384 1 4 . ARG . 7384 1 5 . LYS . 7384 1 6 . VAL . 7384 1 7 . ILE . 7384 1 8 . ARG . 7384 1 9 . CYS . 7384 1 10 . TRP . 7384 1 11 . ASN . 7384 1 12 . CYS . 7384 1 13 . GLY . 7384 1 14 . LYS . 7384 1 15 . GLU . 7384 1 16 . GLY . 7384 1 17 . HIS . 7384 1 18 . SER . 7384 1 19 . ALA . 7384 1 20 . ARG . 7384 1 21 . GLN . 7384 1 22 . CYS . 7384 1 23 . ARG . 7384 1 24 . ALA . 7384 1 25 . PRO . 7384 1 26 . ARG . 7384 1 27 . ARG . 7384 1 28 . GLN . 7384 1 29 . GLY . 7384 1 30 . CYS . 7384 1 31 . TRP . 7384 1 32 . LYS . 7384 1 33 . CYS . 7384 1 34 . GLY . 7384 1 35 . LYS . 7384 1 36 . THR . 7384 1 37 . GLY . 7384 1 38 . HIS . 7384 1 39 . VAL . 7384 1 40 . MET . 7384 1 41 . ALA . 7384 1 42 . LYS . 7384 1 43 . CYS . 7384 1 44 . PRO . 7384 1 45 . GLU . 7384 1 46 . ARG . 7384 1 47 . GLN . 7384 1 48 . ALA . 7384 1 49 . GLY . 7384 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 . ALA 1 1 7384 1 . GLN 2 2 7384 1 . GLN 3 3 7384 1 . ARG 4 4 7384 1 . LYS 5 5 7384 1 . VAL 6 6 7384 1 . ILE 7 7 7384 1 . ARG 8 8 7384 1 . CYS 9 9 7384 1 . TRP 10 10 7384 1 . ASN 11 11 7384 1 . CYS 12 12 7384 1 . GLY 13 13 7384 1 . LYS 14 14 7384 1 . GLU 15 15 7384 1 . GLY 16 16 7384 1 . HIS 17 17 7384 1 . SER 18 18 7384 1 . ALA 19 19 7384 1 . ARG 20 20 7384 1 . GLN 21 21 7384 1 . CYS 22 22 7384 1 . ARG 23 23 7384 1 . ALA 24 24 7384 1 . PRO 25 25 7384 1 . ARG 26 26 7384 1 . ARG 27 27 7384 1 . GLN 28 28 7384 1 . GLY 29 29 7384 1 . CYS 30 30 7384 1 . TRP 31 31 7384 1 . LYS 32 32 7384 1 . CYS 33 33 7384 1 . GLY 34 34 7384 1 . LYS 35 35 7384 1 . THR 36 36 7384 1 . GLY 37 37 7384 1 . HIS 38 38 7384 1 . VAL 39 39 7384 1 . MET 40 40 7384 1 . ALA 41 41 7384 1 . LYS 42 42 7384 1 . CYS 43 43 7384 1 . PRO 44 44 7384 1 . GLU 45 45 7384 1 . ARG 46 46 7384 1 . GLN 47 47 7384 1 . ALA 48 48 7384 1 . GLY 49 49 7384 1 stop_ save_ save_ZN _Entity.Sf_category entity _Entity.Sf_framecode ZN _Entity.Entry_ID 7384 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name ZN _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 no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ZN . 7384 2 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 7384 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Gag_polyprotein_(Pr55Gag) . 11709 organism . 'Human immunodeficiency virus type 2' HIV-2 . . Viruses . Lentivirus 'Human immunodeficiency virus 2' 'isolate Ghana-1 subtype A' . . . . . . . . . . . . . . . . . . . . 7384 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 7384 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Gag_polyprotein_(Pr55Gag) . 'recombinant technology' . bacteria . . . . 'BL21 (DE3)' . . . . . . . . . . . . . . . . . . . . . . 7384 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 7384 _Chem_comp.ID ZN _Chem_comp.Provenance . _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _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 . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _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 ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Oct 7 14:15:35 2011 ; _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 7384 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 7384 ZN [Zn++] SMILES CACTVS 3.341 7384 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 7384 ZN [Zn+2] SMILES ACDLabs 10.04 7384 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 7384 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 7384 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 7384 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 7384 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 . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 7384 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7384 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5mM 13C,15N-labeled Protein; 3.2mM ZnCl2; 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 Gag_polyprotein_(Pr55Gag) '[U-13C; U-15N]' . . 1 $Gag_polyprotein_(Pr55Gag) . . 1.5 . . mM . . . . 7384 1 2 ZnCl2 . . . . . . . 3.2 . . mM . . . . 7384 1 3 H2O . . . . . . . 90 . . % . . . . 7384 1 4 D2O . . . . . . . 10 . . % . . . . 7384 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 7384 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5mM 13C,15N-labeled Protein; 3.2mM ZnCl2; 90% H2O, 10%D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '99.96% 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 Gag_polyprotein_(Pr55Gag) '[U-13C; U-15N]' . . 1 $Gag_polyprotein_(Pr55Gag) . . 1.5 . . mM . . . . 7384 2 2 ZnCl2 . . . . . . . 3.2 . . mM . . . . 7384 2 3 D2O . . . . . . . 99.96 . . % . . . . 7384 2 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 7384 _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' . . . 7384 1 pH 5.8 . pH 7384 1 pressure 1 . atm 7384 1 temperature 288 . K 7384 1 stop_ save_ ############################ # Computer software used # ############################ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 7384 _Software.ID 1 _Software.Name ANSIG _Software.Version 3.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kraulis, P.J.' . . 7384 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 7384 1 stop_ save_ save_AZARA _Software.Sf_category software _Software.Sf_framecode AZARA _Software.Entry_ID 7384 _Software.ID 2 _Software.Name AZARA _Software.Version 2.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Boucher, W.' . . 7384 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 7384 2 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 7384 _Software.ID 3 _Software.Name 'X-PLOR NIH' _Software.Version 2.9.9 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'PARDI, A.' . . 7384 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 7384 3 stop_ save_ save_X-PLOR_NIH2 _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH2 _Software.Entry_ID 7384 _Software.ID 4 _Software.Name 'X-PLOR NIH' _Software.Version 2.9.9 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'PARDI, A.' . . 7384 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7384 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 7384 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_500 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode 500 _NMR_spectrometer_list.Entry_ID 7384 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DMX . 500 . . . 7384 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 7384 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 3D_13C-separated_NOESY no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7384 1 2 3D_15N-separated_NOESY no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7384 1 3 '2D NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7384 1 4 HNHA no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7384 1 5 '2D TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7384 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 7384 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . 1 $citations . . 1 $citations 7384 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $citations . . 1 $citations 7384 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . 1 $citations . . 1 $citations 7384 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7384 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 3D_13C-separated_NOESY . . . 7384 1 2 3D_15N-separated_NOESY . . . 7384 1 3 '2D NOESY' . . . 7384 1 4 HNHA . . . 7384 1 5 '2D TOCSY' . . . 7384 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HA H 1 4.1 0.05 . 1 . . . . 1 ALA HA . 7384 1 2 . 1 1 1 1 ALA HB1 H 1 1.5 0.05 . 1 . . . . 1 ALA HB . 7384 1 3 . 1 1 1 1 ALA HB2 H 1 1.5 0.05 . 1 . . . . 1 ALA HB . 7384 1 4 . 1 1 1 1 ALA HB3 H 1 1.5 0.05 . 1 . . . . 1 ALA HB . 7384 1 5 . 1 1 1 1 ALA CA C 13 51.7 0.5 . 1 . . . . 1 ALA CA . 7384 1 6 . 1 1 1 1 ALA CB C 13 19.4 0.5 . 1 . . . . 1 ALA CB . 7384 1 7 . 1 1 2 2 GLN H H 1 8.76 0.05 . 1 . . . . 2 GLN H . 7384 1 8 . 1 1 2 2 GLN N N 15 120.1 0.2 . 1 . . . . 2 GLN N . 7384 1 9 . 1 1 3 3 GLN H H 1 8.72 0.05 . 1 . . . . 3 GLN H . 7384 1 10 . 1 1 3 3 GLN HA H 1 4.33 0.05 . 1 . . . . 3 GLN HA . 7384 1 11 . 1 1 3 3 GLN HB2 H 1 1.97 0.05 . 2 . . . . 3 GLN HB2 . 7384 1 12 . 1 1 3 3 GLN HB3 H 1 2.05 0.05 . 2 . . . . 3 GLN HB3 . 7384 1 13 . 1 1 3 3 GLN HE21 H 1 6.95 0.05 . 2 . . . . 3 GLN HE21 . 7384 1 14 . 1 1 3 3 GLN HE22 H 1 6.95 0.05 . 2 . . . . 3 GLN HE22 . 7384 1 15 . 1 1 3 3 GLN HG2 H 1 2.36 0.05 . 2 . . . . 3 GLN HG2 . 7384 1 16 . 1 1 3 3 GLN HG3 H 1 2.36 0.05 . 2 . . . . 3 GLN HG3 . 7384 1 17 . 1 1 3 3 GLN CA C 13 55.7 0.5 . 1 . . . . 3 GLN CA . 7384 1 18 . 1 1 3 3 GLN N N 15 123.4 0.2 . 1 . . . . 3 GLN N . 7384 1 19 . 1 1 3 3 GLN NE2 N 15 112.8 0.2 . 1 . . . . 3 GLN NE2 . 7384 1 20 . 1 1 4 4 ARG H H 1 8.58 0.05 . 1 . . . . 4 ARG H . 7384 1 21 . 1 1 4 4 ARG HA H 1 4.28 0.05 . 1 . . . . 4 ARG HA . 7384 1 22 . 1 1 4 4 ARG HB2 H 1 1.75 0.05 . 2 . . . . 4 ARG HB2 . 7384 1 23 . 1 1 4 4 ARG HB3 H 1 1.75 0.05 . 2 . . . . 4 ARG HB3 . 7384 1 24 . 1 1 4 4 ARG HD2 H 1 3.17 0.05 . 2 . . . . 4 ARG HD2 . 7384 1 25 . 1 1 4 4 ARG HD3 H 1 3.17 0.05 . 2 . . . . 4 ARG HD3 . 7384 1 26 . 1 1 4 4 ARG HG2 H 1 1.59 0.05 . 2 . . . . 4 ARG HG2 . 7384 1 27 . 1 1 4 4 ARG HG3 H 1 1.59 0.05 . 2 . . . . 4 ARG HG3 . 7384 1 28 . 1 1 4 4 ARG CA C 13 56.2 0.5 . 1 . . . . 4 ARG CA . 7384 1 29 . 1 1 4 4 ARG CB C 13 30.9 0.5 . 1 . . . . 4 ARG CB . 7384 1 30 . 1 1 4 4 ARG CD C 13 43.3 0.5 . 1 . . . . 4 ARG CD . 7384 1 31 . 1 1 4 4 ARG N N 15 123.8 0.2 . 1 . . . . 4 ARG N . 7384 1 32 . 1 1 5 5 LYS H H 1 8.53 0.05 . 1 . . . . 5 LYS H . 7384 1 33 . 1 1 5 5 LYS HA H 1 4.31 0.05 . 1 . . . . 5 LYS HA . 7384 1 34 . 1 1 5 5 LYS HB2 H 1 1.73 0.05 . 2 . . . . 5 LYS HB2 . 7384 1 35 . 1 1 5 5 LYS HB3 H 1 1.73 0.05 . 2 . . . . 5 LYS HB3 . 7384 1 36 . 1 1 5 5 LYS HD2 H 1 1.68 0.05 . 2 . . . . 5 LYS HD2 . 7384 1 37 . 1 1 5 5 LYS HD3 H 1 1.68 0.05 . 2 . . . . 5 LYS HD3 . 7384 1 38 . 1 1 5 5 LYS HE2 H 1 2.97 0.05 . 2 . . . . 5 LYS HE2 . 7384 1 39 . 1 1 5 5 LYS HE3 H 1 2.97 0.05 . 2 . . . . 5 LYS HE3 . 7384 1 40 . 1 1 5 5 LYS HG2 H 1 1.35 0.05 . 2 . . . . 5 LYS HG2 . 7384 1 41 . 1 1 5 5 LYS HG3 H 1 1.42 0.05 . 2 . . . . 5 LYS HG3 . 7384 1 42 . 1 1 5 5 LYS C C 13 176.3 0.5 . 1 . . . . 5 LYS C . 7384 1 43 . 1 1 5 5 LYS CA C 13 56.2 0.5 . 1 . . . . 5 LYS CA . 7384 1 44 . 1 1 5 5 LYS CB C 13 33 0.5 . 1 . . . . 5 LYS CB . 7384 1 45 . 1 1 5 5 LYS CD C 13 29 0.5 . 1 . . . . 5 LYS CD . 7384 1 46 . 1 1 5 5 LYS CE C 13 42.2 0.5 . 1 . . . . 5 LYS CE . 7384 1 47 . 1 1 5 5 LYS CG C 13 24.8 0.5 . 1 . . . . 5 LYS CG . 7384 1 48 . 1 1 5 5 LYS N N 15 124.4 0.2 . 1 . . . . 5 LYS N . 7384 1 49 . 1 1 6 6 VAL H H 1 8.34 0.05 . 1 . . . . 6 VAL H . 7384 1 50 . 1 1 6 6 VAL HA H 1 4.09 0.05 . 1 . . . . 6 VAL HA . 7384 1 51 . 1 1 6 6 VAL HB H 1 1.91 0.05 . 1 . . . . 6 VAL HB . 7384 1 52 . 1 1 6 6 VAL HG11 H 1 0.82 0.05 . 2 . . . . 6 VAL HG1 . 7384 1 53 . 1 1 6 6 VAL HG12 H 1 0.82 0.05 . 2 . . . . 6 VAL HG1 . 7384 1 54 . 1 1 6 6 VAL HG13 H 1 0.82 0.05 . 2 . . . . 6 VAL HG1 . 7384 1 55 . 1 1 6 6 VAL HG21 H 1 0.88 0.05 . 2 . . . . 6 VAL HG2 . 7384 1 56 . 1 1 6 6 VAL HG22 H 1 0.88 0.05 . 2 . . . . 6 VAL HG2 . 7384 1 57 . 1 1 6 6 VAL HG23 H 1 0.88 0.05 . 2 . . . . 6 VAL HG2 . 7384 1 58 . 1 1 6 6 VAL C C 13 175.8 0.5 . 1 . . . . 6 VAL C . 7384 1 59 . 1 1 6 6 VAL CA C 13 62 0.5 . 1 . . . . 6 VAL CA . 7384 1 60 . 1 1 6 6 VAL CB C 13 33 0.5 . 1 . . . . 6 VAL CB . 7384 1 61 . 1 1 6 6 VAL CG1 C 13 20.9 0.5 . 2 . . . . 6 VAL CG1 . 7384 1 62 . 1 1 6 6 VAL CG2 C 13 20.9 0.5 . 2 . . . . 6 VAL CG2 . 7384 1 63 . 1 1 6 6 VAL N N 15 124 0.2 . 1 . . . . 6 VAL N . 7384 1 64 . 1 1 7 7 ILE H H 1 8.63 0.05 . 1 . . . . 7 ILE H . 7384 1 65 . 1 1 7 7 ILE HA H 1 4.09 0.05 . 1 . . . . 7 ILE HA . 7384 1 66 . 1 1 7 7 ILE HB H 1 1.62 0.05 . 1 . . . . 7 ILE HB . 7384 1 67 . 1 1 7 7 ILE HD11 H 1 0.77 0.05 . 1 . . . . 7 ILE HD1 . 7384 1 68 . 1 1 7 7 ILE HD12 H 1 0.77 0.05 . 1 . . . . 7 ILE HD1 . 7384 1 69 . 1 1 7 7 ILE HD13 H 1 0.77 0.05 . 1 . . . . 7 ILE HD1 . 7384 1 70 . 1 1 7 7 ILE HG12 H 1 1.07 0.05 . 2 . . . . 7 ILE HG12 . 7384 1 71 . 1 1 7 7 ILE HG13 H 1 0.67 0.05 . 2 . . . . 7 ILE HG13 . 7384 1 72 . 1 1 7 7 ILE HG21 H 1 1.34 0.05 . 1 . . . . 7 ILE HG2 . 7384 1 73 . 1 1 7 7 ILE HG22 H 1 1.34 0.05 . 1 . . . . 7 ILE HG2 . 7384 1 74 . 1 1 7 7 ILE HG23 H 1 1.34 0.05 . 1 . . . . 7 ILE HG2 . 7384 1 75 . 1 1 7 7 ILE C C 13 174.3 0.5 . 1 . . . . 7 ILE C . 7384 1 76 . 1 1 7 7 ILE CA C 13 60.5 0.5 . 1 . . . . 7 ILE CA . 7384 1 77 . 1 1 7 7 ILE CB C 13 38.8 0.5 . 1 . . . . 7 ILE CB . 7384 1 78 . 1 1 7 7 ILE CD1 C 13 12.9 0.5 . 1 . . . . 7 ILE CD1 . 7384 1 79 . 1 1 7 7 ILE CG1 C 13 27.2 0.5 . 1 . . . . 7 ILE CG1 . 7384 1 80 . 1 1 7 7 ILE CG2 C 13 16.8 0.5 . 1 . . . . 7 ILE CG2 . 7384 1 81 . 1 1 7 7 ILE N N 15 127.8 0.2 . 1 . . . . 7 ILE N . 7384 1 82 . 1 1 8 8 ARG H H 1 8.32 0.05 . 1 . . . . 8 ARG H . 7384 1 83 . 1 1 8 8 ARG HA H 1 4.5 0.05 . 1 . . . . 8 ARG HA . 7384 1 84 . 1 1 8 8 ARG HB2 H 1 1.43 0.05 . 2 . . . . 8 ARG HB2 . 7384 1 85 . 1 1 8 8 ARG HB3 H 1 1.43 0.05 . 2 . . . . 8 ARG HB3 . 7384 1 86 . 1 1 8 8 ARG HD2 H 1 2.96 0.05 . 2 . . . . 8 ARG HD2 . 7384 1 87 . 1 1 8 8 ARG HD3 H 1 3.01 0.05 . 2 . . . . 8 ARG HD3 . 7384 1 88 . 1 1 8 8 ARG HE H 1 7.18 0.2 . 1 . . . . 8 ARG HE . 7384 1 89 . 1 1 8 8 ARG HG2 H 1 1.15 0.05 . 2 . . . . 8 ARG HG2 . 7384 1 90 . 1 1 8 8 ARG HG3 H 1 1.15 0.05 . 2 . . . . 8 ARG HG3 . 7384 1 91 . 1 1 8 8 ARG C C 13 174.7 0.5 . 1 . . . . 8 ARG C . 7384 1 92 . 1 1 8 8 ARG CA C 13 54.4 0.5 . 1 . . . . 8 ARG CA . 7384 1 93 . 1 1 8 8 ARG CB C 13 32.8 0.5 . 1 . . . . 8 ARG CB . 7384 1 94 . 1 1 8 8 ARG CD C 13 42.9 0.5 . 1 . . . . 8 ARG CD . 7384 1 95 . 1 1 8 8 ARG CG C 13 27.5 0.5 . 1 . . . . 8 ARG CG . 7384 1 96 . 1 1 8 8 ARG N N 15 125.7 0.2 . 1 . . . . 8 ARG N . 7384 1 97 . 1 1 9 9 CYS H H 1 8.35 0.05 . 1 . . . . 9 CYS H . 7384 1 98 . 1 1 9 9 CYS HA H 1 4.07 0.05 . 1 . . . . 9 CYS HA . 7384 1 99 . 1 1 9 9 CYS HB2 H 1 1.82 0.05 . 1 . . . . 9 CYS HB2 . 7384 1 100 . 1 1 9 9 CYS HB3 H 1 2.74 0.05 . 1 . . . . 9 CYS HB3 . 7384 1 101 . 1 1 9 9 CYS C C 13 178.6 0.5 . 1 . . . . 9 CYS C . 7384 1 102 . 1 1 9 9 CYS CA C 13 59.6 0.5 . 1 . . . . 9 CYS CA . 7384 1 103 . 1 1 9 9 CYS CB C 13 30.1 0.5 . 1 . . . . 9 CYS CB . 7384 1 104 . 1 1 9 9 CYS N N 15 129.3 0.2 . 1 . . . . 9 CYS N . 7384 1 105 . 1 1 10 10 TRP H H 1 8.64 0.05 . 1 . . . . 10 TRP H . 7384 1 106 . 1 1 10 10 TRP HA H 1 4.47 0.05 . 1 . . . . 10 TRP HA . 7384 1 107 . 1 1 10 10 TRP HB2 H 1 3.28 0.05 . 2 . . . . 10 TRP HB2 . 7384 1 108 . 1 1 10 10 TRP HB3 H 1 3.38 0.05 . 2 . . . . 10 TRP HB3 . 7384 1 109 . 1 1 10 10 TRP HD1 H 1 7.26 0.05 . 1 . . . . 10 TRP HD1 . 7384 1 110 . 1 1 10 10 TRP HE1 H 1 10.01 0.05 . 1 . . . . 10 TRP HE1 . 7384 1 111 . 1 1 10 10 TRP C C 13 176.9 0.5 . 1 . . . . 10 TRP C . 7384 1 112 . 1 1 10 10 TRP CA C 13 59.2 0.5 . 1 . . . . 10 TRP CA . 7384 1 113 . 1 1 10 10 TRP CB C 13 29.8 0.5 . 1 . . . . 10 TRP CB . 7384 1 114 . 1 1 10 10 TRP N N 15 129.3 0.2 . 1 . . . . 10 TRP N . 7384 1 115 . 1 1 10 10 TRP NE1 N 15 129.4 0.2 . 1 . . . . 10 TRP NE1 . 7384 1 116 . 1 1 11 11 ASN H H 1 9.31 0.05 . 1 . . . . 11 ASN H . 7384 1 117 . 1 1 11 11 ASN HA H 1 4.4 0.05 . 1 . . . . 11 ASN HA . 7384 1 118 . 1 1 11 11 ASN HB2 H 1 2.16 0.05 . 2 . . . . 11 ASN HB2 . 7384 1 119 . 1 1 11 11 ASN HB3 H 1 3.06 0.05 . 2 . . . . 11 ASN HB3 . 7384 1 120 . 1 1 11 11 ASN HD21 H 1 6.73 0.05 . 2 . . . . 11 ASN HD21 . 7384 1 121 . 1 1 11 11 ASN HD22 H 1 8.45 0.05 . 2 . . . . 11 ASN HD22 . 7384 1 122 . 1 1 11 11 ASN C C 13 175.9 0.5 . 1 . . . . 11 ASN C . 7384 1 123 . 1 1 11 11 ASN CA C 13 57.3 0.5 . 1 . . . . 11 ASN CA . 7384 1 124 . 1 1 11 11 ASN CB C 13 39.9 0.5 . 1 . . . . 11 ASN CB . 7384 1 125 . 1 1 11 11 ASN N N 15 121.4 0.2 . 1 . . . . 11 ASN N . 7384 1 126 . 1 1 11 11 ASN ND2 N 15 118 0.2 . 1 . . . . 11 ASN ND2 . 7384 1 127 . 1 1 12 12 CYS H H 1 8.92 0.05 . 1 . . . . 12 CYS H . 7384 1 128 . 1 1 12 12 CYS HA H 1 4.92 0.05 . 1 . . . . 12 CYS HA . 7384 1 129 . 1 1 12 12 CYS HB2 H 1 2.45 0.05 . 1 . . . . 12 CYS HB2 . 7384 1 130 . 1 1 12 12 CYS HB3 H 1 3.25 0.05 . 1 . . . . 12 CYS HB3 . 7384 1 131 . 1 1 12 12 CYS C C 13 176.6 0.5 . 1 . . . . 12 CYS C . 7384 1 132 . 1 1 12 12 CYS CA C 13 58.6 0.5 . 1 . . . . 12 CYS CA . 7384 1 133 . 1 1 12 12 CYS CB C 13 32.3 0.5 . 1 . . . . 12 CYS CB . 7384 1 134 . 1 1 12 12 CYS N N 15 117.4 0.2 . 1 . . . . 12 CYS N . 7384 1 135 . 1 1 13 13 GLY H H 1 7.91 0.05 . 1 . . . . 13 GLY H . 7384 1 136 . 1 1 13 13 GLY HA2 H 1 3.67 0.05 . 2 . . . . 13 GLY HA2 . 7384 1 137 . 1 1 13 13 GLY HA3 H 1 3.96 0.05 . 2 . . . . 13 GLY HA3 . 7384 1 138 . 1 1 13 13 GLY C C 13 174.1 0.5 . 1 . . . . 13 GLY C . 7384 1 139 . 1 1 13 13 GLY CA C 13 46.1 0.5 . 1 . . . . 13 GLY CA . 7384 1 140 . 1 1 13 13 GLY N N 15 113.8 0.2 . 1 . . . . 13 GLY N . 7384 1 141 . 1 1 14 14 LYS H H 1 8.16 0.05 . 1 . . . . 14 LYS H . 7384 1 142 . 1 1 14 14 LYS HA H 1 4.39 0.05 . 1 . . . . 14 LYS HA . 7384 1 143 . 1 1 14 14 LYS HB2 H 1 1.78 0.05 . 2 . . . . 14 LYS HB2 . 7384 1 144 . 1 1 14 14 LYS HB3 H 1 1.89 0.05 . 2 . . . . 14 LYS HB3 . 7384 1 145 . 1 1 14 14 LYS HD2 H 1 1.74 0.05 . 2 . . . . 14 LYS HD2 . 7384 1 146 . 1 1 14 14 LYS HD3 H 1 1.74 0.05 . 2 . . . . 14 LYS HD3 . 7384 1 147 . 1 1 14 14 LYS HE2 H 1 3.02 0.05 . 2 . . . . 14 LYS HE2 . 7384 1 148 . 1 1 14 14 LYS HE3 H 1 3.02 0.05 . 2 . . . . 14 LYS HE3 . 7384 1 149 . 1 1 14 14 LYS HG2 H 1 1.45 0.05 . 2 . . . . 14 LYS HG2 . 7384 1 150 . 1 1 14 14 LYS HG3 H 1 1.6 0.05 . 2 . . . . 14 LYS HG3 . 7384 1 151 . 1 1 14 14 LYS C C 13 175.9 0.5 . 1 . . . . 14 LYS C . 7384 1 152 . 1 1 14 14 LYS CA C 13 56.2 0.5 . 1 . . . . 14 LYS CA . 7384 1 153 . 1 1 14 14 LYS CB C 13 33.8 0.5 . 1 . . . . 14 LYS CB . 7384 1 154 . 1 1 14 14 LYS CD C 13 28.9 0.5 . 1 . . . . 14 LYS CD . 7384 1 155 . 1 1 14 14 LYS CE C 13 42.5 0.5 . 1 . . . . 14 LYS CE . 7384 1 156 . 1 1 14 14 LYS CG C 13 25.9 0.5 . 1 . . . . 14 LYS CG . 7384 1 157 . 1 1 14 14 LYS N N 15 121.6 0.2 . 1 . . . . 14 LYS N . 7384 1 158 . 1 1 15 15 GLU H H 1 8.5 0.05 . 1 . . . . 15 GLU H . 7384 1 159 . 1 1 15 15 GLU HA H 1 4.61 0.05 . 1 . . . . 15 GLU HA . 7384 1 160 . 1 1 15 15 GLU HB2 H 1 1.9 0.05 . 2 . . . . 15 GLU HB2 . 7384 1 161 . 1 1 15 15 GLU HB3 H 1 1.9 0.05 . 2 . . . . 15 GLU HB3 . 7384 1 162 . 1 1 15 15 GLU HG2 H 1 2.07 0.05 . 2 . . . . 15 GLU HG2 . 7384 1 163 . 1 1 15 15 GLU HG3 H 1 2.29 0.05 . 2 . . . . 15 GLU HG3 . 7384 1 164 . 1 1 15 15 GLU C C 13 178.9 0.5 . 1 . . . . 15 GLU C . 7384 1 165 . 1 1 15 15 GLU CA C 13 56.1 0.5 . 1 . . . . 15 GLU CA . 7384 1 166 . 1 1 15 15 GLU CB C 13 30.9 0.5 . 1 . . . . 15 GLU CB . 7384 1 167 . 1 1 15 15 GLU CG C 13 36.9 0.5 . 1 . . . . 15 GLU CG . 7384 1 168 . 1 1 15 15 GLU N N 15 118.4 0.2 . 1 . . . . 15 GLU N . 7384 1 169 . 1 1 16 16 GLY H H 1 8.8 0.05 . 1 . . . . 16 GLY H . 7384 1 170 . 1 1 16 16 GLY HA2 H 1 3.69 0.05 . 2 . . . . 16 GLY HA2 . 7384 1 171 . 1 1 16 16 GLY HA3 H 1 4.48 0.05 . 2 . . . . 16 GLY HA3 . 7384 1 172 . 1 1 16 16 GLY C C 13 173.9 0.5 . 1 . . . . 16 GLY C . 7384 1 173 . 1 1 16 16 GLY CA C 13 45.7 0.5 . 1 . . . . 16 GLY CA . 7384 1 174 . 1 1 16 16 GLY N N 15 107.7 0.2 . 1 . . . . 16 GLY N . 7384 1 175 . 1 1 17 17 HIS H H 1 7.15 0.05 . 1 . . . . 17 HIS H . 7384 1 176 . 1 1 17 17 HIS HA H 1 4.7 0.05 . 1 . . . . 17 HIS HA . 7384 1 177 . 1 1 17 17 HIS HB2 H 1 3.14 0.05 . 2 . . . . 17 HIS HB2 . 7384 1 178 . 1 1 17 17 HIS HB3 H 1 3.14 0.05 . 2 . . . . 17 HIS HB3 . 7384 1 179 . 1 1 17 17 HIS HD2 H 1 7.05 0.05 . 1 . . . . 17 HIS HD2 . 7384 1 180 . 1 1 17 17 HIS C C 13 170.7 0.5 . 1 . . . . 17 HIS C . 7384 1 181 . 1 1 17 17 HIS CA C 13 55.4 0.5 . 1 . . . . 17 HIS CA . 7384 1 182 . 1 1 17 17 HIS CB C 13 30 0.5 . 1 . . . . 17 HIS CB . 7384 1 183 . 1 1 17 17 HIS N N 15 113.9 0.2 . 1 . . . . 17 HIS N . 7384 1 184 . 1 1 18 18 SER H H 1 8.46 0.05 . 1 . . . . 18 SER H . 7384 1 185 . 1 1 18 18 SER HA H 1 4.79 0.05 . 1 . . . . 18 SER HA . 7384 1 186 . 1 1 18 18 SER HB2 H 1 3.84 0.05 . 1 . . . . 18 SER HB2 . 7384 1 187 . 1 1 18 18 SER HB3 H 1 4.14 0.05 . 1 . . . . 18 SER HB3 . 7384 1 188 . 1 1 18 18 SER C C 13 176.4 0.5 . 1 . . . . 18 SER C . 7384 1 189 . 1 1 18 18 SER CA C 13 55.9 0.5 . 1 . . . . 18 SER CA . 7384 1 190 . 1 1 18 18 SER CB C 13 66.5 0.5 . 1 . . . . 18 SER CB . 7384 1 191 . 1 1 18 18 SER N N 15 112.1 0.2 . 1 . . . . 18 SER N . 7384 1 192 . 1 1 19 19 ALA H H 1 9.03 0.05 . 1 . . . . 19 ALA H . 7384 1 193 . 1 1 19 19 ALA HA H 1 4.69 0.05 . 1 . . . . 19 ALA HA . 7384 1 194 . 1 1 19 19 ALA HB1 H 1 1.22 0.05 . 1 . . . . 19 ALA HB . 7384 1 195 . 1 1 19 19 ALA HB2 H 1 1.22 0.05 . 1 . . . . 19 ALA HB . 7384 1 196 . 1 1 19 19 ALA HB3 H 1 1.22 0.05 . 1 . . . . 19 ALA HB . 7384 1 197 . 1 1 19 19 ALA C C 13 180.6 0.5 . 1 . . . . 19 ALA C . 7384 1 198 . 1 1 19 19 ALA CA C 13 56.2 0.5 . 1 . . . . 19 ALA CA . 7384 1 199 . 1 1 19 19 ALA CB C 13 18.4 0.5 . 1 . . . . 19 ALA CB . 7384 1 200 . 1 1 19 19 ALA N N 15 124.5 0.2 . 1 . . . . 19 ALA N . 7384 1 201 . 1 1 20 20 ARG H H 1 8.27 0.05 . 1 . . . . 20 ARG H . 7384 1 202 . 1 1 20 20 ARG HA H 1 4.09 0.05 . 1 . . . . 20 ARG HA . 7384 1 203 . 1 1 20 20 ARG HB2 H 1 1.82 0.05 . 2 . . . . 20 ARG HB2 . 7384 1 204 . 1 1 20 20 ARG HB3 H 1 1.82 0.05 . 2 . . . . 20 ARG HB3 . 7384 1 205 . 1 1 20 20 ARG HD2 H 1 3.21 0.05 . 2 . . . . 20 ARG HD2 . 7384 1 206 . 1 1 20 20 ARG HD3 H 1 3.21 0.05 . 2 . . . . 20 ARG HD3 . 7384 1 207 . 1 1 20 20 ARG HG2 H 1 1.66 0.05 . 2 . . . . 20 ARG HG2 . 7384 1 208 . 1 1 20 20 ARG HG3 H 1 1.66 0.05 . 2 . . . . 20 ARG HG3 . 7384 1 209 . 1 1 20 20 ARG C C 13 177.5 0.5 . 1 . . . . 20 ARG C . 7384 1 210 . 1 1 20 20 ARG CA C 13 58.5 0.5 . 1 . . . . 20 ARG CA . 7384 1 211 . 1 1 20 20 ARG CB C 13 29.9 0.5 . 1 . . . . 20 ARG CB . 7384 1 212 . 1 1 20 20 ARG CD C 13 43.2 0.5 . 1 . . . . 20 ARG CD . 7384 1 213 . 1 1 20 20 ARG CG C 13 27.3 0.5 . 1 . . . . 20 ARG CG . 7384 1 214 . 1 1 20 20 ARG N N 15 116.7 0.2 . 1 . . . . 20 ARG N . 7384 1 215 . 1 1 21 21 GLN H H 1 7.81 0.05 . 1 . . . . 21 GLN H . 7384 1 216 . 1 1 21 21 GLN HA H 1 4.37 0.05 . 1 . . . . 21 GLN HA . 7384 1 217 . 1 1 21 21 GLN HB2 H 1 2.24 0.05 . 2 . . . . 21 GLN HB2 . 7384 1 218 . 1 1 21 21 GLN HB3 H 1 2.24 0.05 . 2 . . . . 21 GLN HB3 . 7384 1 219 . 1 1 21 21 GLN HE21 H 1 6.94 0.05 . 2 . . . . 21 GLN HE21 . 7384 1 220 . 1 1 21 21 GLN HE22 H 1 7.67 0.05 . 2 . . . . 21 GLN HE22 . 7384 1 221 . 1 1 21 21 GLN HG2 H 1 2.25 0.05 . 2 . . . . 21 GLN HG2 . 7384 1 222 . 1 1 21 21 GLN HG3 H 1 2.4 0.05 . 2 . . . . 21 GLN HG3 . 7384 1 223 . 1 1 21 21 GLN C C 13 175.4 0.5 . 1 . . . . 21 GLN C . 7384 1 224 . 1 1 21 21 GLN CA C 13 55.1 0.5 . 1 . . . . 21 GLN CA . 7384 1 225 . 1 1 21 21 GLN CB C 13 31.3 0.5 . 1 . . . . 21 GLN CB . 7384 1 226 . 1 1 21 21 GLN CG C 13 34.5 0.5 . 1 . . . . 21 GLN CG . 7384 1 227 . 1 1 21 21 GLN N N 15 116.2 0.2 . 1 . . . . 21 GLN N . 7384 1 228 . 1 1 21 21 GLN NE2 N 15 112.8 0.2 . 1 . . . . 21 GLN NE2 . 7384 1 229 . 1 1 22 22 CYS H H 1 7.51 0.05 . 1 . . . . 22 CYS H . 7384 1 230 . 1 1 22 22 CYS HA H 1 3.64 0.05 . 1 . . . . 22 CYS HA . 7384 1 231 . 1 1 22 22 CYS HB2 H 1 2.95 0.05 . 2 . . . . 22 CYS HB2 . 7384 1 232 . 1 1 22 22 CYS HB3 H 1 3.4 0.05 . 2 . . . . 22 CYS HB3 . 7384 1 233 . 1 1 22 22 CYS C C 13 177 0.5 . 1 . . . . 22 CYS C . 7384 1 234 . 1 1 22 22 CYS CA C 13 62.8 0.5 . 1 . . . . 22 CYS CA . 7384 1 235 . 1 1 22 22 CYS CB C 13 31 0.5 . 1 . . . . 22 CYS CB . 7384 1 236 . 1 1 22 22 CYS N N 15 123.8 0.2 . 1 . . . . 22 CYS N . 7384 1 237 . 1 1 23 23 ARG H H 1 8.87 0.05 . 1 . . . . 23 ARG H . 7384 1 238 . 1 1 23 23 ARG HA H 1 4.5 0.05 . 1 . . . . 23 ARG HA . 7384 1 239 . 1 1 23 23 ARG HB2 H 1 1.62 0.05 . 2 . . . . 23 ARG HB2 . 7384 1 240 . 1 1 23 23 ARG HB3 H 1 2.04 0.05 . 2 . . . . 23 ARG HB3 . 7384 1 241 . 1 1 23 23 ARG HD2 H 1 3.11 0.05 . 2 . . . . 23 ARG HD2 . 7384 1 242 . 1 1 23 23 ARG HD3 H 1 3.11 0.05 . 2 . . . . 23 ARG HD3 . 7384 1 243 . 1 1 23 23 ARG HG2 H 1 1.52 0.05 . 2 . . . . 23 ARG HG2 . 7384 1 244 . 1 1 23 23 ARG HG3 H 1 1.63 0.05 . 2 . . . . 23 ARG HG3 . 7384 1 245 . 1 1 23 23 ARG C C 13 176.2 0.5 . 1 . . . . 23 ARG C . 7384 1 246 . 1 1 23 23 ARG CA C 13 55.3 0.5 . 1 . . . . 23 ARG CA . 7384 1 247 . 1 1 23 23 ARG CB C 13 30.3 0.5 . 1 . . . . 23 ARG CB . 7384 1 248 . 1 1 23 23 ARG CD C 13 42.9 0.5 . 1 . . . . 23 ARG CD . 7384 1 249 . 1 1 23 23 ARG CG C 13 26.9 0.5 . 1 . . . . 23 ARG CG . 7384 1 250 . 1 1 23 23 ARG N N 15 128.2 0.2 . 1 . . . . 23 ARG N . 7384 1 251 . 1 1 24 24 ALA H H 1 8.78 0.05 . 1 . . . . 24 ALA H . 7384 1 252 . 1 1 24 24 ALA HA H 1 4.55 0.05 . 1 . . . . 24 ALA HA . 7384 1 253 . 1 1 24 24 ALA HB1 H 1 1.35 0.05 . 1 . . . . 24 ALA HB . 7384 1 254 . 1 1 24 24 ALA HB2 H 1 1.35 0.05 . 1 . . . . 24 ALA HB . 7384 1 255 . 1 1 24 24 ALA HB3 H 1 1.35 0.05 . 1 . . . . 24 ALA HB . 7384 1 256 . 1 1 24 24 ALA C C 13 174.5 0.5 . 1 . . . . 24 ALA C . 7384 1 257 . 1 1 24 24 ALA CA C 13 51.1 0.5 . 1 . . . . 24 ALA CA . 7384 1 258 . 1 1 24 24 ALA CB C 13 17.9 0.5 . 1 . . . . 24 ALA CB . 7384 1 259 . 1 1 24 24 ALA N N 15 128.3 0.2 . 1 . . . . 24 ALA N . 7384 1 260 . 1 1 25 25 PRO HA H 1 4.28 0.05 . 1 . . . . 25 PRO HA . 7384 1 261 . 1 1 25 25 PRO HB2 H 1 1.71 0.05 . 2 . . . . 25 PRO HB2 . 7384 1 262 . 1 1 25 25 PRO HB3 H 1 2.28 0.05 . 2 . . . . 25 PRO HB3 . 7384 1 263 . 1 1 25 25 PRO HD2 H 1 3.5 0.05 . 2 . . . . 25 PRO HD2 . 7384 1 264 . 1 1 25 25 PRO HD3 H 1 3.77 0.05 . 2 . . . . 25 PRO HD3 . 7384 1 265 . 1 1 25 25 PRO HG2 H 1 1.95 0.05 . 2 . . . . 25 PRO HG2 . 7384 1 266 . 1 1 25 25 PRO HG3 H 1 2.03 0.05 . 2 . . . . 25 PRO HG3 . 7384 1 267 . 1 1 25 25 PRO CA C 13 62.8 0.5 . 1 . . . . 25 PRO CA . 7384 1 268 . 1 1 25 25 PRO CB C 13 31.8 0.5 . 1 . . . . 25 PRO CB . 7384 1 269 . 1 1 25 25 PRO CD C 13 50.2 0.5 . 1 . . . . 25 PRO CD . 7384 1 270 . 1 1 25 25 PRO CG C 13 27.8 0.5 . 1 . . . . 25 PRO CG . 7384 1 271 . 1 1 26 26 ARG H H 1 8.66 0.05 . 1 . . . . 26 ARG H . 7384 1 272 . 1 1 26 26 ARG HA H 1 4.33 0.05 . 1 . . . . 26 ARG HA . 7384 1 273 . 1 1 26 26 ARG HB2 H 1 1.78 0.05 . 2 . . . . 26 ARG HB2 . 7384 1 274 . 1 1 26 26 ARG HB3 H 1 1.78 0.05 . 2 . . . . 26 ARG HB3 . 7384 1 275 . 1 1 26 26 ARG HD2 H 1 3.13 0.05 . 2 . . . . 26 ARG HD2 . 7384 1 276 . 1 1 26 26 ARG HD3 H 1 3.13 0.05 . 2 . . . . 26 ARG HD3 . 7384 1 277 . 1 1 26 26 ARG HG2 H 1 1.7 0.05 . 2 . . . . 26 ARG HG2 . 7384 1 278 . 1 1 26 26 ARG HG3 H 1 1.7 0.05 . 2 . . . . 26 ARG HG3 . 7384 1 279 . 1 1 26 26 ARG CA C 13 55.8 0.5 . 1 . . . . 26 ARG CA . 7384 1 280 . 1 1 26 26 ARG CB C 13 30.1 0.5 . 1 . . . . 26 ARG CB . 7384 1 281 . 1 1 26 26 ARG CD C 13 43.3 0.5 . 1 . . . . 26 ARG CD . 7384 1 282 . 1 1 26 26 ARG CG C 13 26.9 0.5 . 1 . . . . 26 ARG CG . 7384 1 283 . 1 1 26 26 ARG N N 15 124 0.2 . 1 . . . . 26 ARG N . 7384 1 284 . 1 1 27 27 ARG H H 1 8.99 0.05 . 1 . . . . 27 ARG H . 7384 1 285 . 1 1 27 27 ARG HA H 1 4.33 0.05 . 1 . . . . 27 ARG HA . 7384 1 286 . 1 1 27 27 ARG HB2 H 1 1.86 0.05 . 2 . . . . 27 ARG HB2 . 7384 1 287 . 1 1 27 27 ARG HB3 H 1 1.86 0.05 . 2 . . . . 27 ARG HB3 . 7384 1 288 . 1 1 27 27 ARG HD2 H 1 3.06 0.05 . 2 . . . . 27 ARG HD2 . 7384 1 289 . 1 1 27 27 ARG HD3 H 1 3.06 0.05 . 2 . . . . 27 ARG HD3 . 7384 1 290 . 1 1 27 27 ARG HE H 1 6.93 0.05 . 1 . . . . 27 ARG HE . 7384 1 291 . 1 1 27 27 ARG HG2 H 1 1.66 0.05 . 2 . . . . 27 ARG HG2 . 7384 1 292 . 1 1 27 27 ARG HG3 H 1 1.66 0.05 . 2 . . . . 27 ARG HG3 . 7384 1 293 . 1 1 27 27 ARG CA C 13 56.2 0.5 . 1 . . . . 27 ARG CA . 7384 1 294 . 1 1 27 27 ARG CB C 13 31.1 0.5 . 1 . . . . 27 ARG CB . 7384 1 295 . 1 1 27 27 ARG CD C 13 43.7 0.5 . 1 . . . . 27 ARG CD . 7384 1 296 . 1 1 27 27 ARG CG C 13 26.9 0.5 . 1 . . . . 27 ARG CG . 7384 1 297 . 1 1 27 27 ARG N N 15 127.5 0.2 . 1 . . . . 27 ARG N . 7384 1 298 . 1 1 27 27 ARG NE N 15 112.2 0.2 . 1 . . . . 27 ARG NE . 7384 1 299 . 1 1 28 28 GLN H H 1 8.65 0.05 . 1 . . . . 28 GLN H . 7384 1 300 . 1 1 28 28 GLN HA H 1 4.33 0.05 . 1 . . . . 28 GLN HA . 7384 1 301 . 1 1 28 28 GLN HB2 H 1 1.94 0.05 . 2 . . . . 28 GLN HB2 . 7384 1 302 . 1 1 28 28 GLN HB3 H 1 2.07 0.05 . 2 . . . . 28 GLN HB3 . 7384 1 303 . 1 1 28 28 GLN HE21 H 1 6.92 0.05 . 2 . . . . 28 GLN HE21 . 7384 1 304 . 1 1 28 28 GLN HE22 H 1 7.59 0.05 . 2 . . . . 28 GLN HE22 . 7384 1 305 . 1 1 28 28 GLN HG2 H 1 2.38 0.05 . 2 . . . . 28 GLN HG2 . 7384 1 306 . 1 1 28 28 GLN HG3 H 1 2.38 0.05 . 2 . . . . 28 GLN HG3 . 7384 1 307 . 1 1 28 28 GLN C C 13 176.2 0.5 . 1 . . . . 28 GLN C . 7384 1 308 . 1 1 28 28 GLN CA C 13 55.8 0.5 . 1 . . . . 28 GLN CA . 7384 1 309 . 1 1 28 28 GLN CB C 13 29.5 0.5 . 1 . . . . 28 GLN CB . 7384 1 310 . 1 1 28 28 GLN CG C 13 33.8 0.5 . 1 . . . . 28 GLN CG . 7384 1 311 . 1 1 28 28 GLN N N 15 122.4 0.2 . 1 . . . . 28 GLN N . 7384 1 312 . 1 1 28 28 GLN NE2 N 15 112.9 0.2 . 1 . . . . 28 GLN NE2 . 7384 1 313 . 1 1 29 29 GLY H H 1 8.27 0.05 . 1 . . . . 29 GLY H . 7384 1 314 . 1 1 29 29 GLY HA2 H 1 3.74 0.05 . 2 . . . . 29 GLY HA2 . 7384 1 315 . 1 1 29 29 GLY HA3 H 1 3.74 0.05 . 2 . . . . 29 GLY HA3 . 7384 1 316 . 1 1 29 29 GLY C C 13 172.8 0.5 . 1 . . . . 29 GLY C . 7384 1 317 . 1 1 29 29 GLY CA C 13 44.5 0.5 . 1 . . . . 29 GLY CA . 7384 1 318 . 1 1 29 29 GLY N N 15 109.6 0.2 . 1 . . . . 29 GLY N . 7384 1 319 . 1 1 30 30 CYS H H 1 8.28 0.05 . 1 . . . . 30 CYS H . 7384 1 320 . 1 1 30 30 CYS HA H 1 4.06 0.05 . 1 . . . . 30 CYS HA . 7384 1 321 . 1 1 30 30 CYS HB2 H 1 2.06 0.05 . 2 . . . . 30 CYS HB2 . 7384 1 322 . 1 1 30 30 CYS HB3 H 1 2.85 0.05 . 2 . . . . 30 CYS HB3 . 7384 1 323 . 1 1 30 30 CYS CA C 13 59.6 0.5 . 1 . . . . 30 CYS CA . 7384 1 324 . 1 1 30 30 CYS CB C 13 35 0.5 . 1 . . . . 30 CYS CB . 7384 1 325 . 1 1 30 30 CYS N N 15 124.2 0.2 . 1 . . . . 30 CYS N . 7384 1 326 . 1 1 31 31 TRP H H 1 8.44 0.05 . 1 . . . . 31 TRP H . 7384 1 327 . 1 1 31 31 TRP HA H 1 4.45 0.05 . 1 . . . . 31 TRP HA . 7384 1 328 . 1 1 31 31 TRP HB2 H 1 3.4 0.05 . 2 . . . . 31 TRP HB2 . 7384 1 329 . 1 1 31 31 TRP HB3 H 1 3.4 0.05 . 2 . . . . 31 TRP HB3 . 7384 1 330 . 1 1 31 31 TRP HD1 H 1 7.17 0.05 . 1 . . . . 31 TRP HD1 . 7384 1 331 . 1 1 31 31 TRP HE1 H 1 10.12 0.05 . 1 . . . . 31 TRP HE1 . 7384 1 332 . 1 1 31 31 TRP CA C 13 58.6 0.5 . 1 . . . . 31 TRP CA . 7384 1 333 . 1 1 31 31 TRP CB C 13 29.7 0.5 . 1 . . . . 31 TRP CB . 7384 1 334 . 1 1 31 31 TRP N N 15 129.8 0.2 . 1 . . . . 31 TRP N . 7384 1 335 . 1 1 31 31 TRP NE1 N 15 129 0.2 . 1 . . . . 31 TRP NE1 . 7384 1 336 . 1 1 32 32 LYS H H 1 9.24 0.05 . 1 . . . . 32 LYS H . 7384 1 337 . 1 1 32 32 LYS HA H 1 4.32 0.05 . 1 . . . . 32 LYS HA . 7384 1 338 . 1 1 32 32 LYS HB2 H 1 2.18 0.05 . 2 . . . . 32 LYS HB2 . 7384 1 339 . 1 1 32 32 LYS HB3 H 1 2.18 0.05 . 2 . . . . 32 LYS HB3 . 7384 1 340 . 1 1 32 32 LYS HD2 H 1 1.23 0.05 . 2 . . . . 32 LYS HD2 . 7384 1 341 . 1 1 32 32 LYS HD3 H 1 1.23 0.05 . 2 . . . . 32 LYS HD3 . 7384 1 342 . 1 1 32 32 LYS HG2 H 1 1.58 0.05 . 2 . . . . 32 LYS HG2 . 7384 1 343 . 1 1 32 32 LYS HG3 H 1 1.58 0.05 . 2 . . . . 32 LYS HG3 . 7384 1 344 . 1 1 32 32 LYS C C 13 176.7 0.5 . 1 . . . . 32 LYS C . 7384 1 345 . 1 1 32 32 LYS CA C 13 58.7 0.5 . 1 . . . . 32 LYS CA . 7384 1 346 . 1 1 32 32 LYS CB C 13 33.2 0.5 . 1 . . . . 32 LYS CB . 7384 1 347 . 1 1 32 32 LYS CD C 13 22.6 0.5 . 1 . . . . 32 LYS CD . 7384 1 348 . 1 1 32 32 LYS CG C 13 25.8 0.5 . 1 . . . . 32 LYS CG . 7384 1 349 . 1 1 32 32 LYS N N 15 122.7 0.2 . 1 . . . . 32 LYS N . 7384 1 350 . 1 1 33 33 CYS H H 1 8.51 0.05 . 1 . . . . 33 CYS H . 7384 1 351 . 1 1 33 33 CYS HA H 1 4.94 0.05 . 1 . . . . 33 CYS HA . 7384 1 352 . 1 1 33 33 CYS HB2 H 1 3.21 0.05 . 1 . . . . 33 CYS HB2 . 7384 1 353 . 1 1 33 33 CYS HB3 H 1 2.49 0.05 . 1 . . . . 33 CYS HB3 . 7384 1 354 . 1 1 33 33 CYS C C 13 176.9 0.5 . 1 . . . . 33 CYS C . 7384 1 355 . 1 1 33 33 CYS CA C 13 58.9 0.5 . 1 . . . . 33 CYS CA . 7384 1 356 . 1 1 33 33 CYS CB C 13 32.7 0.5 . 1 . . . . 33 CYS CB . 7384 1 357 . 1 1 33 33 CYS N N 15 117.4 0.2 . 1 . . . . 33 CYS N . 7384 1 358 . 1 1 34 34 GLY H H 1 8.11 0.05 . 1 . . . . 34 GLY H . 7384 1 359 . 1 1 34 34 GLY HA2 H 1 3.63 0.05 . 2 . . . . 34 GLY HA2 . 7384 1 360 . 1 1 34 34 GLY HA3 H 1 3.93 0.05 . 2 . . . . 34 GLY HA3 . 7384 1 361 . 1 1 34 34 GLY C C 13 174.3 0.5 . 1 . . . . 34 GLY C . 7384 1 362 . 1 1 34 34 GLY CA C 13 46.1 0.5 . 1 . . . . 34 GLY CA . 7384 1 363 . 1 1 34 34 GLY N N 15 113.9 0.2 . 1 . . . . 34 GLY N . 7384 1 364 . 1 1 35 35 LYS H H 1 8.33 0.05 . 1 . . . . 35 LYS H . 7384 1 365 . 1 1 35 35 LYS HA H 1 4.5 0.05 . 1 . . . . 35 LYS HA . 7384 1 366 . 1 1 35 35 LYS HB2 H 1 1.76 0.05 . 2 . . . . 35 LYS HB2 . 7384 1 367 . 1 1 35 35 LYS HB3 H 1 1.97 0.05 . 2 . . . . 35 LYS HB3 . 7384 1 368 . 1 1 35 35 LYS HE2 H 1 3.04 0.05 . 2 . . . . 35 LYS HD2 . 7384 1 369 . 1 1 35 35 LYS HE3 H 1 3.04 0.05 . 2 . . . . 35 LYS HD3 . 7384 1 370 . 1 1 35 35 LYS HG2 H 1 1.43 0.05 . 2 . . . . 35 LYS HG2 . 7384 1 371 . 1 1 35 35 LYS HG3 H 1 1.62 0.05 . 2 . . . . 35 LYS HG3 . 7384 1 372 . 1 1 35 35 LYS C C 13 176.7 0.5 . 1 . . . . 35 LYS C . 7384 1 373 . 1 1 35 35 LYS CA C 13 56.4 0.5 . 1 . . . . 35 LYS CA . 7384 1 374 . 1 1 35 35 LYS CB C 13 33.4 0.5 . 1 . . . . 35 LYS CB . 7384 1 375 . 1 1 35 35 LYS CG C 13 25.4 0.5 . 1 . . . . 35 LYS CG . 7384 1 376 . 1 1 35 35 LYS N N 15 121.9 0.2 . 1 . . . . 35 LYS N . 7384 1 377 . 1 1 36 36 THR H H 1 8.22 0.05 . 1 . . . . 36 THR H . 7384 1 378 . 1 1 36 36 THR HA H 1 4.28 0.05 . 1 . . . . 36 THR HA . 7384 1 379 . 1 1 36 36 THR HB H 1 4.23 0.05 . 1 . . . . 36 THR HB . 7384 1 380 . 1 1 36 36 THR HG21 H 1 1.16 0.05 . 1 . . . . 36 THR HG2 . 7384 1 381 . 1 1 36 36 THR HG22 H 1 1.16 0.05 . 1 . . . . 36 THR HG2 . 7384 1 382 . 1 1 36 36 THR HG23 H 1 1.16 0.05 . 1 . . . . 36 THR HG2 . 7384 1 383 . 1 1 36 36 THR C C 13 176.4 0.5 . 1 . . . . 36 THR C . 7384 1 384 . 1 1 36 36 THR CA C 13 61.8 0.5 . 1 . . . . 36 THR CA . 7384 1 385 . 1 1 36 36 THR CB C 13 69.2 0.5 . 1 . . . . 36 THR CB . 7384 1 386 . 1 1 36 36 THR CG2 C 13 21.8 0.5 . 1 . . . . 36 THR CG2 . 7384 1 387 . 1 1 36 36 THR N N 15 110.2 0.2 . 1 . . . . 36 THR N . 7384 1 388 . 1 1 37 37 GLY H H 1 8.6 0.05 . 1 . . . . 37 GLY H . 7384 1 389 . 1 1 37 37 GLY HA2 H 1 3.72 0.05 . 2 . . . . 37 GLY HA2 . 7384 1 390 . 1 1 37 37 GLY HA3 H 1 4.29 0.05 . 2 . . . . 37 GLY HA3 . 7384 1 391 . 1 1 37 37 GLY C C 13 173.7 0.5 . 1 . . . . 37 GLY C . 7384 1 392 . 1 1 37 37 GLY CA C 13 45.6 0.5 . 1 . . . . 37 GLY CA . 7384 1 393 . 1 1 37 37 GLY N N 15 107.9 0.2 . 1 . . . . 37 GLY N . 7384 1 394 . 1 1 38 38 HIS H H 1 7.1 0.05 . 1 . . . . 38 HIS H . 7384 1 395 . 1 1 38 38 HIS HA H 1 4.9 0.05 . 1 . . . . 38 HIS HA . 7384 1 396 . 1 1 38 38 HIS HB2 H 1 3.07 0.05 . 2 . . . . 38 HIS HB2 . 7384 1 397 . 1 1 38 38 HIS HB3 H 1 3.18 0.05 . 2 . . . . 38 HIS HB3 . 7384 1 398 . 1 1 38 38 HIS HD2 H 1 7.19 0.05 . 1 . . . . 38 HIS HD2 . 7384 1 399 . 1 1 38 38 HIS CA C 13 43.3 0.5 . 1 . . . . 38 HIS CA . 7384 1 400 . 1 1 38 38 HIS CB C 13 27.7 0.5 . 1 . . . . 38 HIS CB . 7384 1 401 . 1 1 38 38 HIS N N 15 112.6 0.2 . 1 . . . . 38 HIS N . 7384 1 402 . 1 1 39 39 VAL H H 1 7.94 0.05 . 1 . . . . 39 VAL H . 7384 1 403 . 1 1 39 39 VAL HA H 1 4.58 0.05 . 1 . . . . 39 VAL HA . 7384 1 404 . 1 1 39 39 VAL HB H 1 2.35 0.05 . 1 . . . . 39 VAL HB . 7384 1 405 . 1 1 39 39 VAL HG11 H 1 0.88 0.05 . 2 . . . . 39 VAL HG1 . 7384 1 406 . 1 1 39 39 VAL HG12 H 1 0.88 0.05 . 2 . . . . 39 VAL HG1 . 7384 1 407 . 1 1 39 39 VAL HG13 H 1 0.88 0.05 . 2 . . . . 39 VAL HG1 . 7384 1 408 . 1 1 39 39 VAL HG21 H 1 0.88 0.05 . 2 . . . . 39 VAL HG2 . 7384 1 409 . 1 1 39 39 VAL HG22 H 1 0.88 0.05 . 2 . . . . 39 VAL HG2 . 7384 1 410 . 1 1 39 39 VAL HG23 H 1 0.88 0.05 . 2 . . . . 39 VAL HG2 . 7384 1 411 . 1 1 39 39 VAL C C 13 172.8 0.5 . 1 . . . . 39 VAL C . 7384 1 412 . 1 1 39 39 VAL CA C 13 59.2 0.5 . 1 . . . . 39 VAL CA . 7384 1 413 . 1 1 39 39 VAL CB C 13 33.7 0.5 . 1 . . . . 39 VAL CB . 7384 1 414 . 1 1 39 39 VAL CG1 C 13 21.4 0.5 . 2 . . . . 39 VAL CG1 . 7384 1 415 . 1 1 39 39 VAL CG2 C 13 21.4 0.5 . 2 . . . . 39 VAL CG2 . 7384 1 416 . 1 1 39 39 VAL N N 15 110.5 0.2 . 1 . . . . 39 VAL N . 7384 1 417 . 1 1 40 40 MET H H 1 8.81 0.05 . 1 . . . . 40 MET H . 7384 1 418 . 1 1 40 40 MET HA H 1 4.77 0.05 . 1 . . . . 40 MET HA . 7384 1 419 . 1 1 40 40 MET HB2 H 1 2.08 0.05 . 2 . . . . 40 MET HB2 . 7384 1 420 . 1 1 40 40 MET HB3 H 1 2.08 0.05 . 2 . . . . 40 MET HB3 . 7384 1 421 . 1 1 40 40 MET HG2 H 1 2.45 0.05 . 2 . . . . 40 MET HG2 . 7384 1 422 . 1 1 40 40 MET HG3 H 1 2.45 0.05 . 2 . . . . 40 MET HG3 . 7384 1 423 . 1 1 40 40 MET C C 13 178.3 0.5 . 1 . . . . 40 MET C . 7384 1 424 . 1 1 40 40 MET CA C 13 60.1 0.5 . 1 . . . . 40 MET CA . 7384 1 425 . 1 1 40 40 MET CB C 13 32.8 0.5 . 1 . . . . 40 MET CB . 7384 1 426 . 1 1 40 40 MET CG C 13 31.8 0.5 . 1 . . . . 40 MET CG . 7384 1 427 . 1 1 40 40 MET N N 15 122.4 0.2 . 1 . . . . 40 MET N . 7384 1 428 . 1 1 41 41 ALA H H 1 8.53 0.05 . 1 . . . . 41 ALA H . 7384 1 429 . 1 1 41 41 ALA HA H 1 4.1 0.05 . 1 . . . . 41 ALA HA . 7384 1 430 . 1 1 41 41 ALA HB1 H 1 1.4 0.05 . 1 . . . . 41 ALA HB . 7384 1 431 . 1 1 41 41 ALA HB2 H 1 1.4 0.05 . 1 . . . . 41 ALA HB . 7384 1 432 . 1 1 41 41 ALA HB3 H 1 1.4 0.05 . 1 . . . . 41 ALA HB . 7384 1 433 . 1 1 41 41 ALA C C 13 178.3 0.5 . 1 . . . . 41 ALA C . 7384 1 434 . 1 1 41 41 ALA CA C 13 54.4 0.5 . 1 . . . . 41 ALA CA . 7384 1 435 . 1 1 41 41 ALA CB C 13 18.8 0.5 . 1 . . . . 41 ALA CB . 7384 1 436 . 1 1 41 41 ALA N N 15 120.8 0.2 . 1 . . . . 41 ALA N . 7384 1 437 . 1 1 42 42 LYS H H 1 7.9 0.05 . 1 . . . . 42 LYS H . 7384 1 438 . 1 1 42 42 LYS HA H 1 4.48 0.05 . 1 . . . . 42 LYS HA . 7384 1 439 . 1 1 42 42 LYS HB2 H 1 2.09 0.05 . 1 . . . . 42 LYS HB2 . 7384 1 440 . 1 1 42 42 LYS HB3 H 1 1.63 0.05 . 1 . . . . 42 LYS HB3 . 7384 1 441 . 1 1 42 42 LYS HE2 H 1 2.93 0.05 . 2 . . . . 42 LYS HE2 . 7384 1 442 . 1 1 42 42 LYS HE3 H 1 2.93 0.05 . 2 . . . . 42 LYS HE3 . 7384 1 443 . 1 1 42 42 LYS HG2 H 1 1.21 0.05 . 2 . . . . 42 LYS HG2 . 7384 1 444 . 1 1 42 42 LYS HG3 H 1 1.4 0.05 . 2 . . . . 42 LYS HG3 . 7384 1 445 . 1 1 42 42 LYS C C 13 175.4 0.5 . 1 . . . . 42 LYS C . 7384 1 446 . 1 1 42 42 LYS CA C 13 53.5 0.5 . 1 . . . . 42 LYS CA . 7384 1 447 . 1 1 42 42 LYS CB C 13 32.7 0.5 . 1 . . . . 42 LYS CB . 7384 1 448 . 1 1 42 42 LYS CG C 13 24.7 0.5 . 1 . . . . 42 LYS CG . 7384 1 449 . 1 1 42 42 LYS N N 15 115.2 0.2 . 1 . . . . 42 LYS N . 7384 1 450 . 1 1 43 43 CYS H H 1 7.57 0.05 . 1 . . . . 43 CYS H . 7384 1 451 . 1 1 43 43 CYS HA H 1 4.02 0.05 . 1 . . . . 43 CYS HA . 7384 1 452 . 1 1 43 43 CYS HB2 H 1 2.79 0.05 . 2 . . . . 43 CYS HB2 . 7384 1 453 . 1 1 43 43 CYS HB3 H 1 3.29 0.05 . 2 . . . . 43 CYS HB3 . 7384 1 454 . 1 1 43 43 CYS CA C 13 58.6 0.5 . 1 . . . . 43 CYS CA . 7384 1 455 . 1 1 43 43 CYS CB C 13 30.8 0.5 . 1 . . . . 43 CYS CB . 7384 1 456 . 1 1 43 43 CYS N N 15 125.6 0.2 . 1 . . . . 43 CYS N . 7384 1 457 . 1 1 44 44 PRO HA H 1 4.43 0.05 . 1 . . . . 44 PRO HA . 7384 1 458 . 1 1 44 44 PRO HB2 H 1 1.93 0.05 . 2 . . . . 44 PRO HB2 . 7384 1 459 . 1 1 44 44 PRO HB3 H 1 2.15 0.05 . 2 . . . . 44 PRO HB3 . 7384 1 460 . 1 1 44 44 PRO HD2 H 1 3 0.05 . 2 . . . . 44 PRO HD2 . 7384 1 461 . 1 1 44 44 PRO HD3 H 1 3.62 0.05 . 2 . . . . 44 PRO HD3 . 7384 1 462 . 1 1 44 44 PRO HG2 H 1 1.79 0.05 . 2 . . . . 44 PRO HG2 . 7384 1 463 . 1 1 44 44 PRO HG3 H 1 1.85 0.05 . 2 . . . . 44 PRO HG3 . 7384 1 464 . 1 1 44 44 PRO CA C 13 63.8 0.5 . 1 . . . . 44 PRO CA . 7384 1 465 . 1 1 44 44 PRO CB C 13 32.2 0.5 . 1 . . . . 44 PRO CB . 7384 1 466 . 1 1 44 44 PRO CD C 13 50.4 0.5 . 1 . . . . 44 PRO CD . 7384 1 467 . 1 1 44 44 PRO CG C 13 26.7 0.5 . 1 . . . . 44 PRO CG . 7384 1 468 . 1 1 45 45 GLU H H 1 8.67 0.05 . 1 . . . . 45 GLU H . 7384 1 469 . 1 1 45 45 GLU HA H 1 4.25 0.05 . 1 . . . . 45 GLU HA . 7384 1 470 . 1 1 45 45 GLU HB2 H 1 1.94 0.05 . 2 . . . . 45 GLU HB2 . 7384 1 471 . 1 1 45 45 GLU HB3 H 1 2.11 0.05 . 2 . . . . 45 GLU HB3 . 7384 1 472 . 1 1 45 45 GLU HG2 H 1 2.18 0.05 . 2 . . . . 45 GLU HG2 . 7384 1 473 . 1 1 45 45 GLU HG3 H 1 2.3 0.05 . 2 . . . . 45 GLU HG3 . 7384 1 474 . 1 1 45 45 GLU CA C 13 56.6 0.5 . 1 . . . . 45 GLU CA . 7384 1 475 . 1 1 45 45 GLU CB C 13 28.8 0.5 . 1 . . . . 45 GLU CB . 7384 1 476 . 1 1 45 45 GLU CG C 13 35.9 0.5 . 1 . . . . 45 GLU CG . 7384 1 477 . 1 1 45 45 GLU N N 15 120.6 0.2 . 1 . . . . 45 GLU N . 7384 1 478 . 1 1 46 46 ARG H H 1 8.16 0.05 . 1 . . . . 46 ARG H . 7384 1 479 . 1 1 46 46 ARG HA H 1 4.24 0.05 . 1 . . . . 46 ARG HA . 7384 1 480 . 1 1 46 46 ARG HB2 H 1 1.78 0.05 . 2 . . . . 46 ARG HB2 . 7384 1 481 . 1 1 46 46 ARG HB3 H 1 1.84 0.05 . 2 . . . . 46 ARG HB3 . 7384 1 482 . 1 1 46 46 ARG HD2 H 1 3.18 0.05 . 2 . . . . 46 ARG HD2 . 7384 1 483 . 1 1 46 46 ARG HD3 H 1 3.18 0.05 . 2 . . . . 46 ARG HD3 . 7384 1 484 . 1 1 46 46 ARG HG2 H 1 1.59 0.05 . 2 . . . . 46 ARG HG2 . 7384 1 485 . 1 1 46 46 ARG HG3 H 1 1.59 0.05 . 2 . . . . 46 ARG HG3 . 7384 1 486 . 1 1 46 46 ARG C C 13 176.3 0.5 . 1 . . . . 46 ARG C . 7384 1 487 . 1 1 46 46 ARG CA C 13 56.3 0.5 . 1 . . . . 46 ARG CA . 7384 1 488 . 1 1 46 46 ARG CB C 13 30.8 0.5 . 1 . . . . 46 ARG CB . 7384 1 489 . 1 1 46 46 ARG CG C 13 27 0.5 . 1 . . . . 46 ARG CG . 7384 1 490 . 1 1 46 46 ARG N N 15 121.2 0.2 . 1 . . . . 46 ARG N . 7384 1 491 . 1 1 47 47 GLN H H 1 8.47 0.05 . 1 . . . . 47 GLN H . 7384 1 492 . 1 1 47 47 GLN HA H 1 4.3 0.05 . 1 . . . . 47 GLN HA . 7384 1 493 . 1 1 47 47 GLN HB2 H 1 1.97 0.05 . 2 . . . . 47 GLN HB2 . 7384 1 494 . 1 1 47 47 GLN HB3 H 1 2.11 0.05 . 2 . . . . 47 GLN HB3 . 7384 1 495 . 1 1 47 47 GLN HE21 H 1 6.89 0.05 . 2 . . . . 47 GLN HE21 . 7384 1 496 . 1 1 47 47 GLN HE22 H 1 6.89 0.05 . 2 . . . . 47 GLN HE22 . 7384 1 497 . 1 1 47 47 GLN HG2 H 1 2.33 0.05 . 2 . . . . 47 GLN HG2 . 7384 1 498 . 1 1 47 47 GLN HG3 H 1 2.33 0.05 . 2 . . . . 47 GLN HG3 . 7384 1 499 . 1 1 47 47 GLN C C 13 175.7 0.5 . 1 . . . . 47 GLN C . 7384 1 500 . 1 1 47 47 GLN CA C 13 55.8 0.5 . 1 . . . . 47 GLN CA . 7384 1 501 . 1 1 47 47 GLN N N 15 121.3 0.2 . 1 . . . . 47 GLN N . 7384 1 502 . 1 1 47 47 GLN NE2 N 15 112.8 0.2 . 1 . . . . 47 GLN NE2 . 7384 1 503 . 1 1 48 48 ALA H H 1 8.42 0.05 . 1 . . . . 48 ALA H . 7384 1 504 . 1 1 48 48 ALA HA H 1 4.32 0.05 . 1 . . . . 48 ALA HA . 7384 1 505 . 1 1 48 48 ALA HB1 H 1 1.38 0.05 . 1 . . . . 48 ALA HB . 7384 1 506 . 1 1 48 48 ALA HB2 H 1 1.38 0.05 . 1 . . . . 48 ALA HB . 7384 1 507 . 1 1 48 48 ALA HB3 H 1 1.38 0.05 . 1 . . . . 48 ALA HB . 7384 1 508 . 1 1 48 48 ALA C C 13 177.3 0.5 . 1 . . . . 48 ALA C . 7384 1 509 . 1 1 48 48 ALA CA C 13 52.4 0.5 . 1 . . . . 48 ALA CA . 7384 1 510 . 1 1 48 48 ALA CB C 13 19.4 0.5 . 1 . . . . 48 ALA CB . 7384 1 511 . 1 1 48 48 ALA N N 15 126 0.2 . 1 . . . . 48 ALA N . 7384 1 512 . 1 1 49 49 GLY H H 1 8.08 0.05 . 1 . . . . 49 GLY H . 7384 1 513 . 1 1 49 49 GLY HA2 H 1 3.75 0.05 . 2 . . . . 49 GLY HA2 . 7384 1 514 . 1 1 49 49 GLY HA3 H 1 3.75 0.05 . 2 . . . . 49 GLY HA3 . 7384 1 515 . 1 1 49 49 GLY C C 13 179.4 0.5 . 1 . . . . 49 GLY C . 7384 1 516 . 1 1 49 49 GLY CA C 13 45.9 0.5 . 1 . . . . 49 GLY CA . 7384 1 517 . 1 1 49 49 GLY N N 15 114.7 0.2 . 1 . . . . 49 GLY N . 7384 1 stop_ save_