data_15208 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15208 _Entry.Title ; Embryonic Neural Inducing Factor Churchill is not a DNA-Binding Zinc Finger Protein: Solution Structure Reveals a Solvent-Exposed Beta-Sheet and Zinc Binuclear Cluster ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-04-07 _Entry.Accession_date 2007-04-07 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 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 Brian Lee . M. . 15208 2 Bethany Buck-Koehntop . A. . 15208 3 Maria Martinez-Yamout . A. . 15208 4 Joel Gottesfeld . M. . 15208 5 'H. Jane' Dyson . . . 15208 6 Peter Wright . E. . 15208 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 15208 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PROTEIN . 15208 ZINC . 15208 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15208 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 454 15208 '15N chemical shifts' 113 15208 '1H chemical shifts' 734 15208 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 . . 2009-02-04 2007-04-07 update BMRB 'Renumber residue codes in data table' 15208 1 . . 2008-05-06 2007-04-07 original author 'original release' 15208 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2JOX 'BMRB Entry Tracking System' 15208 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15208 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17610897 _Citation.Full_citation . _Citation.Title ; Embryonic Neural Inducing Factor Churchill is not a DNA-Binding Zinc Finger Protein: Solution Structure Reveals a Solvent-Exposed Beta-Sheet and Zinc Binuclear Cluster ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 371 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1274 _Citation.Page_last 1289 _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 Brian Lee . M. . 15208 1 2 Bethany Buck-Koehntop . A. . 15208 1 3 Maria Martinez-Yamout . A. . 15208 1 4 'H. Jane' Dyson . . . 15208 1 5 Peter Wright . E. . 15208 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15208 _Assembly.ID 1 _Assembly.Name Churchill _Assembly.BMRB_code . _Assembly.Number_of_components 4 _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 protein 1 $Churchill A . yes native no no . . . 15208 1 2 'zinc ion, 1' 2 $ZN B . yes native no no . . . 15208 1 3 'zinc ion, 2' 2 $ZN C . yes native no no . . . 15208 1 4 'zinc ion, 3' 2 $ZN D . yes native no no . . . 15208 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 coordination single . 2 'zinc ion, 1' 2 ZN 1 1 ZN . 1 protein 1 CYS 1 1 SG . . . . . . . . . . 15208 1 2 coordination single . 2 'zinc ion, 1' 2 ZN 1 1 ZN . 1 protein 1 CYS 4 4 SG . . . . . . . . . . 15208 1 3 coordination single . 2 'zinc ion, 1' 2 ZN 1 1 ZN . 1 protein 1 CYS 29 29 SG . . . . . . . . . . 15208 1 4 coordination single . 2 'zinc ion, 1' 2 ZN 1 1 ZN . 1 protein 1 HIS 65 65 NE2 . . . . . . . . . . 15208 1 5 coordination single . 3 'zinc ion, 2' 2 ZN 1 1 ZN . 1 protein 1 CYS 29 29 SG . . . . . . . . . . 15208 1 6 coordination single . 3 'zinc ion, 2' 2 ZN 1 1 ZN . 1 protein 1 CYS 32 32 SG . . . . . . . . . . 15208 1 7 coordination single . 3 'zinc ion, 2' 2 ZN 1 1 ZN . 1 protein 1 CYS 60 60 SG . . . . . . . . . . 15208 1 8 coordination single . 3 'zinc ion, 2' 2 ZN 1 1 ZN . 1 protein 1 CYS 63 63 SG . . . . . . . . . . 15208 1 9 coordination single . 4 'zinc ion, 3' 2 ZN 1 1 ZN . 1 protein 1 HIS 58 58 NE2 . . . . . . . . . . 15208 1 10 coordination single . 4 'zinc ion, 3' 2 ZN 1 1 ZN . 1 protein 1 HIS 70 70 ND1 . . . . . . . . . . 15208 1 11 coordination single . 4 'zinc ion, 3' 2 ZN 1 1 ZN . 1 protein 1 CYS 87 87 SG . . . . . . . . . . 15208 1 12 coordination single . 4 'zinc ion, 3' 2 ZN 1 1 ZN . 1 protein 1 CYS 90 90 SG . . . . . . . . . . 15208 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Churchill _Entity.Sf_category entity _Entity.Sf_framecode Churchill _Entity.Entry_ID 15208 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Churchill _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 ; CGDCVEKEYPNRGNTCLENG SFLLNFTGCAVCSKRDFMLI TNKSLKEEDGEEIVTYDHLC KNCHHVIARHEYTFSIMDEF QEYTMLCLLCGKAEDTISIL PDDPRQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 106 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 12166.857 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2JOX . "Embryonic Neural Inducing Factor Churchill Is Not A Dna- Binding Zinc Finger Protein: Solution Structure Reveals A Solvent-Expo" . . . . . 100.00 106 100.00 100.00 1.71e-71 . . . . 15208 1 2 no DBJ BAG51943 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 112 100.00 100.00 1.33e-71 . . . . 15208 1 3 no DBJ BAG59416 . "unnamed protein product [Homo sapiens]" . . . . . 76.42 471 100.00 100.00 3.50e-49 . . . . 15208 1 4 no DBJ BAH12268 . "unnamed protein product [Homo sapiens]" . . . . . 77.36 119 98.78 100.00 8.51e-52 . . . . 15208 1 5 no EMBL CAH92555 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 6 no GB AAH20550 . "Churchill domain containing 1 [Homo sapiens]" . . . . . 100.00 112 100.00 100.00 1.33e-71 . . . . 15208 1 7 no GB AAI68770 . "Churchill domain containing 1 [Rattus norvegicus]" . . . . . 100.00 112 97.17 99.06 3.25e-70 . . . . 15208 1 8 no GB AIC61091 . "CHURC1, partial [synthetic construct]" . . . . . 100.00 112 100.00 100.00 1.33e-71 . . . . 15208 1 9 no GB EAW80884 . "churchill domain containing 1, isoform CRA_b [Homo sapiens]" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 10 no GB EAW80885 . "churchill domain containing 1, isoform CRA_b [Homo sapiens]" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 11 no REF NP_001100211 . "protein Churchill [Rattus norvegicus]" . . . . . 100.00 112 97.17 99.06 3.25e-70 . . . . 15208 1 12 no REF NP_001126496 . "protein Churchill [Pongo abelii]" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 13 no REF NP_001189488 . "CHURC1-FNTB protein isoform 1 [Homo sapiens]" . . . . . 76.42 498 100.00 100.00 7.93e-51 . . . . 15208 1 14 no REF NP_001190992 . "protein Churchill isoform 2 [Homo sapiens]" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 15 no REF NP_660148 . "protein Churchill isoform 1 [Homo sapiens]" . . . . . 100.94 140 98.13 98.13 7.23e-69 . . . . 15208 1 16 no SP Q5R6Q5 . "RecName: Full=Protein Churchill" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 1 17 no SP Q8WUH1 . "RecName: Full=Protein Churchill" . . . . . 100.00 139 100.00 100.00 5.02e-72 . . . . 15208 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 2 CYS . 15208 1 2 3 GLY . 15208 1 3 4 ASP . 15208 1 4 5 CYS . 15208 1 5 6 VAL . 15208 1 6 7 GLU . 15208 1 7 8 LYS . 15208 1 8 9 GLU . 15208 1 9 10 TYR . 15208 1 10 11 PRO . 15208 1 11 12 ASN . 15208 1 12 13 ARG . 15208 1 13 14 GLY . 15208 1 14 15 ASN . 15208 1 15 16 THR . 15208 1 16 17 CYS . 15208 1 17 18 LEU . 15208 1 18 19 GLU . 15208 1 19 20 ASN . 15208 1 20 21 GLY . 15208 1 21 22 SER . 15208 1 22 23 PHE . 15208 1 23 24 LEU . 15208 1 24 25 LEU . 15208 1 25 26 ASN . 15208 1 26 27 PHE . 15208 1 27 28 THR . 15208 1 28 29 GLY . 15208 1 29 30 CYS . 15208 1 30 31 ALA . 15208 1 31 32 VAL . 15208 1 32 33 CYS . 15208 1 33 34 SER . 15208 1 34 35 LYS . 15208 1 35 36 ARG . 15208 1 36 37 ASP . 15208 1 37 38 PHE . 15208 1 38 39 MET . 15208 1 39 40 LEU . 15208 1 40 41 ILE . 15208 1 41 42 THR . 15208 1 42 43 ASN . 15208 1 43 44 LYS . 15208 1 44 45 SER . 15208 1 45 46 LEU . 15208 1 46 47 LYS . 15208 1 47 48 GLU . 15208 1 48 49 GLU . 15208 1 49 50 ASP . 15208 1 50 51 GLY . 15208 1 51 52 GLU . 15208 1 52 53 GLU . 15208 1 53 54 ILE . 15208 1 54 55 VAL . 15208 1 55 56 THR . 15208 1 56 57 TYR . 15208 1 57 58 ASP . 15208 1 58 59 HIS . 15208 1 59 60 LEU . 15208 1 60 61 CYS . 15208 1 61 62 LYS . 15208 1 62 63 ASN . 15208 1 63 64 CYS . 15208 1 64 65 HIS . 15208 1 65 66 HIS . 15208 1 66 67 VAL . 15208 1 67 68 ILE . 15208 1 68 69 ALA . 15208 1 69 70 ARG . 15208 1 70 71 HIS . 15208 1 71 72 GLU . 15208 1 72 73 TYR . 15208 1 73 74 THR . 15208 1 74 75 PHE . 15208 1 75 76 SER . 15208 1 76 77 ILE . 15208 1 77 78 MET . 15208 1 78 79 ASP . 15208 1 79 80 GLU . 15208 1 80 81 PHE . 15208 1 81 82 GLN . 15208 1 82 83 GLU . 15208 1 83 84 TYR . 15208 1 84 85 THR . 15208 1 85 86 MET . 15208 1 86 87 LEU . 15208 1 87 88 CYS . 15208 1 88 89 LEU . 15208 1 89 90 LEU . 15208 1 90 91 CYS . 15208 1 91 92 GLY . 15208 1 92 93 LYS . 15208 1 93 94 ALA . 15208 1 94 95 GLU . 15208 1 95 96 ASP . 15208 1 96 97 THR . 15208 1 97 98 ILE . 15208 1 98 99 SER . 15208 1 99 100 ILE . 15208 1 100 101 LEU . 15208 1 101 102 PRO . 15208 1 102 103 ASP . 15208 1 103 104 ASP . 15208 1 104 105 PRO . 15208 1 105 106 ARG . 15208 1 106 107 GLN . 15208 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 . CYS 1 1 15208 1 . GLY 2 2 15208 1 . ASP 3 3 15208 1 . CYS 4 4 15208 1 . VAL 5 5 15208 1 . GLU 6 6 15208 1 . LYS 7 7 15208 1 . GLU 8 8 15208 1 . TYR 9 9 15208 1 . PRO 10 10 15208 1 . ASN 11 11 15208 1 . ARG 12 12 15208 1 . GLY 13 13 15208 1 . ASN 14 14 15208 1 . THR 15 15 15208 1 . CYS 16 16 15208 1 . LEU 17 17 15208 1 . GLU 18 18 15208 1 . ASN 19 19 15208 1 . GLY 20 20 15208 1 . SER 21 21 15208 1 . PHE 22 22 15208 1 . LEU 23 23 15208 1 . LEU 24 24 15208 1 . ASN 25 25 15208 1 . PHE 26 26 15208 1 . THR 27 27 15208 1 . GLY 28 28 15208 1 . CYS 29 29 15208 1 . ALA 30 30 15208 1 . VAL 31 31 15208 1 . CYS 32 32 15208 1 . SER 33 33 15208 1 . LYS 34 34 15208 1 . ARG 35 35 15208 1 . ASP 36 36 15208 1 . PHE 37 37 15208 1 . MET 38 38 15208 1 . LEU 39 39 15208 1 . ILE 40 40 15208 1 . THR 41 41 15208 1 . ASN 42 42 15208 1 . LYS 43 43 15208 1 . SER 44 44 15208 1 . LEU 45 45 15208 1 . LYS 46 46 15208 1 . GLU 47 47 15208 1 . GLU 48 48 15208 1 . ASP 49 49 15208 1 . GLY 50 50 15208 1 . GLU 51 51 15208 1 . GLU 52 52 15208 1 . ILE 53 53 15208 1 . VAL 54 54 15208 1 . THR 55 55 15208 1 . TYR 56 56 15208 1 . ASP 57 57 15208 1 . HIS 58 58 15208 1 . LEU 59 59 15208 1 . CYS 60 60 15208 1 . LYS 61 61 15208 1 . ASN 62 62 15208 1 . CYS 63 63 15208 1 . HIS 64 64 15208 1 . HIS 65 65 15208 1 . VAL 66 66 15208 1 . ILE 67 67 15208 1 . ALA 68 68 15208 1 . ARG 69 69 15208 1 . HIS 70 70 15208 1 . GLU 71 71 15208 1 . TYR 72 72 15208 1 . THR 73 73 15208 1 . PHE 74 74 15208 1 . SER 75 75 15208 1 . ILE 76 76 15208 1 . MET 77 77 15208 1 . ASP 78 78 15208 1 . GLU 79 79 15208 1 . PHE 80 80 15208 1 . GLN 81 81 15208 1 . GLU 82 82 15208 1 . TYR 83 83 15208 1 . THR 84 84 15208 1 . MET 85 85 15208 1 . LEU 86 86 15208 1 . CYS 87 87 15208 1 . LEU 88 88 15208 1 . LEU 89 89 15208 1 . CYS 90 90 15208 1 . GLY 91 91 15208 1 . LYS 92 92 15208 1 . ALA 93 93 15208 1 . GLU 94 94 15208 1 . ASP 95 95 15208 1 . THR 96 96 15208 1 . ILE 97 97 15208 1 . SER 98 98 15208 1 . ILE 99 99 15208 1 . LEU 100 100 15208 1 . PRO 101 101 15208 1 . ASP 102 102 15208 1 . ASP 103 103 15208 1 . PRO 104 104 15208 1 . ARG 105 105 15208 1 . GLN 106 106 15208 1 stop_ save_ save_ZN _Entity.Sf_category entity _Entity.Sf_framecode ZN _Entity.Entry_ID 15208 _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 . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _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 . 15208 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 15208 _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 $Churchill . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 15208 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 15208 _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 $Churchill . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET21a . . . . . . 15208 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 15208 _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 . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _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 . _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 . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _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 Wed Dec 20 05:48:03 2006 ; _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=1/Zn/q+2 INCHI InChi 1 15208 ZN [Zn++] SMILES_CANONICAL CACTVS 2.87 15208 ZN [Zn+2] SMILES OpenEye/OEToolkits 1.4.2 15208 ZN [Zn+2] SMILES_CANONICAL OpenEye/OEToolkits 1.4.2 15208 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(+2) cation' 'SYSTEMATIC NAME' OpenEye/Lexichem 1.4 15208 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 . . . . . . . . . . . . . . . 15208 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15208 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 Churchill '[U-13C; U-15N]' . . 1 $Churchill . . 1 . . mM . . . . 15208 1 2 Tris 'natural abundance' . . . . . . 25 . . mM . . . . 15208 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 15208 1 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15208 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 15208 _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' 40 . mM 15208 1 pH 6.8 . pH 15208 1 pressure 1 . atm 15208 1 temperature 298 . K 15208 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 15208 _Software.ID 1 _Software.Name AMBER _Software.Version . _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 Koll' . . 15208 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15208 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 15208 _Software.ID 2 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 15208 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 15208 2 refinement 15208 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 15208 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 15208 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15208 3 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15208 _Software.ID 4 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15208 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15208 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 15208 _Software.ID 5 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 15208 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift calculation' 15208 5 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 15208 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15208 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 15208 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 15208 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_5 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_5 _NMR_spectrometer.Entry_ID 15208 _NMR_spectrometer.ID 5 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15208 _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 . . . 15208 1 2 spectrometer_2 Bruker DMX . 600 . . . 15208 1 3 spectrometer_3 Bruker DMX . 800 . . . 15208 1 4 spectrometer_4 Bruker DMX . 900 . . . 15208 1 5 spectrometer_5 Bruker DRX . 750 . . . 15208 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 15208 _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 . . . . . . . . . . . . . . . . . . . . . 15208 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 8 '3D (HCA)CO(CA)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 9 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 10 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 11 '3D CBCGCD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 12 '3D CBCGCE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 13 '3D HNHB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 14 '3D HACAHB-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 15 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 16 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 1 17 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15208 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 15208 _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 . indirect 0.251449530 . . . . . . . . . 15208 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15208 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15208 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 15208 _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 3 '3D HNCO' . . . 15208 1 4 '3D HNCA' . . . 15208 1 6 '3D CBCA(CO)NH' . . . 15208 1 10 '3D HCCH-COSY' . . . 15208 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 CYS HA H 1 4.451 . . 1 . . . . 2 CYS HA . 15208 1 2 . 1 1 1 1 CYS HB2 H 1 3.403 . . 2 . . . . 2 CYS HB2 . 15208 1 3 . 1 1 1 1 CYS HB3 H 1 3.067 . . 2 . . . . 2 CYS HB3 . 15208 1 4 . 1 1 1 1 CYS C C 13 177.398 . . 1 . . . . 2 CYS C . 15208 1 5 . 1 1 1 1 CYS CA C 13 57.071 . . 1 . . . . 2 CYS CA . 15208 1 6 . 1 1 1 1 CYS CB C 13 34.419 . . 1 . . . . 2 CYS CB . 15208 1 7 . 1 1 2 2 GLY H H 1 8.990 . . 1 . . . . 3 GLY HN . 15208 1 8 . 1 1 2 2 GLY HA2 H 1 4.130 . . 2 . . . . 3 GLY HA2 . 15208 1 9 . 1 1 2 2 GLY HA3 H 1 3.845 . . 2 . . . . 3 GLY HA3 . 15208 1 10 . 1 1 2 2 GLY C C 13 174.588 . . 1 . . . . 3 GLY C . 15208 1 11 . 1 1 2 2 GLY CA C 13 46.757 . . 1 . . . . 3 GLY CA . 15208 1 12 . 1 1 2 2 GLY N N 15 104.875 . . 1 . . . . 3 GLY N . 15208 1 13 . 1 1 3 3 ASP H H 1 8.603 . . 1 . . . . 4 ASP HN . 15208 1 14 . 1 1 3 3 ASP HA H 1 4.894 . . 1 . . . . 4 ASP HA . 15208 1 15 . 1 1 3 3 ASP HB2 H 1 2.825 . . 1 . . . . 4 ASP QB . 15208 1 16 . 1 1 3 3 ASP HB3 H 1 2.825 . . 1 . . . . 4 ASP QB . 15208 1 17 . 1 1 3 3 ASP C C 13 177.346 . . 1 . . . . 4 ASP C . 15208 1 18 . 1 1 3 3 ASP CA C 13 55.547 . . 1 . . . . 4 ASP CA . 15208 1 19 . 1 1 3 3 ASP CB C 13 40.874 . . 1 . . . . 4 ASP CB . 15208 1 20 . 1 1 3 3 ASP N N 15 119.926 . . 1 . . . . 4 ASP N . 15208 1 21 . 1 1 4 4 CYS H H 1 7.975 . . 1 . . . . 5 CYS HN . 15208 1 22 . 1 1 4 4 CYS HA H 1 4.798 . . 1 . . . . 5 CYS HA . 15208 1 23 . 1 1 4 4 CYS HB2 H 1 3.654 . . 2 . . . . 5 CYS HB2 . 15208 1 24 . 1 1 4 4 CYS HB3 H 1 3.530 . . 2 . . . . 5 CYS HB3 . 15208 1 25 . 1 1 4 4 CYS C C 13 174.952 . . 1 . . . . 5 CYS C . 15208 1 26 . 1 1 4 4 CYS CA C 13 62.802 . . 1 . . . . 5 CYS CA . 15208 1 27 . 1 1 4 4 CYS CB C 13 32.471 . . 1 . . . . 5 CYS CB . 15208 1 28 . 1 1 4 4 CYS N N 15 120.561 . . 1 . . . . 5 CYS N . 15208 1 29 . 1 1 5 5 VAL H H 1 6.930 . . 1 . . . . 6 VAL HN . 15208 1 30 . 1 1 5 5 VAL HA H 1 5.667 . . 1 . . . . 6 VAL HA . 15208 1 31 . 1 1 5 5 VAL HB H 1 2.409 . . 1 . . . . 6 VAL HB . 15208 1 32 . 1 1 5 5 VAL HG11 H 1 0.775 . . 2 . . . . 6 VAL QG1 . 15208 1 33 . 1 1 5 5 VAL HG12 H 1 0.775 . . 2 . . . . 6 VAL QG1 . 15208 1 34 . 1 1 5 5 VAL HG13 H 1 0.775 . . 2 . . . . 6 VAL QG1 . 15208 1 35 . 1 1 5 5 VAL HG21 H 1 0.714 . . 2 . . . . 6 VAL QG2 . 15208 1 36 . 1 1 5 5 VAL HG22 H 1 0.714 . . 2 . . . . 6 VAL QG2 . 15208 1 37 . 1 1 5 5 VAL HG23 H 1 0.714 . . 2 . . . . 6 VAL QG2 . 15208 1 38 . 1 1 5 5 VAL C C 13 175.507 . . 1 . . . . 6 VAL C . 15208 1 39 . 1 1 5 5 VAL CA C 13 57.440 . . 1 . . . . 6 VAL CA . 15208 1 40 . 1 1 5 5 VAL CB C 13 34.791 . . 1 . . . . 6 VAL CB . 15208 1 41 . 1 1 5 5 VAL CG1 C 13 22.012 . . 2 . . . . 6 VAL CG1 . 15208 1 42 . 1 1 5 5 VAL CG2 C 13 18.427 . . 2 . . . . 6 VAL CG2 . 15208 1 43 . 1 1 5 5 VAL N N 15 105.881 . . 1 . . . . 6 VAL N . 15208 1 44 . 1 1 6 6 GLU H H 1 8.036 . . 1 . . . . 7 GLU HN . 15208 1 45 . 1 1 6 6 GLU HA H 1 4.090 . . 1 . . . . 7 GLU HA . 15208 1 46 . 1 1 6 6 GLU HB2 H 1 2.345 . . 2 . . . . 7 GLU HB2 . 15208 1 47 . 1 1 6 6 GLU HB3 H 1 1.971 . . 2 . . . . 7 GLU HB3 . 15208 1 48 . 1 1 6 6 GLU HG2 H 1 2.252 . . 2 . . . . 7 GLU HG2 . 15208 1 49 . 1 1 6 6 GLU HG3 H 1 2.142 . . 2 . . . . 7 GLU HG3 . 15208 1 50 . 1 1 6 6 GLU C C 13 177.814 . . 1 . . . . 7 GLU C . 15208 1 51 . 1 1 6 6 GLU CA C 13 58.685 . . 1 . . . . 7 GLU CA . 15208 1 52 . 1 1 6 6 GLU CB C 13 29.103 . . 1 . . . . 7 GLU CB . 15208 1 53 . 1 1 6 6 GLU CG C 13 36.332 . . 1 . . . . 7 GLU CG . 15208 1 54 . 1 1 6 6 GLU N N 15 123.388 . . 1 . . . . 7 GLU N . 15208 1 55 . 1 1 7 7 LYS H H 1 9.037 . . 1 . . . . 8 LYS HN . 15208 1 56 . 1 1 7 7 LYS HA H 1 4.607 . . 1 . . . . 8 LYS HA . 15208 1 57 . 1 1 7 7 LYS HB2 H 1 1.789 . . 2 . . . . 8 LYS HB2 . 15208 1 58 . 1 1 7 7 LYS HB3 H 1 1.701 . . 2 . . . . 8 LYS HB3 . 15208 1 59 . 1 1 7 7 LYS HG2 H 1 1.451 . . 2 . . . . 8 LYS HG2 . 15208 1 60 . 1 1 7 7 LYS HG3 H 1 1.376 . . 2 . . . . 8 LYS HG3 . 15208 1 61 . 1 1 7 7 LYS HD2 H 1 1.781 . . 1 . . . . 8 LYS QD . 15208 1 62 . 1 1 7 7 LYS HD3 H 1 1.781 . . 1 . . . . 8 LYS QD . 15208 1 63 . 1 1 7 7 LYS HE2 H 1 3.069 . . 1 . . . . 8 LYS QE . 15208 1 64 . 1 1 7 7 LYS HE3 H 1 3.069 . . 1 . . . . 8 LYS QE . 15208 1 65 . 1 1 7 7 LYS C C 13 174.744 . . 1 . . . . 8 LYS C . 15208 1 66 . 1 1 7 7 LYS CA C 13 53.936 . . 1 . . . . 8 LYS CA . 15208 1 67 . 1 1 7 7 LYS CB C 13 35.644 . . 1 . . . . 8 LYS CB . 15208 1 68 . 1 1 7 7 LYS CG C 13 24.657 . . 1 . . . . 8 LYS CG . 15208 1 69 . 1 1 7 7 LYS CD C 13 28.900 . . 1 . . . . 8 LYS CD . 15208 1 70 . 1 1 7 7 LYS CE C 13 42.050 . . 1 . . . . 8 LYS CE . 15208 1 71 . 1 1 7 7 LYS N N 15 119.746 . . 1 . . . . 8 LYS N . 15208 1 72 . 1 1 8 8 GLU H H 1 8.907 . . 1 . . . . 9 GLU HN . 15208 1 73 . 1 1 8 8 GLU HA H 1 4.131 . . 1 . . . . 9 GLU HA . 15208 1 74 . 1 1 8 8 GLU HB2 H 1 2.082 . . 1 . . . . 9 GLU QB . 15208 1 75 . 1 1 8 8 GLU HB3 H 1 2.082 . . 1 . . . . 9 GLU QB . 15208 1 76 . 1 1 8 8 GLU HG2 H 1 2.490 . . 2 . . . . 9 GLU HG2 . 15208 1 77 . 1 1 8 8 GLU HG3 H 1 2.045 . . 2 . . . . 9 GLU HG3 . 15208 1 78 . 1 1 8 8 GLU C C 13 176.912 . . 1 . . . . 9 GLU C . 15208 1 79 . 1 1 8 8 GLU CA C 13 57.024 . . 1 . . . . 9 GLU CA . 15208 1 80 . 1 1 8 8 GLU CB C 13 30.082 . . 1 . . . . 9 GLU CB . 15208 1 81 . 1 1 8 8 GLU CG C 13 36.792 . . 1 . . . . 9 GLU CG . 15208 1 82 . 1 1 8 8 GLU N N 15 124.302 . . 1 . . . . 9 GLU N . 15208 1 83 . 1 1 9 9 TYR H H 1 9.063 . . 1 . . . . 10 TYR HN . 15208 1 84 . 1 1 9 9 TYR HA H 1 3.887 . . 1 . . . . 10 TYR HA . 15208 1 85 . 1 1 9 9 TYR HB2 H 1 3.337 . . 2 . . . . 10 TYR HB2 . 15208 1 86 . 1 1 9 9 TYR HB3 H 1 2.711 . . 2 . . . . 10 TYR HB3 . 15208 1 87 . 1 1 9 9 TYR HD1 H 1 6.848 . . 1 . . . . 10 TYR QD . 15208 1 88 . 1 1 9 9 TYR HD2 H 1 6.848 . . 1 . . . . 10 TYR QD . 15208 1 89 . 1 1 9 9 TYR HE1 H 1 6.794 . . 1 . . . . 10 TYR QE . 15208 1 90 . 1 1 9 9 TYR HE2 H 1 6.794 . . 1 . . . . 10 TYR QE . 15208 1 91 . 1 1 9 9 TYR C C 13 171.330 . . 1 . . . . 10 TYR C . 15208 1 92 . 1 1 9 9 TYR CA C 13 57.929 . . 1 . . . . 10 TYR CA . 15208 1 93 . 1 1 9 9 TYR CB C 13 36.725 . . 1 . . . . 10 TYR CB . 15208 1 94 . 1 1 9 9 TYR CD1 C 13 133.768 . . 2 . . . . 10 TYR CD1 . 15208 1 95 . 1 1 9 9 TYR CE1 C 13 118.065 . . 2 . . . . 10 TYR CE1 . 15208 1 96 . 1 1 9 9 TYR N N 15 117.009 . . 1 . . . . 10 TYR N . 15208 1 97 . 1 1 10 10 PRO HA H 1 4.268 . . 1 . . . . 11 PRO HA . 15208 1 98 . 1 1 10 10 PRO HB2 H 1 2.116 . . 2 . . . . 11 PRO HB2 . 15208 1 99 . 1 1 10 10 PRO HB3 H 1 1.944 . . 2 . . . . 11 PRO HB3 . 15208 1 100 . 1 1 10 10 PRO HG2 H 1 2.088 . . 2 . . . . 11 PRO HG2 . 15208 1 101 . 1 1 10 10 PRO HG3 H 1 1.996 . . 2 . . . . 11 PRO HG3 . 15208 1 102 . 1 1 10 10 PRO HD2 H 1 3.944 . . 2 . . . . 11 PRO HD2 . 15208 1 103 . 1 1 10 10 PRO HD3 H 1 3.166 . . 2 . . . . 11 PRO HD3 . 15208 1 104 . 1 1 10 10 PRO C C 13 176.062 . . 1 . . . . 11 PRO C . 15208 1 105 . 1 1 10 10 PRO CA C 13 62.990 . . 1 . . . . 11 PRO CA . 15208 1 106 . 1 1 10 10 PRO CB C 13 31.424 . . 1 . . . . 11 PRO CB . 15208 1 107 . 1 1 10 10 PRO CG C 13 27.735 . . 1 . . . . 11 PRO CG . 15208 1 108 . 1 1 10 10 PRO CD C 13 50.318 . . 1 . . . . 11 PRO CD . 15208 1 109 . 1 1 11 11 ASN H H 1 8.776 . . 1 . . . . 12 ASN HN . 15208 1 110 . 1 1 11 11 ASN HA H 1 4.741 . . 1 . . . . 12 ASN HA . 15208 1 111 . 1 1 11 11 ASN HB2 H 1 3.035 . . 2 . . . . 12 ASN HB2 . 15208 1 112 . 1 1 11 11 ASN HB3 H 1 2.948 . . 2 . . . . 12 ASN HB3 . 15208 1 113 . 1 1 11 11 ASN HD21 H 1 7.769 . . 2 . . . . 12 ASN HD21 . 15208 1 114 . 1 1 11 11 ASN HD22 H 1 7.136 . . 2 . . . . 12 ASN HD22 . 15208 1 115 . 1 1 11 11 ASN C C 13 176.947 . . 1 . . . . 12 ASN C . 15208 1 116 . 1 1 11 11 ASN CA C 13 54.517 . . 1 . . . . 12 ASN CA . 15208 1 117 . 1 1 11 11 ASN CB C 13 38.160 . . 1 . . . . 12 ASN CB . 15208 1 118 . 1 1 11 11 ASN N N 15 120.237 . . 1 . . . . 12 ASN N . 15208 1 119 . 1 1 11 11 ASN ND2 N 15 113.207 . . 1 . . . . 12 ASN ND2 . 15208 1 120 . 1 1 12 12 ARG H H 1 8.761 . . 1 . . . . 13 ARG HN . 15208 1 121 . 1 1 12 12 ARG HA H 1 4.679 . . 1 . . . . 13 ARG HA . 15208 1 122 . 1 1 12 12 ARG HB2 H 1 2.223 . . 2 . . . . 13 ARG HB2 . 15208 1 123 . 1 1 12 12 ARG HB3 H 1 1.410 . . 2 . . . . 13 ARG HB3 . 15208 1 124 . 1 1 12 12 ARG HG2 H 1 1.783 . . 2 . . . . 13 ARG HG2 . 15208 1 125 . 1 1 12 12 ARG HG3 H 1 1.594 . . 2 . . . . 13 ARG HG3 . 15208 1 126 . 1 1 12 12 ARG HD2 H 1 2.853 . . 1 . . . . 13 ARG QD . 15208 1 127 . 1 1 12 12 ARG HD3 H 1 2.853 . . 1 . . . . 13 ARG QD . 15208 1 128 . 1 1 12 12 ARG HE H 1 7.113 . . 1 . . . . 13 ARG HE . 15208 1 129 . 1 1 12 12 ARG C C 13 177.502 . . 1 . . . . 13 ARG C . 15208 1 130 . 1 1 12 12 ARG CA C 13 52.345 . . 1 . . . . 13 ARG CA . 15208 1 131 . 1 1 12 12 ARG CB C 13 28.385 . . 1 . . . . 13 ARG CB . 15208 1 132 . 1 1 12 12 ARG CG C 13 25.961 . . 1 . . . . 13 ARG CG . 15208 1 133 . 1 1 12 12 ARG CD C 13 40.024 . . 1 . . . . 13 ARG CD . 15208 1 134 . 1 1 12 12 ARG N N 15 126.676 . . 1 . . . . 13 ARG N . 15208 1 135 . 1 1 12 12 ARG NE N 15 79.951 . . 1 . . . . 13 ARG NE . 15208 1 136 . 1 1 13 13 GLY H H 1 8.651 . . 1 . . . . 14 GLY HN . 15208 1 137 . 1 1 13 13 GLY HA2 H 1 4.032 . . 2 . . . . 14 GLY HA2 . 15208 1 138 . 1 1 13 13 GLY HA3 H 1 3.749 . . 2 . . . . 14 GLY HA3 . 15208 1 139 . 1 1 13 13 GLY C C 13 173.635 . . 1 . . . . 14 GLY C . 15208 1 140 . 1 1 13 13 GLY CA C 13 47.886 . . 1 . . . . 14 GLY CA . 15208 1 141 . 1 1 13 13 GLY N N 15 110.822 . . 1 . . . . 14 GLY N . 15208 1 142 . 1 1 14 14 ASN H H 1 8.636 . . 1 . . . . 15 ASN HN . 15208 1 143 . 1 1 14 14 ASN HA H 1 5.323 . . 1 . . . . 15 ASN HA . 15208 1 144 . 1 1 14 14 ASN HB2 H 1 2.940 . . 1 . . . . 15 ASN QB . 15208 1 145 . 1 1 14 14 ASN HB3 H 1 2.940 . . 1 . . . . 15 ASN QB . 15208 1 146 . 1 1 14 14 ASN HD21 H 1 7.760 . . 2 . . . . 15 ASN HD21 . 15208 1 147 . 1 1 14 14 ASN HD22 H 1 6.838 . . 2 . . . . 15 ASN HD22 . 15208 1 148 . 1 1 14 14 ASN C C 13 175.053 . . 1 . . . . 15 ASN C . 15208 1 149 . 1 1 14 14 ASN CA C 13 52.131 . . 1 . . . . 15 ASN CA . 15208 1 150 . 1 1 14 14 ASN CB C 13 39.351 . . 1 . . . . 15 ASN CB . 15208 1 151 . 1 1 14 14 ASN N N 15 126.017 . . 1 . . . . 15 ASN N . 15208 1 152 . 1 1 14 14 ASN ND2 N 15 111.850 . . 1 . . . . 15 ASN ND2 . 15208 1 153 . 1 1 15 15 THR H H 1 7.842 . . 1 . . . . 16 THR HN . 15208 1 154 . 1 1 15 15 THR HA H 1 3.930 . . 1 . . . . 16 THR HA . 15208 1 155 . 1 1 15 15 THR HB H 1 4.226 . . 1 . . . . 16 THR HB . 15208 1 156 . 1 1 15 15 THR HG21 H 1 1.103 . . 1 . . . . 16 THR QG2 . 15208 1 157 . 1 1 15 15 THR HG22 H 1 1.103 . . 1 . . . . 16 THR QG2 . 15208 1 158 . 1 1 15 15 THR HG23 H 1 1.103 . . 1 . . . . 16 THR QG2 . 15208 1 159 . 1 1 15 15 THR C C 13 170.825 . . 1 . . . . 16 THR C . 15208 1 160 . 1 1 15 15 THR CA C 13 62.905 . . 1 . . . . 16 THR CA . 15208 1 161 . 1 1 15 15 THR CB C 13 68.787 . . 1 . . . . 16 THR CB . 15208 1 162 . 1 1 15 15 THR CG2 C 13 21.329 . . 1 . . . . 16 THR CG2 . 15208 1 163 . 1 1 15 15 THR N N 15 119.535 . . 1 . . . . 16 THR N . 15208 1 164 . 1 1 16 16 CYS H H 1 7.922 . . 1 . . . . 17 CYS HN . 15208 1 165 . 1 1 16 16 CYS HA H 1 4.503 . . 1 . . . . 17 CYS HA . 15208 1 166 . 1 1 16 16 CYS HB2 H 1 3.118 . . 2 . . . . 17 CYS HB2 . 15208 1 167 . 1 1 16 16 CYS HB3 H 1 2.510 . . 2 . . . . 17 CYS HB3 . 15208 1 168 . 1 1 16 16 CYS C C 13 173.791 . . 1 . . . . 17 CYS C . 15208 1 169 . 1 1 16 16 CYS CA C 13 57.316 . . 1 . . . . 17 CYS CA . 15208 1 170 . 1 1 16 16 CYS CB C 13 28.524 . . 1 . . . . 17 CYS CB . 15208 1 171 . 1 1 16 16 CYS N N 15 122.474 . . 1 . . . . 17 CYS N . 15208 1 172 . 1 1 17 17 LEU H H 1 8.517 . . 1 . . . . 18 LEU HN . 15208 1 173 . 1 1 17 17 LEU HA H 1 4.734 . . 1 . . . . 18 LEU HA . 15208 1 174 . 1 1 17 17 LEU HB2 H 1 2.072 . . 2 . . . . 18 LEU HB2 . 15208 1 175 . 1 1 17 17 LEU HB3 H 1 1.721 . . 2 . . . . 18 LEU HB3 . 15208 1 176 . 1 1 17 17 LEU HG H 1 1.466 . . 1 . . . . 18 LEU HG . 15208 1 177 . 1 1 17 17 LEU HD11 H 1 0.860 . . 2 . . . . 18 LEU QD1 . 15208 1 178 . 1 1 17 17 LEU HD12 H 1 0.860 . . 2 . . . . 18 LEU QD1 . 15208 1 179 . 1 1 17 17 LEU HD13 H 1 0.860 . . 2 . . . . 18 LEU QD1 . 15208 1 180 . 1 1 17 17 LEU HD21 H 1 0.803 . . 2 . . . . 18 LEU QD2 . 15208 1 181 . 1 1 17 17 LEU HD22 H 1 0.803 . . 2 . . . . 18 LEU QD2 . 15208 1 182 . 1 1 17 17 LEU HD23 H 1 0.803 . . 2 . . . . 18 LEU QD2 . 15208 1 183 . 1 1 17 17 LEU C C 13 175.813 . . 1 . . . . 18 LEU C . 15208 1 184 . 1 1 17 17 LEU CA C 13 54.516 . . 1 . . . . 18 LEU CA . 15208 1 185 . 1 1 17 17 LEU CB C 13 43.706 . . 1 . . . . 18 LEU CB . 15208 1 186 . 1 1 17 17 LEU CG C 13 27.124 . . 1 . . . . 18 LEU CG . 15208 1 187 . 1 1 17 17 LEU CD1 C 13 25.326 . . 2 . . . . 18 LEU CD1 . 15208 1 188 . 1 1 17 17 LEU CD2 C 13 23.684 . . 2 . . . . 18 LEU CD2 . 15208 1 189 . 1 1 17 17 LEU N N 15 126.322 . . 1 . . . . 18 LEU N . 15208 1 190 . 1 1 18 18 GLU H H 1 8.906 . . 1 . . . . 19 GLU HN . 15208 1 191 . 1 1 18 18 GLU HA H 1 3.740 . . 1 . . . . 19 GLU HA . 15208 1 192 . 1 1 18 18 GLU HB2 H 1 1.527 . . 2 . . . . 19 GLU HB2 . 15208 1 193 . 1 1 18 18 GLU HB3 H 1 0.546 . . 2 . . . . 19 GLU HB3 . 15208 1 194 . 1 1 18 18 GLU HG2 H 1 1.900 . . 2 . . . . 19 GLU HG2 . 15208 1 195 . 1 1 18 18 GLU HG3 H 1 1.792 . . 2 . . . . 19 GLU HG3 . 15208 1 196 . 1 1 18 18 GLU C C 13 172.401 . . 1 . . . . 19 GLU C . 15208 1 197 . 1 1 18 18 GLU CA C 13 54.921 . . 1 . . . . 19 GLU CA . 15208 1 198 . 1 1 18 18 GLU CB C 13 29.201 . . 1 . . . . 19 GLU CB . 15208 1 199 . 1 1 18 18 GLU CG C 13 35.000 . . 1 . . . . 19 GLU CG . 15208 1 200 . 1 1 18 18 GLU N N 15 123.469 . . 1 . . . . 19 GLU N . 15208 1 201 . 1 1 19 19 ASN H H 1 7.289 . . 1 . . . . 20 ASN HN . 15208 1 202 . 1 1 19 19 ASN HA H 1 4.546 . . 1 . . . . 20 ASN HA . 15208 1 203 . 1 1 19 19 ASN HB2 H 1 2.475 . . 1 . . . . 20 ASN QB . 15208 1 204 . 1 1 19 19 ASN HB3 H 1 2.475 . . 1 . . . . 20 ASN QB . 15208 1 205 . 1 1 19 19 ASN HD21 H 1 7.556 . . 2 . . . . 20 ASN HD21 . 15208 1 206 . 1 1 19 19 ASN HD22 H 1 6.709 . . 2 . . . . 20 ASN HD22 . 15208 1 207 . 1 1 19 19 ASN C C 13 175.661 . . 1 . . . . 20 ASN C . 15208 1 208 . 1 1 19 19 ASN CA C 13 51.197 . . 1 . . . . 20 ASN CA . 15208 1 209 . 1 1 19 19 ASN CB C 13 41.459 . . 1 . . . . 20 ASN CB . 15208 1 210 . 1 1 19 19 ASN N N 15 115.306 . . 1 . . . . 20 ASN N . 15208 1 211 . 1 1 19 19 ASN ND2 N 15 113.707 . . 1 . . . . 20 ASN ND2 . 15208 1 212 . 1 1 20 20 GLY H H 1 7.588 . . 1 . . . . 21 GLY HN . 15208 1 213 . 1 1 20 20 GLY HA2 H 1 4.251 . . 2 . . . . 21 GLY HA2 . 15208 1 214 . 1 1 20 20 GLY HA3 H 1 3.785 . . 2 . . . . 21 GLY HA3 . 15208 1 215 . 1 1 20 20 GLY C C 13 174.045 . . 1 . . . . 21 GLY C . 15208 1 216 . 1 1 20 20 GLY CA C 13 44.551 . . 1 . . . . 21 GLY CA . 15208 1 217 . 1 1 20 20 GLY N N 15 104.753 . . 1 . . . . 21 GLY N . 15208 1 218 . 1 1 21 21 SER H H 1 8.239 . . 1 . . . . 22 SER HN . 15208 1 219 . 1 1 21 21 SER HA H 1 4.854 . . 1 . . . . 22 SER HA . 15208 1 220 . 1 1 21 21 SER HB2 H 1 3.611 . . 2 . . . . 22 SER HB2 . 15208 1 221 . 1 1 21 21 SER HB3 H 1 3.514 . . 2 . . . . 22 SER HB3 . 15208 1 222 . 1 1 21 21 SER C C 13 173.202 . . 1 . . . . 22 SER C . 15208 1 223 . 1 1 21 21 SER CA C 13 57.545 . . 1 . . . . 22 SER CA . 15208 1 224 . 1 1 21 21 SER CB C 13 65.916 . . 1 . . . . 22 SER CB . 15208 1 225 . 1 1 21 21 SER N N 15 111.425 . . 1 . . . . 22 SER N . 15208 1 226 . 1 1 22 22 PHE H H 1 7.647 . . 1 . . . . 23 PHE HN . 15208 1 227 . 1 1 22 22 PHE HA H 1 5.245 . . 1 . . . . 23 PHE HA . 15208 1 228 . 1 1 22 22 PHE HB2 H 1 3.473 . . 2 . . . . 23 PHE HB2 . 15208 1 229 . 1 1 22 22 PHE HB3 H 1 3.242 . . 2 . . . . 23 PHE HB3 . 15208 1 230 . 1 1 22 22 PHE HD1 H 1 7.551 . . 1 . . . . 23 PHE QD . 15208 1 231 . 1 1 22 22 PHE HD2 H 1 7.551 . . 1 . . . . 23 PHE QD . 15208 1 232 . 1 1 22 22 PHE HE1 H 1 7.310 . . 1 . . . . 23 PHE QE . 15208 1 233 . 1 1 22 22 PHE HE2 H 1 7.310 . . 1 . . . . 23 PHE QE . 15208 1 234 . 1 1 22 22 PHE HZ H 1 7.311 . . 1 . . . . 23 PHE HZ . 15208 1 235 . 1 1 22 22 PHE C C 13 174.382 . . 1 . . . . 23 PHE C . 15208 1 236 . 1 1 22 22 PHE CA C 13 53.852 . . 1 . . . . 23 PHE CA . 15208 1 237 . 1 1 22 22 PHE CB C 13 38.016 . . 1 . . . . 23 PHE CB . 15208 1 238 . 1 1 22 22 PHE CD1 C 13 130.330 . . 2 . . . . 23 PHE CD1 . 15208 1 239 . 1 1 22 22 PHE CE1 C 13 131.273 . . 2 . . . . 23 PHE CE1 . 15208 1 240 . 1 1 22 22 PHE CZ C 13 129.972 . . 1 . . . . 23 PHE CZ . 15208 1 241 . 1 1 22 22 PHE N N 15 128.100 . . 1 . . . . 23 PHE N . 15208 1 242 . 1 1 23 23 LEU H H 1 7.873 . . 1 . . . . 24 LEU HN . 15208 1 243 . 1 1 23 23 LEU HA H 1 3.859 . . 1 . . . . 24 LEU HA . 15208 1 244 . 1 1 23 23 LEU HB2 H 1 1.790 . . 2 . . . . 24 LEU HB2 . 15208 1 245 . 1 1 23 23 LEU HB3 H 1 1.693 . . 2 . . . . 24 LEU HB3 . 15208 1 246 . 1 1 23 23 LEU HG H 1 1.776 . . 1 . . . . 24 LEU HG . 15208 1 247 . 1 1 23 23 LEU HD11 H 1 1.073 . . 2 . . . . 24 LEU QD1 . 15208 1 248 . 1 1 23 23 LEU HD12 H 1 1.073 . . 2 . . . . 24 LEU QD1 . 15208 1 249 . 1 1 23 23 LEU HD13 H 1 1.073 . . 2 . . . . 24 LEU QD1 . 15208 1 250 . 1 1 23 23 LEU HD21 H 1 0.911 . . 2 . . . . 24 LEU QD2 . 15208 1 251 . 1 1 23 23 LEU HD22 H 1 0.911 . . 2 . . . . 24 LEU QD2 . 15208 1 252 . 1 1 23 23 LEU HD23 H 1 0.911 . . 2 . . . . 24 LEU QD2 . 15208 1 253 . 1 1 23 23 LEU C C 13 178.892 . . 1 . . . . 24 LEU C . 15208 1 254 . 1 1 23 23 LEU CA C 13 57.955 . . 1 . . . . 24 LEU CA . 15208 1 255 . 1 1 23 23 LEU CB C 13 41.371 . . 1 . . . . 24 LEU CB . 15208 1 256 . 1 1 23 23 LEU CG C 13 27.199 . . 1 . . . . 24 LEU CG . 15208 1 257 . 1 1 23 23 LEU CD1 C 13 24.995 . . 2 . . . . 24 LEU CD1 . 15208 1 258 . 1 1 23 23 LEU CD2 C 13 23.746 . . 2 . . . . 24 LEU CD2 . 15208 1 259 . 1 1 23 23 LEU N N 15 127.220 . . 1 . . . . 24 LEU N . 15208 1 260 . 1 1 24 24 LEU H H 1 7.600 . . 1 . . . . 25 LEU HN . 15208 1 261 . 1 1 24 24 LEU HA H 1 3.918 . . 1 . . . . 25 LEU HA . 15208 1 262 . 1 1 24 24 LEU HB2 H 1 1.152 . . 2 . . . . 25 LEU HB2 . 15208 1 263 . 1 1 24 24 LEU HB3 H 1 1.056 . . 2 . . . . 25 LEU HB3 . 15208 1 264 . 1 1 24 24 LEU HG H 1 1.520 . . 1 . . . . 25 LEU HG . 15208 1 265 . 1 1 24 24 LEU HD11 H 1 0.902 . . 2 . . . . 25 LEU QD1 . 15208 1 266 . 1 1 24 24 LEU HD12 H 1 0.902 . . 2 . . . . 25 LEU QD1 . 15208 1 267 . 1 1 24 24 LEU HD13 H 1 0.902 . . 2 . . . . 25 LEU QD1 . 15208 1 268 . 1 1 24 24 LEU HD21 H 1 0.858 . . 2 . . . . 25 LEU QD2 . 15208 1 269 . 1 1 24 24 LEU HD22 H 1 0.858 . . 2 . . . . 25 LEU QD2 . 15208 1 270 . 1 1 24 24 LEU HD23 H 1 0.858 . . 2 . . . . 25 LEU QD2 . 15208 1 271 . 1 1 24 24 LEU C C 13 176.990 . . 1 . . . . 25 LEU C . 15208 1 272 . 1 1 24 24 LEU CA C 13 56.837 . . 1 . . . . 25 LEU CA . 15208 1 273 . 1 1 24 24 LEU CB C 13 41.668 . . 1 . . . . 25 LEU CB . 15208 1 274 . 1 1 24 24 LEU CG C 13 26.892 . . 1 . . . . 25 LEU CG . 15208 1 275 . 1 1 24 24 LEU CD1 C 13 24.511 . . 2 . . . . 25 LEU CD1 . 15208 1 276 . 1 1 24 24 LEU CD2 C 13 24.150 . . 2 . . . . 25 LEU CD2 . 15208 1 277 . 1 1 24 24 LEU N N 15 117.485 . . 1 . . . . 25 LEU N . 15208 1 278 . 1 1 25 25 ASN H H 1 6.800 . . 1 . . . . 26 ASN HN . 15208 1 279 . 1 1 25 25 ASN HA H 1 4.878 . . 1 . . . . 26 ASN HA . 15208 1 280 . 1 1 25 25 ASN HB2 H 1 2.726 . . 2 . . . . 26 ASN HB2 . 15208 1 281 . 1 1 25 25 ASN HB3 H 1 2.124 . . 2 . . . . 26 ASN HB3 . 15208 1 282 . 1 1 25 25 ASN HD21 H 1 9.114 . . 2 . . . . 26 ASN HD21 . 15208 1 283 . 1 1 25 25 ASN HD22 H 1 8.664 . . 2 . . . . 26 ASN HD22 . 15208 1 284 . 1 1 25 25 ASN C C 13 173.416 . . 1 . . . . 26 ASN C . 15208 1 285 . 1 1 25 25 ASN CA C 13 51.460 . . 1 . . . . 26 ASN CA . 15208 1 286 . 1 1 25 25 ASN CB C 13 40.992 . . 1 . . . . 26 ASN CB . 15208 1 287 . 1 1 25 25 ASN N N 15 112.749 . . 1 . . . . 26 ASN N . 15208 1 288 . 1 1 25 25 ASN ND2 N 15 117.413 . . 1 . . . . 26 ASN ND2 . 15208 1 289 . 1 1 26 26 PHE H H 1 7.677 . . 1 . . . . 27 PHE HN . 15208 1 290 . 1 1 26 26 PHE HA H 1 5.245 . . 1 . . . . 27 PHE HA . 15208 1 291 . 1 1 26 26 PHE HB2 H 1 3.445 . . 2 . . . . 27 PHE HB2 . 15208 1 292 . 1 1 26 26 PHE HB3 H 1 2.835 . . 2 . . . . 27 PHE HB3 . 15208 1 293 . 1 1 26 26 PHE HD1 H 1 7.487 . . 1 . . . . 27 PHE QD . 15208 1 294 . 1 1 26 26 PHE HD2 H 1 7.487 . . 1 . . . . 27 PHE QD . 15208 1 295 . 1 1 26 26 PHE HE1 H 1 7.493 . . 1 . . . . 27 PHE QE . 15208 1 296 . 1 1 26 26 PHE HE2 H 1 7.493 . . 1 . . . . 27 PHE QE . 15208 1 297 . 1 1 26 26 PHE C C 13 175.360 . . 1 . . . . 27 PHE C . 15208 1 298 . 1 1 26 26 PHE CA C 13 53.903 . . 1 . . . . 27 PHE CA . 15208 1 299 . 1 1 26 26 PHE CB C 13 39.604 . . 1 . . . . 27 PHE CB . 15208 1 300 . 1 1 26 26 PHE CD1 C 13 131.675 . . 2 . . . . 27 PHE CD1 . 15208 1 301 . 1 1 26 26 PHE CE1 C 13 131.457 . . 2 . . . . 27 PHE CE1 . 15208 1 302 . 1 1 26 26 PHE N N 15 119.839 . . 1 . . . . 27 PHE N . 15208 1 303 . 1 1 27 27 THR H H 1 8.838 . . 1 . . . . 28 THR HN . 15208 1 304 . 1 1 27 27 THR HA H 1 4.104 . . 1 . . . . 28 THR HA . 15208 1 305 . 1 1 27 27 THR HB H 1 4.166 . . 1 . . . . 28 THR HB . 15208 1 306 . 1 1 27 27 THR HG21 H 1 0.971 . . 1 . . . . 28 THR QG2 . 15208 1 307 . 1 1 27 27 THR HG22 H 1 0.971 . . 1 . . . . 28 THR QG2 . 15208 1 308 . 1 1 27 27 THR HG23 H 1 0.971 . . 1 . . . . 28 THR QG2 . 15208 1 309 . 1 1 27 27 THR C C 13 174.202 . . 1 . . . . 28 THR C . 15208 1 310 . 1 1 27 27 THR CA C 13 61.959 . . 1 . . . . 28 THR CA . 15208 1 311 . 1 1 27 27 THR CB C 13 67.687 . . 1 . . . . 28 THR CB . 15208 1 312 . 1 1 27 27 THR CG2 C 13 21.920 . . 1 . . . . 28 THR CG2 . 15208 1 313 . 1 1 27 27 THR N N 15 121.155 . . 1 . . . . 28 THR N . 15208 1 314 . 1 1 28 28 GLY H H 1 5.553 . . 1 . . . . 29 GLY HN . 15208 1 315 . 1 1 28 28 GLY HA2 H 1 4.025 . . 2 . . . . 29 GLY HA2 . 15208 1 316 . 1 1 28 28 GLY HA3 H 1 2.318 . . 2 . . . . 29 GLY HA3 . 15208 1 317 . 1 1 28 28 GLY C C 13 171.257 . . 1 . . . . 29 GLY C . 15208 1 318 . 1 1 28 28 GLY CA C 13 43.353 . . 1 . . . . 29 GLY CA . 15208 1 319 . 1 1 28 28 GLY N N 15 107.843 . . 1 . . . . 29 GLY N . 15208 1 320 . 1 1 29 29 CYS H H 1 8.008 . . 1 . . . . 30 CYS HN . 15208 1 321 . 1 1 29 29 CYS HA H 1 4.973 . . 1 . . . . 30 CYS HA . 15208 1 322 . 1 1 29 29 CYS HB2 H 1 3.368 . . 2 . . . . 30 CYS HB2 . 15208 1 323 . 1 1 29 29 CYS HB3 H 1 3.229 . . 2 . . . . 30 CYS HB3 . 15208 1 324 . 1 1 29 29 CYS C C 13 178.734 . . 1 . . . . 30 CYS C . 15208 1 325 . 1 1 29 29 CYS CA C 13 60.143 . . 1 . . . . 30 CYS CA . 15208 1 326 . 1 1 29 29 CYS CB C 13 31.851 . . 1 . . . . 30 CYS CB . 15208 1 327 . 1 1 29 29 CYS N N 15 125.343 . . 1 . . . . 30 CYS N . 15208 1 328 . 1 1 30 30 ALA H H 1 9.710 . . 1 . . . . 31 ALA HN . 15208 1 329 . 1 1 30 30 ALA HA H 1 3.940 . . 1 . . . . 31 ALA HA . 15208 1 330 . 1 1 30 30 ALA HB1 H 1 1.270 . . 1 . . . . 31 ALA QB . 15208 1 331 . 1 1 30 30 ALA HB2 H 1 1.270 . . 1 . . . . 31 ALA QB . 15208 1 332 . 1 1 30 30 ALA HB3 H 1 1.270 . . 1 . . . . 31 ALA QB . 15208 1 333 . 1 1 30 30 ALA C C 13 177.777 . . 1 . . . . 31 ALA C . 15208 1 334 . 1 1 30 30 ALA CA C 13 54.324 . . 1 . . . . 31 ALA CA . 15208 1 335 . 1 1 30 30 ALA CB C 13 21.349 . . 1 . . . . 31 ALA CB . 15208 1 336 . 1 1 30 30 ALA N N 15 136.626 . . 1 . . . . 31 ALA N . 15208 1 337 . 1 1 31 31 VAL H H 1 8.922 . . 1 . . . . 32 VAL HN . 15208 1 338 . 1 1 31 31 VAL HA H 1 3.759 . . 1 . . . . 32 VAL HA . 15208 1 339 . 1 1 31 31 VAL HB H 1 2.292 . . 1 . . . . 32 VAL HB . 15208 1 340 . 1 1 31 31 VAL HG11 H 1 0.848 . . 2 . . . . 32 VAL QG1 . 15208 1 341 . 1 1 31 31 VAL HG12 H 1 0.848 . . 2 . . . . 32 VAL QG1 . 15208 1 342 . 1 1 31 31 VAL HG13 H 1 0.848 . . 2 . . . . 32 VAL QG1 . 15208 1 343 . 1 1 31 31 VAL HG21 H 1 0.376 . . 2 . . . . 32 VAL QG2 . 15208 1 344 . 1 1 31 31 VAL HG22 H 1 0.376 . . 2 . . . . 32 VAL QG2 . 15208 1 345 . 1 1 31 31 VAL HG23 H 1 0.376 . . 2 . . . . 32 VAL QG2 . 15208 1 346 . 1 1 31 31 VAL C C 13 177.748 . . 1 . . . . 32 VAL C . 15208 1 347 . 1 1 31 31 VAL CA C 13 65.235 . . 1 . . . . 32 VAL CA . 15208 1 348 . 1 1 31 31 VAL CB C 13 31.883 . . 1 . . . . 32 VAL CB . 15208 1 349 . 1 1 31 31 VAL CG1 C 13 21.369 . . 2 . . . . 32 VAL CG1 . 15208 1 350 . 1 1 31 31 VAL CG2 C 13 21.287 . . 2 . . . . 32 VAL CG2 . 15208 1 351 . 1 1 31 31 VAL N N 15 120.740 . . 1 . . . . 32 VAL N . 15208 1 352 . 1 1 32 32 CYS H H 1 8.756 . . 1 . . . . 33 CYS HN . 15208 1 353 . 1 1 32 32 CYS HA H 1 4.966 . . 1 . . . . 33 CYS HA . 15208 1 354 . 1 1 32 32 CYS HB2 H 1 3.136 . . 2 . . . . 33 CYS HB2 . 15208 1 355 . 1 1 32 32 CYS HB3 H 1 2.654 . . 2 . . . . 33 CYS HB3 . 15208 1 356 . 1 1 32 32 CYS C C 13 176.876 . . 1 . . . . 33 CYS C . 15208 1 357 . 1 1 32 32 CYS CA C 13 59.072 . . 1 . . . . 33 CYS CA . 15208 1 358 . 1 1 32 32 CYS CB C 13 31.472 . . 1 . . . . 33 CYS CB . 15208 1 359 . 1 1 32 32 CYS N N 15 120.481 . . 1 . . . . 33 CYS N . 15208 1 360 . 1 1 33 33 SER H H 1 8.034 . . 1 . . . . 34 SER HN . 15208 1 361 . 1 1 33 33 SER HA H 1 4.282 . . 1 . . . . 34 SER HA . 15208 1 362 . 1 1 33 33 SER HB2 H 1 4.160 . . 2 . . . . 34 SER HB2 . 15208 1 363 . 1 1 33 33 SER HB3 H 1 3.980 . . 2 . . . . 34 SER HB3 . 15208 1 364 . 1 1 33 33 SER C C 13 173.616 . . 1 . . . . 34 SER C . 15208 1 365 . 1 1 33 33 SER CA C 13 61.111 . . 1 . . . . 34 SER CA . 15208 1 366 . 1 1 33 33 SER CB C 13 62.774 . . 1 . . . . 34 SER CB . 15208 1 367 . 1 1 33 33 SER N N 15 117.116 . . 1 . . . . 34 SER N . 15208 1 368 . 1 1 34 34 LYS H H 1 8.225 . . 1 . . . . 35 LYS HN . 15208 1 369 . 1 1 34 34 LYS HA H 1 4.437 . . 1 . . . . 35 LYS HA . 15208 1 370 . 1 1 34 34 LYS HB2 H 1 2.107 . . 2 . . . . 35 LYS HB2 . 15208 1 371 . 1 1 34 34 LYS HB3 H 1 1.909 . . 2 . . . . 35 LYS HB3 . 15208 1 372 . 1 1 34 34 LYS HG2 H 1 1.568 . . 2 . . . . 35 LYS HG2 . 15208 1 373 . 1 1 34 34 LYS HG3 H 1 1.513 . . 2 . . . . 35 LYS HG3 . 15208 1 374 . 1 1 34 34 LYS HD2 H 1 1.663 . . 1 . . . . 35 LYS QD . 15208 1 375 . 1 1 34 34 LYS HD3 H 1 1.663 . . 1 . . . . 35 LYS QD . 15208 1 376 . 1 1 34 34 LYS HE2 H 1 2.948 . . 1 . . . . 35 LYS QE . 15208 1 377 . 1 1 34 34 LYS HE3 H 1 2.948 . . 1 . . . . 35 LYS QE . 15208 1 378 . 1 1 34 34 LYS CA C 13 56.421 . . 1 . . . . 35 LYS CA . 15208 1 379 . 1 1 34 34 LYS CB C 13 33.431 . . 1 . . . . 35 LYS CB . 15208 1 380 . 1 1 34 34 LYS CG C 13 25.716 . . 1 . . . . 35 LYS CG . 15208 1 381 . 1 1 34 34 LYS CD C 13 28.365 . . 1 . . . . 35 LYS CD . 15208 1 382 . 1 1 34 34 LYS CE C 13 42.110 . . 1 . . . . 35 LYS CE . 15208 1 383 . 1 1 34 34 LYS N N 15 121.866 . . 1 . . . . 35 LYS N . 15208 1 384 . 1 1 35 35 ARG HA H 1 4.426 . . 1 . . . . 36 ARG HA . 15208 1 385 . 1 1 35 35 ARG HB2 H 1 1.816 . . 2 . . . . 36 ARG HB2 . 15208 1 386 . 1 1 35 35 ARG HB3 H 1 1.412 . . 2 . . . . 36 ARG HB3 . 15208 1 387 . 1 1 35 35 ARG HG2 H 1 1.310 . . 2 . . . . 36 ARG HG2 . 15208 1 388 . 1 1 35 35 ARG HG3 H 1 1.125 . . 2 . . . . 36 ARG HG3 . 15208 1 389 . 1 1 35 35 ARG HD2 H 1 3.061 . . 2 . . . . 36 ARG HD2 . 15208 1 390 . 1 1 35 35 ARG HD3 H 1 2.903 . . 2 . . . . 36 ARG HD3 . 15208 1 391 . 1 1 35 35 ARG HE H 1 6.974 . . 1 . . . . 36 ARG HE . 15208 1 392 . 1 1 35 35 ARG C C 13 174.603 . . 1 . . . . 36 ARG C . 15208 1 393 . 1 1 35 35 ARG CA C 13 55.522 . . 1 . . . . 36 ARG CA . 15208 1 394 . 1 1 35 35 ARG CB C 13 31.133 . . 1 . . . . 36 ARG CB . 15208 1 395 . 1 1 35 35 ARG CG C 13 28.552 . . 1 . . . . 36 ARG CG . 15208 1 396 . 1 1 35 35 ARG CD C 13 43.118 . . 1 . . . . 36 ARG CD . 15208 1 397 . 1 1 35 35 ARG NE N 15 84.719 . . 1 . . . . 36 ARG NE . 15208 1 398 . 1 1 36 36 ASP H H 1 7.852 . . 1 . . . . 37 ASP HN . 15208 1 399 . 1 1 36 36 ASP HA H 1 4.689 . . 1 . . . . 37 ASP HA . 15208 1 400 . 1 1 36 36 ASP HB2 H 1 2.706 . . 2 . . . . 37 ASP HB2 . 15208 1 401 . 1 1 36 36 ASP HB3 H 1 2.393 . . 2 . . . . 37 ASP HB3 . 15208 1 402 . 1 1 36 36 ASP C C 13 175.575 . . 1 . . . . 37 ASP C . 15208 1 403 . 1 1 36 36 ASP CA C 13 53.667 . . 1 . . . . 37 ASP CA . 15208 1 404 . 1 1 36 36 ASP CB C 13 42.551 . . 1 . . . . 37 ASP CB . 15208 1 405 . 1 1 36 36 ASP N N 15 120.655 . . 1 . . . . 37 ASP N . 15208 1 406 . 1 1 37 37 PHE H H 1 8.594 . . 1 . . . . 38 PHE HN . 15208 1 407 . 1 1 37 37 PHE HA H 1 4.679 . . 1 . . . . 38 PHE HA . 15208 1 408 . 1 1 37 37 PHE HB2 H 1 3.377 . . 2 . . . . 38 PHE HB2 . 15208 1 409 . 1 1 37 37 PHE HB3 H 1 2.983 . . 2 . . . . 38 PHE HB3 . 15208 1 410 . 1 1 37 37 PHE HD1 H 1 7.352 . . 1 . . . . 38 PHE QD . 15208 1 411 . 1 1 37 37 PHE HD2 H 1 7.352 . . 1 . . . . 38 PHE QD . 15208 1 412 . 1 1 37 37 PHE HE1 H 1 7.406 . . 1 . . . . 38 PHE QE . 15208 1 413 . 1 1 37 37 PHE HE2 H 1 7.406 . . 1 . . . . 38 PHE QE . 15208 1 414 . 1 1 37 37 PHE C C 13 175.074 . . 1 . . . . 38 PHE C . 15208 1 415 . 1 1 37 37 PHE CA C 13 58.216 . . 1 . . . . 38 PHE CA . 15208 1 416 . 1 1 37 37 PHE CB C 13 39.782 . . 1 . . . . 38 PHE CB . 15208 1 417 . 1 1 37 37 PHE CD1 C 13 131.944 . . 2 . . . . 38 PHE CD1 . 15208 1 418 . 1 1 37 37 PHE CE1 C 13 131.505 . . 2 . . . . 38 PHE CE1 . 15208 1 419 . 1 1 37 37 PHE N N 15 118.215 . . 1 . . . . 38 PHE N . 15208 1 420 . 1 1 38 38 MET H H 1 8.266 . . 1 . . . . 39 MET HN . 15208 1 421 . 1 1 38 38 MET HA H 1 4.762 . . 1 . . . . 39 MET HA . 15208 1 422 . 1 1 38 38 MET HB2 H 1 1.894 . . 2 . . . . 39 MET HB2 . 15208 1 423 . 1 1 38 38 MET HB3 H 1 1.778 . . 2 . . . . 39 MET HB3 . 15208 1 424 . 1 1 38 38 MET HG2 H 1 2.200 . . 2 . . . . 39 MET HG2 . 15208 1 425 . 1 1 38 38 MET HG3 H 1 2.094 . . 2 . . . . 39 MET HG3 . 15208 1 426 . 1 1 38 38 MET HE1 H 1 1.278 . . 1 . . . . 39 MET QE . 15208 1 427 . 1 1 38 38 MET HE2 H 1 1.278 . . 1 . . . . 39 MET QE . 15208 1 428 . 1 1 38 38 MET HE3 H 1 1.278 . . 1 . . . . 39 MET QE . 15208 1 429 . 1 1 38 38 MET C C 13 174.574 . . 1 . . . . 39 MET C . 15208 1 430 . 1 1 38 38 MET CA C 13 55.547 . . 1 . . . . 39 MET CA . 15208 1 431 . 1 1 38 38 MET CB C 13 34.861 . . 1 . . . . 39 MET CB . 15208 1 432 . 1 1 38 38 MET CG C 13 32.050 . . 1 . . . . 39 MET CG . 15208 1 433 . 1 1 38 38 MET CE C 13 17.288 . . 1 . . . . 39 MET CE . 15208 1 434 . 1 1 38 38 MET N N 15 120.955 . . 1 . . . . 39 MET N . 15208 1 435 . 1 1 39 39 LEU H H 1 9.162 . . 1 . . . . 40 LEU HN . 15208 1 436 . 1 1 39 39 LEU HA H 1 4.660 . . 1 . . . . 40 LEU HA . 15208 1 437 . 1 1 39 39 LEU HB2 H 1 1.561 . . 2 . . . . 40 LEU HB2 . 15208 1 438 . 1 1 39 39 LEU HB3 H 1 1.468 . . 2 . . . . 40 LEU HB3 . 15208 1 439 . 1 1 39 39 LEU HG H 1 1.426 . . 1 . . . . 40 LEU HG . 15208 1 440 . 1 1 39 39 LEU HD11 H 1 0.917 . . 2 . . . . 40 LEU QD1 . 15208 1 441 . 1 1 39 39 LEU HD12 H 1 0.917 . . 2 . . . . 40 LEU QD1 . 15208 1 442 . 1 1 39 39 LEU HD13 H 1 0.917 . . 2 . . . . 40 LEU QD1 . 15208 1 443 . 1 1 39 39 LEU HD21 H 1 0.871 . . 2 . . . . 40 LEU QD2 . 15208 1 444 . 1 1 39 39 LEU HD22 H 1 0.871 . . 2 . . . . 40 LEU QD2 . 15208 1 445 . 1 1 39 39 LEU HD23 H 1 0.871 . . 2 . . . . 40 LEU QD2 . 15208 1 446 . 1 1 39 39 LEU C C 13 175.561 . . 1 . . . . 40 LEU C . 15208 1 447 . 1 1 39 39 LEU CA C 13 53.571 . . 1 . . . . 40 LEU CA . 15208 1 448 . 1 1 39 39 LEU CB C 13 45.105 . . 1 . . . . 40 LEU CB . 15208 1 449 . 1 1 39 39 LEU CG C 13 26.959 . . 1 . . . . 40 LEU CG . 15208 1 450 . 1 1 39 39 LEU CD1 C 13 24.623 . . 2 . . . . 40 LEU CD1 . 15208 1 451 . 1 1 39 39 LEU CD2 C 13 24.355 . . 2 . . . . 40 LEU CD2 . 15208 1 452 . 1 1 39 39 LEU N N 15 124.963 . . 1 . . . . 40 LEU N . 15208 1 453 . 1 1 40 40 ILE H H 1 8.217 . . 1 . . . . 41 ILE HN . 15208 1 454 . 1 1 40 40 ILE HA H 1 4.977 . . 1 . . . . 41 ILE HA . 15208 1 455 . 1 1 40 40 ILE HB H 1 1.510 . . 1 . . . . 41 ILE HB . 15208 1 456 . 1 1 40 40 ILE HG12 H 1 1.413 . . 9 . . . . 41 ILE HG12 . 15208 1 457 . 1 1 40 40 ILE HG13 H 1 0.812 . . 9 . . . . 41 ILE HG13 . 15208 1 458 . 1 1 40 40 ILE HG21 H 1 0.296 . . 1 . . . . 41 ILE QG2 . 15208 1 459 . 1 1 40 40 ILE HG22 H 1 0.296 . . 1 . . . . 41 ILE QG2 . 15208 1 460 . 1 1 40 40 ILE HG23 H 1 0.296 . . 1 . . . . 41 ILE QG2 . 15208 1 461 . 1 1 40 40 ILE HD11 H 1 0.488 . . 1 . . . . 41 ILE QD1 . 15208 1 462 . 1 1 40 40 ILE HD12 H 1 0.488 . . 1 . . . . 41 ILE QD1 . 15208 1 463 . 1 1 40 40 ILE HD13 H 1 0.488 . . 1 . . . . 41 ILE QD1 . 15208 1 464 . 1 1 40 40 ILE C C 13 176.032 . . 1 . . . . 41 ILE C . 15208 1 465 . 1 1 40 40 ILE CA C 13 60.063 . . 1 . . . . 41 ILE CA . 15208 1 466 . 1 1 40 40 ILE CB C 13 38.520 . . 1 . . . . 41 ILE CB . 15208 1 467 . 1 1 40 40 ILE CG1 C 13 27.363 . . 2 . . . . 41 ILE CG1 . 15208 1 468 . 1 1 40 40 ILE CG2 C 13 16.698 . . 2 . . . . 41 ILE CG2 . 15208 1 469 . 1 1 40 40 ILE CD1 C 13 12.852 . . 1 . . . . 41 ILE CD1 . 15208 1 470 . 1 1 40 40 ILE N N 15 123.813 . . 1 . . . . 41 ILE N . 15208 1 471 . 1 1 41 41 THR H H 1 8.690 . . 1 . . . . 42 THR HN . 15208 1 472 . 1 1 41 41 THR HA H 1 4.709 . . 1 . . . . 42 THR HA . 15208 1 473 . 1 1 41 41 THR HB H 1 4.068 . . 1 . . . . 42 THR HB . 15208 1 474 . 1 1 41 41 THR HG21 H 1 1.064 . . 1 . . . . 42 THR QG2 . 15208 1 475 . 1 1 41 41 THR HG22 H 1 1.064 . . 1 . . . . 42 THR QG2 . 15208 1 476 . 1 1 41 41 THR HG23 H 1 1.064 . . 1 . . . . 42 THR QG2 . 15208 1 477 . 1 1 41 41 THR C C 13 172.415 . . 1 . . . . 42 THR C . 15208 1 478 . 1 1 41 41 THR CA C 13 59.369 . . 1 . . . . 42 THR CA . 15208 1 479 . 1 1 41 41 THR CB C 13 70.156 . . 1 . . . . 42 THR CB . 15208 1 480 . 1 1 41 41 THR CG2 C 13 20.780 . . 1 . . . . 42 THR CG2 . 15208 1 481 . 1 1 41 41 THR N N 15 120.111 . . 1 . . . . 42 THR N . 15208 1 482 . 1 1 42 42 ASN H H 1 8.585 . . 1 . . . . 43 ASN HN . 15208 1 483 . 1 1 42 42 ASN HA H 1 4.393 . . 1 . . . . 43 ASN HA . 15208 1 484 . 1 1 42 42 ASN HB2 H 1 3.076 . . 2 . . . . 43 ASN HB2 . 15208 1 485 . 1 1 42 42 ASN HB3 H 1 2.791 . . 2 . . . . 43 ASN HB3 . 15208 1 486 . 1 1 42 42 ASN HD21 H 1 8.296 . . 2 . . . . 43 ASN HD21 . 15208 1 487 . 1 1 42 42 ASN HD22 H 1 6.755 . . 2 . . . . 43 ASN HD22 . 15208 1 488 . 1 1 42 42 ASN C C 13 174.188 . . 1 . . . . 43 ASN C . 15208 1 489 . 1 1 42 42 ASN CA C 13 53.489 . . 1 . . . . 43 ASN CA . 15208 1 490 . 1 1 42 42 ASN CB C 13 36.977 . . 1 . . . . 43 ASN CB . 15208 1 491 . 1 1 42 42 ASN N N 15 117.511 . . 1 . . . . 43 ASN N . 15208 1 492 . 1 1 42 42 ASN ND2 N 15 113.873 . . 1 . . . . 43 ASN ND2 . 15208 1 493 . 1 1 43 43 LYS H H 1 8.299 . . 1 . . . . 44 LYS HN . 15208 1 494 . 1 1 43 43 LYS HA H 1 5.129 . . 1 . . . . 44 LYS HA . 15208 1 495 . 1 1 43 43 LYS HB2 H 1 1.830 . . 2 . . . . 44 LYS HB2 . 15208 1 496 . 1 1 43 43 LYS HB3 H 1 1.359 . . 2 . . . . 44 LYS HB3 . 15208 1 497 . 1 1 43 43 LYS HG2 H 1 1.335 . . 1 . . . . 44 LYS QG . 15208 1 498 . 1 1 43 43 LYS HG3 H 1 1.335 . . 1 . . . . 44 LYS QG . 15208 1 499 . 1 1 43 43 LYS HD2 H 1 1.518 . . 2 . . . . 44 LYS HD2 . 15208 1 500 . 1 1 43 43 LYS HD3 H 1 1.368 . . 2 . . . . 44 LYS HD3 . 15208 1 501 . 1 1 43 43 LYS HE2 H 1 2.679 . . 1 . . . . 44 LYS QE . 15208 1 502 . 1 1 43 43 LYS HE3 H 1 2.679 . . 1 . . . . 44 LYS QE . 15208 1 503 . 1 1 43 43 LYS C C 13 177.205 . . 1 . . . . 44 LYS C . 15208 1 504 . 1 1 43 43 LYS CA C 13 56.640 . . 1 . . . . 44 LYS CA . 15208 1 505 . 1 1 43 43 LYS CB C 13 32.680 . . 1 . . . . 44 LYS CB . 15208 1 506 . 1 1 43 43 LYS CG C 13 25.340 . . 1 . . . . 44 LYS CG . 15208 1 507 . 1 1 43 43 LYS CD C 13 29.499 . . 1 . . . . 44 LYS CD . 15208 1 508 . 1 1 43 43 LYS CE C 13 41.822 . . 1 . . . . 44 LYS CE . 15208 1 509 . 1 1 43 43 LYS N N 15 119.185 . . 1 . . . . 44 LYS N . 15208 1 510 . 1 1 44 44 SER H H 1 9.451 . . 1 . . . . 45 SER HN . 15208 1 511 . 1 1 44 44 SER HA H 1 4.802 . . 1 . . . . 45 SER HA . 15208 1 512 . 1 1 44 44 SER HB2 H 1 3.799 . . 2 . . . . 45 SER HB2 . 15208 1 513 . 1 1 44 44 SER HB3 H 1 3.725 . . 2 . . . . 45 SER HB3 . 15208 1 514 . 1 1 44 44 SER C C 13 171.800 . . 1 . . . . 45 SER C . 15208 1 515 . 1 1 44 44 SER CA C 13 57.295 . . 1 . . . . 45 SER CA . 15208 1 516 . 1 1 44 44 SER CB C 13 65.349 . . 1 . . . . 45 SER CB . 15208 1 517 . 1 1 44 44 SER N N 15 122.818 . . 1 . . . . 45 SER N . 15208 1 518 . 1 1 45 45 LEU H H 1 8.357 . . 1 . . . . 46 LEU HN . 15208 1 519 . 1 1 45 45 LEU HA H 1 5.380 . . 1 . . . . 46 LEU HA . 15208 1 520 . 1 1 45 45 LEU HB2 H 1 1.765 . . 2 . . . . 46 LEU HB2 . 15208 1 521 . 1 1 45 45 LEU HB3 H 1 1.605 . . 2 . . . . 46 LEU HB3 . 15208 1 522 . 1 1 45 45 LEU HG H 1 1.548 . . 1 . . . . 46 LEU HG . 15208 1 523 . 1 1 45 45 LEU HD11 H 1 0.976 . . 2 . . . . 46 LEU QD1 . 15208 1 524 . 1 1 45 45 LEU HD12 H 1 0.976 . . 2 . . . . 46 LEU QD1 . 15208 1 525 . 1 1 45 45 LEU HD13 H 1 0.976 . . 2 . . . . 46 LEU QD1 . 15208 1 526 . 1 1 45 45 LEU HD21 H 1 0.915 . . 2 . . . . 46 LEU QD2 . 15208 1 527 . 1 1 45 45 LEU HD22 H 1 0.915 . . 2 . . . . 46 LEU QD2 . 15208 1 528 . 1 1 45 45 LEU HD23 H 1 0.915 . . 2 . . . . 46 LEU QD2 . 15208 1 529 . 1 1 45 45 LEU C C 13 175.675 . . 1 . . . . 46 LEU C . 15208 1 530 . 1 1 45 45 LEU CA C 13 54.378 . . 1 . . . . 46 LEU CA . 15208 1 531 . 1 1 45 45 LEU CB C 13 44.722 . . 1 . . . . 46 LEU CB . 15208 1 532 . 1 1 45 45 LEU CG C 13 28.338 . . 1 . . . . 46 LEU CG . 15208 1 533 . 1 1 45 45 LEU CD1 C 13 24.906 . . 2 . . . . 46 LEU CD1 . 15208 1 534 . 1 1 45 45 LEU CD2 C 13 25.548 . . 2 . . . . 46 LEU CD2 . 15208 1 535 . 1 1 45 45 LEU N N 15 126.880 . . 1 . . . . 46 LEU N . 15208 1 536 . 1 1 46 46 LYS H H 1 9.140 . . 1 . . . . 47 LYS HN . 15208 1 537 . 1 1 46 46 LYS HA H 1 4.778 . . 1 . . . . 47 LYS HA . 15208 1 538 . 1 1 46 46 LYS HB2 H 1 1.899 . . 2 . . . . 47 LYS HB2 . 15208 1 539 . 1 1 46 46 LYS HB3 H 1 1.813 . . 2 . . . . 47 LYS HB3 . 15208 1 540 . 1 1 46 46 LYS HG2 H 1 1.427 . . 1 . . . . 47 LYS QG . 15208 1 541 . 1 1 46 46 LYS HG3 H 1 1.427 . . 1 . . . . 47 LYS QG . 15208 1 542 . 1 1 46 46 LYS HD2 H 1 1.706 . . 1 . . . . 47 LYS QD . 15208 1 543 . 1 1 46 46 LYS HD3 H 1 1.706 . . 1 . . . . 47 LYS QD . 15208 1 544 . 1 1 46 46 LYS HE2 H 1 2.960 . . 1 . . . . 47 LYS QE . 15208 1 545 . 1 1 46 46 LYS HE3 H 1 2.960 . . 1 . . . . 47 LYS QE . 15208 1 546 . 1 1 46 46 LYS C C 13 174.159 . . 1 . . . . 47 LYS C . 15208 1 547 . 1 1 46 46 LYS CA C 13 54.913 . . 1 . . . . 47 LYS CA . 15208 1 548 . 1 1 46 46 LYS CB C 13 35.522 . . 1 . . . . 47 LYS CB . 15208 1 549 . 1 1 46 46 LYS CG C 13 24.842 . . 1 . . . . 47 LYS CG . 15208 1 550 . 1 1 46 46 LYS CD C 13 29.181 . . 1 . . . . 47 LYS CD . 15208 1 551 . 1 1 46 46 LYS CE C 13 41.832 . . 1 . . . . 47 LYS CE . 15208 1 552 . 1 1 46 46 LYS N N 15 127.364 . . 1 . . . . 47 LYS N . 15208 1 553 . 1 1 47 47 GLU H H 1 8.687 . . 1 . . . . 48 GLU HN . 15208 1 554 . 1 1 47 47 GLU HA H 1 5.325 . . 1 . . . . 48 GLU HA . 15208 1 555 . 1 1 47 47 GLU HB2 H 1 2.064 . . 2 . . . . 48 GLU HB2 . 15208 1 556 . 1 1 47 47 GLU HB3 H 1 1.955 . . 2 . . . . 48 GLU HB3 . 15208 1 557 . 1 1 47 47 GLU HG2 H 1 2.239 . . 2 . . . . 48 GLU HG2 . 15208 1 558 . 1 1 47 47 GLU HG3 H 1 2.127 . . 2 . . . . 48 GLU HG3 . 15208 1 559 . 1 1 47 47 GLU C C 13 175.331 . . 1 . . . . 48 GLU C . 15208 1 560 . 1 1 47 47 GLU CA C 13 54.862 . . 1 . . . . 48 GLU CA . 15208 1 561 . 1 1 47 47 GLU CB C 13 31.773 . . 1 . . . . 48 GLU CB . 15208 1 562 . 1 1 47 47 GLU CG C 13 36.230 . . 1 . . . . 48 GLU CG . 15208 1 563 . 1 1 47 47 GLU N N 15 124.773 . . 1 . . . . 48 GLU N . 15208 1 564 . 1 1 48 48 GLU H H 1 8.629 . . 1 . . . . 49 GLU HN . 15208 1 565 . 1 1 48 48 GLU HA H 1 4.575 . . 1 . . . . 49 GLU HA . 15208 1 566 . 1 1 48 48 GLU HB2 H 1 2.027 . . 2 . . . . 49 GLU HB2 . 15208 1 567 . 1 1 48 48 GLU HB3 H 1 1.858 . . 2 . . . . 49 GLU HB3 . 15208 1 568 . 1 1 48 48 GLU HG2 H 1 2.173 . . 1 . . . . 49 GLU QG . 15208 1 569 . 1 1 48 48 GLU HG3 H 1 2.173 . . 1 . . . . 49 GLU QG . 15208 1 570 . 1 1 48 48 GLU C C 13 175.689 . . 1 . . . . 49 GLU C . 15208 1 571 . 1 1 48 48 GLU CA C 13 55.412 . . 1 . . . . 49 GLU CA . 15208 1 572 . 1 1 48 48 GLU CB C 13 32.481 . . 1 . . . . 49 GLU CB . 15208 1 573 . 1 1 48 48 GLU CG C 13 35.876 . . 1 . . . . 49 GLU CG . 15208 1 574 . 1 1 48 48 GLU N N 15 124.449 . . 1 . . . . 49 GLU N . 15208 1 575 . 1 1 49 49 ASP H H 1 9.189 . . 1 . . . . 50 ASP HN . 15208 1 576 . 1 1 49 49 ASP HA H 1 4.352 . . 1 . . . . 50 ASP HA . 15208 1 577 . 1 1 49 49 ASP HB2 H 1 2.925 . . 2 . . . . 50 ASP HB2 . 15208 1 578 . 1 1 49 49 ASP HB3 H 1 2.612 . . 2 . . . . 50 ASP HB3 . 15208 1 579 . 1 1 49 49 ASP C C 13 175.789 . . 1 . . . . 50 ASP C . 15208 1 580 . 1 1 49 49 ASP CA C 13 55.638 . . 1 . . . . 50 ASP CA . 15208 1 581 . 1 1 49 49 ASP CB C 13 39.999 . . 1 . . . . 50 ASP CB . 15208 1 582 . 1 1 49 49 ASP N N 15 125.166 . . 1 . . . . 50 ASP N . 15208 1 583 . 1 1 50 50 GLY H H 1 8.722 . . 1 . . . . 51 GLY HN . 15208 1 584 . 1 1 50 50 GLY HA2 H 1 4.176 . . 2 . . . . 51 GLY HA2 . 15208 1 585 . 1 1 50 50 GLY HA3 H 1 3.714 . . 2 . . . . 51 GLY HA3 . 15208 1 586 . 1 1 50 50 GLY C C 13 173.459 . . 1 . . . . 51 GLY C . 15208 1 587 . 1 1 50 50 GLY CA C 13 45.670 . . 1 . . . . 51 GLY CA . 15208 1 588 . 1 1 50 50 GLY N N 15 107.649 . . 1 . . . . 51 GLY N . 15208 1 589 . 1 1 51 51 GLU H H 1 7.866 . . 1 . . . . 52 GLU HN . 15208 1 590 . 1 1 51 51 GLU HA H 1 4.888 . . 1 . . . . 52 GLU HA . 15208 1 591 . 1 1 51 51 GLU HB2 H 1 2.040 . . 2 . . . . 52 GLU HB2 . 15208 1 592 . 1 1 51 51 GLU HB3 H 1 1.945 . . 2 . . . . 52 GLU HB3 . 15208 1 593 . 1 1 51 51 GLU HG2 H 1 2.233 . . 2 . . . . 52 GLU HG2 . 15208 1 594 . 1 1 51 51 GLU HG3 H 1 2.056 . . 2 . . . . 52 GLU HG3 . 15208 1 595 . 1 1 51 51 GLU C C 13 174.603 . . 1 . . . . 52 GLU C . 15208 1 596 . 1 1 51 51 GLU CA C 13 54.895 . . 1 . . . . 52 GLU CA . 15208 1 597 . 1 1 51 51 GLU CB C 13 32.041 . . 1 . . . . 52 GLU CB . 15208 1 598 . 1 1 51 51 GLU CG C 13 35.280 . . 1 . . . . 52 GLU CG . 15208 1 599 . 1 1 51 51 GLU N N 15 120.906 . . 1 . . . . 52 GLU N . 15208 1 600 . 1 1 52 52 GLU H H 1 9.148 . . 1 . . . . 53 GLU HN . 15208 1 601 . 1 1 52 52 GLU HA H 1 5.174 . . 1 . . . . 53 GLU HA . 15208 1 602 . 1 1 52 52 GLU HB2 H 1 2.201 . . 1 . . . . 53 GLU QB . 15208 1 603 . 1 1 52 52 GLU HB3 H 1 2.201 . . 1 . . . . 53 GLU QB . 15208 1 604 . 1 1 52 52 GLU HG2 H 1 2.444 . . 2 . . . . 53 GLU HG2 . 15208 1 605 . 1 1 52 52 GLU HG3 H 1 2.259 . . 2 . . . . 53 GLU HG3 . 15208 1 606 . 1 1 52 52 GLU C C 13 175.160 . . 1 . . . . 53 GLU C . 15208 1 607 . 1 1 52 52 GLU CA C 13 55.113 . . 1 . . . . 53 GLU CA . 15208 1 608 . 1 1 52 52 GLU CB C 13 32.085 . . 1 . . . . 53 GLU CB . 15208 1 609 . 1 1 52 52 GLU CG C 13 54.826 . . 1 . . . . 53 GLU CG . 15208 1 610 . 1 1 52 52 GLU N N 15 125.332 . . 1 . . . . 53 GLU N . 15208 1 611 . 1 1 53 53 ILE H H 1 9.073 . . 1 . . . . 54 ILE HN . 15208 1 612 . 1 1 53 53 ILE HA H 1 4.984 . . 1 . . . . 54 ILE HA . 15208 1 613 . 1 1 53 53 ILE HB H 1 1.793 . . 1 . . . . 54 ILE HB . 15208 1 614 . 1 1 53 53 ILE HG12 H 1 1.545 . . 9 . . . . 54 ILE HG12 . 15208 1 615 . 1 1 53 53 ILE HG13 H 1 1.065 . . 9 . . . . 54 ILE HG13 . 15208 1 616 . 1 1 53 53 ILE HG21 H 1 0.959 . . 1 . . . . 54 ILE QG2 . 15208 1 617 . 1 1 53 53 ILE HG22 H 1 0.959 . . 1 . . . . 54 ILE QG2 . 15208 1 618 . 1 1 53 53 ILE HG23 H 1 0.959 . . 1 . . . . 54 ILE QG2 . 15208 1 619 . 1 1 53 53 ILE HD11 H 1 0.824 . . 1 . . . . 54 ILE QD1 . 15208 1 620 . 1 1 53 53 ILE HD12 H 1 0.824 . . 1 . . . . 54 ILE QD1 . 15208 1 621 . 1 1 53 53 ILE HD13 H 1 0.824 . . 1 . . . . 54 ILE QD1 . 15208 1 622 . 1 1 53 53 ILE C C 13 175.889 . . 1 . . . . 54 ILE C . 15208 1 623 . 1 1 53 53 ILE CA C 13 60.902 . . 1 . . . . 54 ILE CA . 15208 1 624 . 1 1 53 53 ILE CB C 13 41.172 . . 1 . . . . 54 ILE CB . 15208 1 625 . 1 1 53 53 ILE CG1 C 13 27.688 . . 2 . . . . 54 ILE CG1 . 15208 1 626 . 1 1 53 53 ILE CG2 C 13 17.736 . . 2 . . . . 54 ILE CG2 . 15208 1 627 . 1 1 53 53 ILE CD1 C 13 14.489 . . 1 . . . . 54 ILE CD1 . 15208 1 628 . 1 1 53 53 ILE N N 15 123.945 . . 1 . . . . 54 ILE N . 15208 1 629 . 1 1 54 54 VAL H H 1 9.849 . . 1 . . . . 55 VAL HN . 15208 1 630 . 1 1 54 54 VAL HA H 1 5.214 . . 1 . . . . 55 VAL HA . 15208 1 631 . 1 1 54 54 VAL HB H 1 2.398 . . 1 . . . . 55 VAL HB . 15208 1 632 . 1 1 54 54 VAL HG11 H 1 1.272 . . 2 . . . . 55 VAL QG1 . 15208 1 633 . 1 1 54 54 VAL HG12 H 1 1.272 . . 2 . . . . 55 VAL QG1 . 15208 1 634 . 1 1 54 54 VAL HG13 H 1 1.272 . . 2 . . . . 55 VAL QG1 . 15208 1 635 . 1 1 54 54 VAL HG21 H 1 1.230 . . 2 . . . . 55 VAL QG2 . 15208 1 636 . 1 1 54 54 VAL HG22 H 1 1.230 . . 2 . . . . 55 VAL QG2 . 15208 1 637 . 1 1 54 54 VAL HG23 H 1 1.230 . . 2 . . . . 55 VAL QG2 . 15208 1 638 . 1 1 54 54 VAL C C 13 175.275 . . 1 . . . . 55 VAL C . 15208 1 639 . 1 1 54 54 VAL CA C 13 61.343 . . 1 . . . . 55 VAL CA . 15208 1 640 . 1 1 54 54 VAL CB C 13 34.942 . . 1 . . . . 55 VAL CB . 15208 1 641 . 1 1 54 54 VAL CG1 C 13 21.876 . . 2 . . . . 55 VAL CG1 . 15208 1 642 . 1 1 54 54 VAL CG2 C 13 20.936 . . 2 . . . . 55 VAL CG2 . 15208 1 643 . 1 1 54 54 VAL N N 15 131.479 . . 1 . . . . 55 VAL N . 15208 1 644 . 1 1 55 55 THR H H 1 8.711 . . 1 . . . . 56 THR HN . 15208 1 645 . 1 1 55 55 THR HA H 1 5.861 . . 1 . . . . 56 THR HA . 15208 1 646 . 1 1 55 55 THR HB H 1 4.264 . . 1 . . . . 56 THR HB . 15208 1 647 . 1 1 55 55 THR HG21 H 1 1.320 . . 1 . . . . 56 THR QG2 . 15208 1 648 . 1 1 55 55 THR HG22 H 1 1.320 . . 1 . . . . 56 THR QG2 . 15208 1 649 . 1 1 55 55 THR HG23 H 1 1.320 . . 1 . . . . 56 THR QG2 . 15208 1 650 . 1 1 55 55 THR C C 13 173.888 . . 1 . . . . 56 THR C . 15208 1 651 . 1 1 55 55 THR CA C 13 58.486 . . 1 . . . . 56 THR CA . 15208 1 652 . 1 1 55 55 THR CB C 13 72.615 . . 1 . . . . 56 THR CB . 15208 1 653 . 1 1 55 55 THR CG2 C 13 21.827 . . 1 . . . . 56 THR CG2 . 15208 1 654 . 1 1 55 55 THR N N 15 116.948 . . 1 . . . . 56 THR N . 15208 1 655 . 1 1 56 56 TYR H H 1 8.112 . . 1 . . . . 57 TYR HN . 15208 1 656 . 1 1 56 56 TYR HA H 1 4.725 . . 1 . . . . 57 TYR HA . 15208 1 657 . 1 1 56 56 TYR HB2 H 1 3.140 . . 2 . . . . 57 TYR HB2 . 15208 1 658 . 1 1 56 56 TYR HB3 H 1 2.792 . . 2 . . . . 57 TYR HB3 . 15208 1 659 . 1 1 56 56 TYR HD1 H 1 6.294 . . 1 . . . . 57 TYR QD . 15208 1 660 . 1 1 56 56 TYR HD2 H 1 6.294 . . 1 . . . . 57 TYR QD . 15208 1 661 . 1 1 56 56 TYR HE1 H 1 6.787 . . 1 . . . . 57 TYR QE . 15208 1 662 . 1 1 56 56 TYR HE2 H 1 6.787 . . 1 . . . . 57 TYR QE . 15208 1 663 . 1 1 56 56 TYR C C 13 172.043 . . 1 . . . . 57 TYR C . 15208 1 664 . 1 1 56 56 TYR CA C 13 56.891 . . 1 . . . . 57 TYR CA . 15208 1 665 . 1 1 56 56 TYR CB C 13 38.039 . . 1 . . . . 57 TYR CB . 15208 1 666 . 1 1 56 56 TYR CD1 C 13 133.536 . . 2 . . . . 57 TYR CD1 . 15208 1 667 . 1 1 56 56 TYR CE1 C 13 117.424 . . 2 . . . . 57 TYR CE1 . 15208 1 668 . 1 1 56 56 TYR N N 15 113.629 . . 1 . . . . 57 TYR N . 15208 1 669 . 1 1 57 57 ASP H H 1 8.910 . . 1 . . . . 58 ASP HN . 15208 1 670 . 1 1 57 57 ASP HA H 1 5.480 . . 1 . . . . 58 ASP HA . 15208 1 671 . 1 1 57 57 ASP HB2 H 1 2.483 . . 2 . . . . 58 ASP HB2 . 15208 1 672 . 1 1 57 57 ASP HB3 H 1 2.349 . . 2 . . . . 58 ASP HB3 . 15208 1 673 . 1 1 57 57 ASP C C 13 175.275 . . 1 . . . . 58 ASP C . 15208 1 674 . 1 1 57 57 ASP CA C 13 53.684 . . 1 . . . . 58 ASP CA . 15208 1 675 . 1 1 57 57 ASP CB C 13 43.237 . . 1 . . . . 58 ASP CB . 15208 1 676 . 1 1 57 57 ASP N N 15 118.021 . . 1 . . . . 58 ASP N . 15208 1 677 . 1 1 58 58 HIS H H 1 8.890 . . 1 . . . . 59 HIS HN . 15208 1 678 . 1 1 58 58 HIS HA H 1 5.093 . . 1 . . . . 59 HIS HA . 15208 1 679 . 1 1 58 58 HIS HB2 H 1 3.299 . . 2 . . . . 59 HIS HB2 . 15208 1 680 . 1 1 58 58 HIS HB3 H 1 2.912 . . 2 . . . . 59 HIS HB3 . 15208 1 681 . 1 1 58 58 HIS HD2 H 1 6.906 . . 2 . . . . 59 HIS HD2 . 15208 1 682 . 1 1 58 58 HIS HE1 H 1 9.059 . . 1 . . . . 59 HIS HE1 . 15208 1 683 . 1 1 58 58 HIS C C 13 173.773 . . 1 . . . . 59 HIS C . 15208 1 684 . 1 1 58 58 HIS CA C 13 54.069 . . 1 . . . . 59 HIS CA . 15208 1 685 . 1 1 58 58 HIS CB C 13 29.035 . . 1 . . . . 59 HIS CB . 15208 1 686 . 1 1 58 58 HIS CD2 C 13 129.657 . . 1 . . . . 59 HIS CD2 . 15208 1 687 . 1 1 58 58 HIS CE1 C 13 143.023 . . 1 . . . . 59 HIS CE1 . 15208 1 688 . 1 1 58 58 HIS N N 15 118.507 . . 1 . . . . 59 HIS N . 15208 1 689 . 1 1 59 59 LEU H H 1 9.451 . . 1 . . . . 60 LEU HN . 15208 1 690 . 1 1 59 59 LEU HA H 1 5.218 . . 1 . . . . 60 LEU HA . 15208 1 691 . 1 1 59 59 LEU HB2 H 1 1.395 . . 2 . . . . 60 LEU HB2 . 15208 1 692 . 1 1 59 59 LEU HB3 H 1 1.335 . . 2 . . . . 60 LEU HB3 . 15208 1 693 . 1 1 59 59 LEU HG H 1 1.479 . . 1 . . . . 60 LEU HG . 15208 1 694 . 1 1 59 59 LEU HD11 H 1 0.715 . . 2 . . . . 60 LEU QD1 . 15208 1 695 . 1 1 59 59 LEU HD12 H 1 0.715 . . 2 . . . . 60 LEU QD1 . 15208 1 696 . 1 1 59 59 LEU HD13 H 1 0.715 . . 2 . . . . 60 LEU QD1 . 15208 1 697 . 1 1 59 59 LEU HD21 H 1 0.692 . . 2 . . . . 60 LEU QD2 . 15208 1 698 . 1 1 59 59 LEU HD22 H 1 0.692 . . 2 . . . . 60 LEU QD2 . 15208 1 699 . 1 1 59 59 LEU HD23 H 1 0.692 . . 2 . . . . 60 LEU QD2 . 15208 1 700 . 1 1 59 59 LEU C C 13 175.827 . . 1 . . . . 60 LEU C . 15208 1 701 . 1 1 59 59 LEU CA C 13 53.084 . . 1 . . . . 60 LEU CA . 15208 1 702 . 1 1 59 59 LEU CB C 13 47.085 . . 1 . . . . 60 LEU CB . 15208 1 703 . 1 1 59 59 LEU CG C 13 27.891 . . 1 . . . . 60 LEU CG . 15208 1 704 . 1 1 59 59 LEU CD1 C 13 25.818 . . 2 . . . . 60 LEU CD1 . 15208 1 705 . 1 1 59 59 LEU CD2 C 13 25.701 . . 2 . . . . 60 LEU CD2 . 15208 1 706 . 1 1 59 59 LEU N N 15 126.425 . . 1 . . . . 60 LEU N . 15208 1 707 . 1 1 60 60 CYS H H 1 8.927 . . 1 . . . . 61 CYS HN . 15208 1 708 . 1 1 60 60 CYS HA H 1 4.592 . . 1 . . . . 61 CYS HA . 15208 1 709 . 1 1 60 60 CYS HB2 H 1 3.359 . . 2 . . . . 61 CYS HB2 . 15208 1 710 . 1 1 60 60 CYS HB3 H 1 3.217 . . 2 . . . . 61 CYS HB3 . 15208 1 711 . 1 1 60 60 CYS C C 13 177.734 . . 1 . . . . 61 CYS C . 15208 1 712 . 1 1 60 60 CYS CA C 13 59.059 . . 1 . . . . 61 CYS CA . 15208 1 713 . 1 1 60 60 CYS CB C 13 31.277 . . 1 . . . . 61 CYS CB . 15208 1 714 . 1 1 60 60 CYS N N 15 123.662 . . 1 . . . . 61 CYS N . 15208 1 715 . 1 1 61 61 LYS H H 1 9.386 . . 1 . . . . 62 LYS HN . 15208 1 716 . 1 1 61 61 LYS HA H 1 3.952 . . 1 . . . . 62 LYS HA . 15208 1 717 . 1 1 61 61 LYS HB2 H 1 1.950 . . 2 . . . . 62 LYS HB2 . 15208 1 718 . 1 1 61 61 LYS HB3 H 1 1.868 . . 2 . . . . 62 LYS HB3 . 15208 1 719 . 1 1 61 61 LYS HG2 H 1 1.644 . . 2 . . . . 62 LYS HG2 . 15208 1 720 . 1 1 61 61 LYS HG3 H 1 1.484 . . 2 . . . . 62 LYS HG3 . 15208 1 721 . 1 1 61 61 LYS HD2 H 1 1.700 . . 2 . . . . 62 LYS HD2 . 15208 1 722 . 1 1 61 61 LYS HD3 H 1 1.646 . . 2 . . . . 62 LYS HD3 . 15208 1 723 . 1 1 61 61 LYS HE2 H 1 2.972 . . 1 . . . . 62 LYS QE . 15208 1 724 . 1 1 61 61 LYS HE3 H 1 2.972 . . 1 . . . . 62 LYS QE . 15208 1 725 . 1 1 61 61 LYS C C 13 176.004 . . 1 . . . . 62 LYS C . 15208 1 726 . 1 1 61 61 LYS CA C 13 58.784 . . 1 . . . . 62 LYS CA . 15208 1 727 . 1 1 61 61 LYS CB C 13 33.517 . . 1 . . . . 62 LYS CB . 15208 1 728 . 1 1 61 61 LYS CG C 13 25.196 . . 1 . . . . 62 LYS CG . 15208 1 729 . 1 1 61 61 LYS CD C 13 29.735 . . 1 . . . . 62 LYS CD . 15208 1 730 . 1 1 61 61 LYS CE C 13 41.815 . . 1 . . . . 62 LYS CE . 15208 1 731 . 1 1 61 61 LYS N N 15 131.422 . . 1 . . . . 62 LYS N . 15208 1 732 . 1 1 62 62 ASN H H 1 8.910 . . 1 . . . . 63 ASN HN . 15208 1 733 . 1 1 62 62 ASN HA H 1 4.551 . . 1 . . . . 63 ASN HA . 15208 1 734 . 1 1 62 62 ASN HB2 H 1 3.090 . . 2 . . . . 63 ASN HB2 . 15208 1 735 . 1 1 62 62 ASN HB3 H 1 2.532 . . 2 . . . . 63 ASN HB3 . 15208 1 736 . 1 1 62 62 ASN HD21 H 1 8.457 . . 2 . . . . 63 ASN HD21 . 15208 1 737 . 1 1 62 62 ASN HD22 H 1 7.689 . . 2 . . . . 63 ASN HD22 . 15208 1 738 . 1 1 62 62 ASN C C 13 175.622 . . 1 . . . . 63 ASN C . 15208 1 739 . 1 1 62 62 ASN CA C 13 56.106 . . 1 . . . . 63 ASN CA . 15208 1 740 . 1 1 62 62 ASN CB C 13 40.074 . . 1 . . . . 63 ASN CB . 15208 1 741 . 1 1 62 62 ASN N N 15 118.043 . . 1 . . . . 63 ASN N . 15208 1 742 . 1 1 62 62 ASN ND2 N 15 120.371 . . 1 . . . . 63 ASN ND2 . 15208 1 743 . 1 1 63 63 CYS H H 1 8.565 . . 1 . . . . 64 CYS HN . 15208 1 744 . 1 1 63 63 CYS HA H 1 4.898 . . 1 . . . . 64 CYS HA . 15208 1 745 . 1 1 63 63 CYS HB2 H 1 3.294 . . 2 . . . . 64 CYS HB2 . 15208 1 746 . 1 1 63 63 CYS HB3 H 1 2.459 . . 2 . . . . 64 CYS HB3 . 15208 1 747 . 1 1 63 63 CYS C C 13 176.204 . . 1 . . . . 64 CYS C . 15208 1 748 . 1 1 63 63 CYS CA C 13 58.837 . . 1 . . . . 64 CYS CA . 15208 1 749 . 1 1 63 63 CYS CB C 13 33.016 . . 1 . . . . 64 CYS CB . 15208 1 750 . 1 1 63 63 CYS N N 15 118.059 . . 1 . . . . 64 CYS N . 15208 1 751 . 1 1 64 64 HIS H H 1 8.248 . . 1 . . . . 65 HIS HN . 15208 1 752 . 1 1 64 64 HIS HA H 1 4.444 . . 1 . . . . 65 HIS HA . 15208 1 753 . 1 1 64 64 HIS HB2 H 1 3.695 . . 2 . . . . 65 HIS HB2 . 15208 1 754 . 1 1 64 64 HIS HB3 H 1 3.491 . . 2 . . . . 65 HIS HB3 . 15208 1 755 . 1 1 64 64 HIS HD2 H 1 7.142 . . 2 . . . . 65 HIS HD2 . 15208 1 756 . 1 1 64 64 HIS HE1 H 1 8.322 . . 1 . . . . 65 HIS HE1 . 15208 1 757 . 1 1 64 64 HIS C C 13 173.130 . . 1 . . . . 65 HIS C . 15208 1 758 . 1 1 64 64 HIS CA C 13 57.419 . . 1 . . . . 65 HIS CA . 15208 1 759 . 1 1 64 64 HIS CB C 13 26.015 . . 1 . . . . 65 HIS CB . 15208 1 760 . 1 1 64 64 HIS CD2 C 13 118.024 . . 1 . . . . 65 HIS CD2 . 15208 1 761 . 1 1 64 64 HIS CE1 C 13 136.494 . . 1 . . . . 65 HIS CE1 . 15208 1 762 . 1 1 64 64 HIS N N 15 117.272 . . 1 . . . . 65 HIS N . 15208 1 763 . 1 1 65 65 HIS H H 1 8.950 . . 1 . . . . 66 HIS HN . 15208 1 764 . 1 1 65 65 HIS HA H 1 4.483 . . 1 . . . . 66 HIS HA . 15208 1 765 . 1 1 65 65 HIS HB2 H 1 3.279 . . 1 . . . . 66 HIS QB . 15208 1 766 . 1 1 65 65 HIS HB3 H 1 3.279 . . 1 . . . . 66 HIS QB . 15208 1 767 . 1 1 65 65 HIS HD2 H 1 7.227 . . 2 . . . . 66 HIS HD2 . 15208 1 768 . 1 1 65 65 HIS HE1 H 1 7.843 . . 1 . . . . 66 HIS HE1 . 15208 1 769 . 1 1 65 65 HIS C C 13 174.245 . . 1 . . . . 66 HIS C . 15208 1 770 . 1 1 65 65 HIS CA C 13 57.193 . . 1 . . . . 66 HIS CA . 15208 1 771 . 1 1 65 65 HIS CB C 13 30.831 . . 1 . . . . 66 HIS CB . 15208 1 772 . 1 1 65 65 HIS CD2 C 13 129.790 . . 1 . . . . 66 HIS CD2 . 15208 1 773 . 1 1 65 65 HIS CE1 C 13 138.664 . . 1 . . . . 66 HIS CE1 . 15208 1 774 . 1 1 65 65 HIS N N 15 122.024 . . 1 . . . . 66 HIS N . 15208 1 775 . 1 1 66 66 VAL H H 1 8.207 . . 1 . . . . 67 VAL HN . 15208 1 776 . 1 1 66 66 VAL HA H 1 3.883 . . 1 . . . . 67 VAL HA . 15208 1 777 . 1 1 66 66 VAL HB H 1 1.869 . . 1 . . . . 67 VAL HB . 15208 1 778 . 1 1 66 66 VAL HG11 H 1 0.915 . . 2 . . . . 67 VAL QG1 . 15208 1 779 . 1 1 66 66 VAL HG12 H 1 0.915 . . 2 . . . . 67 VAL QG1 . 15208 1 780 . 1 1 66 66 VAL HG13 H 1 0.915 . . 2 . . . . 67 VAL QG1 . 15208 1 781 . 1 1 66 66 VAL HG21 H 1 0.662 . . 2 . . . . 67 VAL QG2 . 15208 1 782 . 1 1 66 66 VAL HG22 H 1 0.662 . . 2 . . . . 67 VAL QG2 . 15208 1 783 . 1 1 66 66 VAL HG23 H 1 0.662 . . 2 . . . . 67 VAL QG2 . 15208 1 784 . 1 1 66 66 VAL C C 13 174.431 . . 1 . . . . 67 VAL C . 15208 1 785 . 1 1 66 66 VAL CA C 13 62.982 . . 1 . . . . 67 VAL CA . 15208 1 786 . 1 1 66 66 VAL CB C 13 30.585 . . 1 . . . . 67 VAL CB . 15208 1 787 . 1 1 66 66 VAL CG1 C 13 21.001 . . 2 . . . . 67 VAL CG1 . 15208 1 788 . 1 1 66 66 VAL CG2 C 13 20.799 . . 2 . . . . 67 VAL CG2 . 15208 1 789 . 1 1 66 66 VAL N N 15 126.991 . . 1 . . . . 67 VAL N . 15208 1 790 . 1 1 67 67 ILE H H 1 8.688 . . 1 . . . . 68 ILE HN . 15208 1 791 . 1 1 67 67 ILE HA H 1 3.686 . . 1 . . . . 68 ILE HA . 15208 1 792 . 1 1 67 67 ILE HB H 1 1.366 . . 1 . . . . 68 ILE HB . 15208 1 793 . 1 1 67 67 ILE HG12 H 1 1.865 . . 1 . . . . 68 ILE QG1 . 15208 1 794 . 1 1 67 67 ILE HG13 H 1 1.865 . . 1 . . . . 68 ILE QG1 . 15208 1 795 . 1 1 67 67 ILE HG21 H 1 0.767 . . 1 . . . . 68 ILE QG2 . 15208 1 796 . 1 1 67 67 ILE HG22 H 1 0.767 . . 1 . . . . 68 ILE QG2 . 15208 1 797 . 1 1 67 67 ILE HG23 H 1 0.767 . . 1 . . . . 68 ILE QG2 . 15208 1 798 . 1 1 67 67 ILE HD11 H 1 0.576 . . 1 . . . . 68 ILE QD1 . 15208 1 799 . 1 1 67 67 ILE HD12 H 1 0.576 . . 1 . . . . 68 ILE QD1 . 15208 1 800 . 1 1 67 67 ILE HD13 H 1 0.576 . . 1 . . . . 68 ILE QD1 . 15208 1 801 . 1 1 67 67 ILE C C 13 175.947 . . 1 . . . . 68 ILE C . 15208 1 802 . 1 1 67 67 ILE CA C 13 63.906 . . 1 . . . . 68 ILE CA . 15208 1 803 . 1 1 67 67 ILE CB C 13 39.758 . . 1 . . . . 68 ILE CB . 15208 1 804 . 1 1 67 67 ILE CG1 C 13 28.535 . . 2 . . . . 68 ILE CG1 . 15208 1 805 . 1 1 67 67 ILE CG2 C 13 16.723 . . 2 . . . . 68 ILE CG2 . 15208 1 806 . 1 1 67 67 ILE CD1 C 13 16.074 . . 1 . . . . 68 ILE CD1 . 15208 1 807 . 1 1 67 67 ILE N N 15 132.587 . . 1 . . . . 68 ILE N . 15208 1 808 . 1 1 68 68 ALA H H 1 7.433 . . 1 . . . . 69 ALA HN . 15208 1 809 . 1 1 68 68 ALA HA H 1 4.491 . . 1 . . . . 69 ALA HA . 15208 1 810 . 1 1 68 68 ALA HB1 H 1 1.691 . . 1 . . . . 69 ALA QB . 15208 1 811 . 1 1 68 68 ALA HB2 H 1 1.691 . . 1 . . . . 69 ALA QB . 15208 1 812 . 1 1 68 68 ALA HB3 H 1 1.691 . . 1 . . . . 69 ALA QB . 15208 1 813 . 1 1 68 68 ALA C C 13 174.102 . . 1 . . . . 69 ALA C . 15208 1 814 . 1 1 68 68 ALA CA C 13 51.937 . . 1 . . . . 69 ALA CA . 15208 1 815 . 1 1 68 68 ALA CB C 13 25.953 . . 1 . . . . 69 ALA CB . 15208 1 816 . 1 1 68 68 ALA N N 15 112.644 . . 1 . . . . 69 ALA N . 15208 1 817 . 1 1 69 69 ARG H H 1 8.266 . . 1 . . . . 70 ARG HN . 15208 1 818 . 1 1 69 69 ARG HA H 1 5.139 . . 1 . . . . 70 ARG HA . 15208 1 819 . 1 1 69 69 ARG HB2 H 1 1.951 . . 2 . . . . 70 ARG HB2 . 15208 1 820 . 1 1 69 69 ARG HB3 H 1 1.807 . . 2 . . . . 70 ARG HB3 . 15208 1 821 . 1 1 69 69 ARG HG2 H 1 1.616 . . 1 . . . . 70 ARG QG . 15208 1 822 . 1 1 69 69 ARG HG3 H 1 1.616 . . 1 . . . . 70 ARG QG . 15208 1 823 . 1 1 69 69 ARG HD2 H 1 3.211 . . 1 . . . . 70 ARG QD . 15208 1 824 . 1 1 69 69 ARG HD3 H 1 3.211 . . 1 . . . . 70 ARG QD . 15208 1 825 . 1 1 69 69 ARG HE H 1 7.920 . . 1 . . . . 70 ARG HE . 15208 1 826 . 1 1 69 69 ARG C C 13 173.945 . . 1 . . . . 70 ARG C . 15208 1 827 . 1 1 69 69 ARG CA C 13 55.534 . . 1 . . . . 70 ARG CA . 15208 1 828 . 1 1 69 69 ARG CB C 13 30.883 . . 1 . . . . 70 ARG CB . 15208 1 829 . 1 1 69 69 ARG CG C 13 27.164 . . 1 . . . . 70 ARG CG . 15208 1 830 . 1 1 69 69 ARG CD C 13 43.187 . . 1 . . . . 70 ARG CD . 15208 1 831 . 1 1 69 69 ARG N N 15 121.806 . . 1 . . . . 70 ARG N . 15208 1 832 . 1 1 69 69 ARG NE N 15 86.230 . . 1 . . . . 70 ARG NE . 15208 1 833 . 1 1 70 70 HIS H H 1 9.767 . . 1 . . . . 71 HIS HN . 15208 1 834 . 1 1 70 70 HIS HA H 1 4.433 . . 1 . . . . 71 HIS HA . 15208 1 835 . 1 1 70 70 HIS HB2 H 1 2.467 . . 2 . . . . 71 HIS HB2 . 15208 1 836 . 1 1 70 70 HIS HB3 H 1 1.755 . . 2 . . . . 71 HIS HB3 . 15208 1 837 . 1 1 70 70 HIS HD2 H 1 6.125 . . 2 . . . . 71 HIS HD2 . 15208 1 838 . 1 1 70 70 HIS HE1 H 1 8.034 . . 1 . . . . 71 HIS HE1 . 15208 1 839 . 1 1 70 70 HIS C C 13 174.131 . . 1 . . . . 71 HIS C . 15208 1 840 . 1 1 70 70 HIS CA C 13 56.542 . . 1 . . . . 71 HIS CA . 15208 1 841 . 1 1 70 70 HIS CB C 13 33.782 . . 1 . . . . 71 HIS CB . 15208 1 842 . 1 1 70 70 HIS CD2 C 13 118.570 . . 1 . . . . 71 HIS CD2 . 15208 1 843 . 1 1 70 70 HIS CE1 C 13 139.749 . . 1 . . . . 71 HIS CE1 . 15208 1 844 . 1 1 70 70 HIS N N 15 132.080 . . 1 . . . . 71 HIS N . 15208 1 845 . 1 1 71 71 GLU H H 1 7.696 . . 1 . . . . 72 GLU HN . 15208 1 846 . 1 1 71 71 GLU HA H 1 5.354 . . 1 . . . . 72 GLU HA . 15208 1 847 . 1 1 71 71 GLU HB2 H 1 2.148 . . 1 . . . . 72 GLU QB . 15208 1 848 . 1 1 71 71 GLU HB3 H 1 2.148 . . 1 . . . . 72 GLU QB . 15208 1 849 . 1 1 71 71 GLU HG2 H 1 2.156 . . 2 . . . . 72 GLU HG2 . 15208 1 850 . 1 1 71 71 GLU HG3 H 1 2.034 . . 2 . . . . 72 GLU HG3 . 15208 1 851 . 1 1 71 71 GLU C C 13 173.659 . . 1 . . . . 72 GLU C . 15208 1 852 . 1 1 71 71 GLU CA C 13 55.463 . . 1 . . . . 72 GLU CA . 15208 1 853 . 1 1 71 71 GLU CB C 13 33.395 . . 1 . . . . 72 GLU CB . 15208 1 854 . 1 1 71 71 GLU CG C 13 37.165 . . 1 . . . . 72 GLU CG . 15208 1 855 . 1 1 71 71 GLU N N 15 126.075 . . 1 . . . . 72 GLU N . 15208 1 856 . 1 1 72 72 TYR H H 1 9.511 . . 1 . . . . 73 TYR HN . 15208 1 857 . 1 1 72 72 TYR HA H 1 5.571 . . 1 . . . . 73 TYR HA . 15208 1 858 . 1 1 72 72 TYR HB2 H 1 3.301 . . 2 . . . . 73 TYR HB2 . 15208 1 859 . 1 1 72 72 TYR HB3 H 1 2.981 . . 2 . . . . 73 TYR HB3 . 15208 1 860 . 1 1 72 72 TYR HD1 H 1 6.934 . . 1 . . . . 73 TYR QD . 15208 1 861 . 1 1 72 72 TYR HD2 H 1 6.934 . . 1 . . . . 73 TYR QD . 15208 1 862 . 1 1 72 72 TYR HE1 H 1 6.745 . . 1 . . . . 73 TYR QE . 15208 1 863 . 1 1 72 72 TYR HE2 H 1 6.745 . . 1 . . . . 73 TYR QE . 15208 1 864 . 1 1 72 72 TYR C C 13 173.759 . . 1 . . . . 73 TYR C . 15208 1 865 . 1 1 72 72 TYR CA C 13 55.869 . . 1 . . . . 73 TYR CA . 15208 1 866 . 1 1 72 72 TYR CB C 13 41.999 . . 1 . . . . 73 TYR CB . 15208 1 867 . 1 1 72 72 TYR CD1 C 13 133.724 . . 2 . . . . 73 TYR CD1 . 15208 1 868 . 1 1 72 72 TYR CE1 C 13 117.556 . . 2 . . . . 73 TYR CE1 . 15208 1 869 . 1 1 72 72 TYR N N 15 130.652 . . 1 . . . . 73 TYR N . 15208 1 870 . 1 1 73 73 THR H H 1 8.460 . . 1 . . . . 74 THR HN . 15208 1 871 . 1 1 73 73 THR HA H 1 5.527 . . 1 . . . . 74 THR HA . 15208 1 872 . 1 1 73 73 THR HB H 1 4.115 . . 1 . . . . 74 THR HB . 15208 1 873 . 1 1 73 73 THR HG21 H 1 1.072 . . 1 . . . . 74 THR QG2 . 15208 1 874 . 1 1 73 73 THR HG22 H 1 1.072 . . 1 . . . . 74 THR QG2 . 15208 1 875 . 1 1 73 73 THR HG23 H 1 1.072 . . 1 . . . . 74 THR QG2 . 15208 1 876 . 1 1 73 73 THR C C 13 171.257 . . 1 . . . . 74 THR C . 15208 1 877 . 1 1 73 73 THR CA C 13 59.637 . . 1 . . . . 74 THR CA . 15208 1 878 . 1 1 73 73 THR CB C 13 72.222 . . 1 . . . . 74 THR CB . 15208 1 879 . 1 1 73 73 THR CG2 C 13 20.878 . . 1 . . . . 74 THR CG2 . 15208 1 880 . 1 1 73 73 THR N N 15 118.556 . . 1 . . . . 74 THR N . 15208 1 881 . 1 1 74 74 PHE H H 1 8.609 . . 1 . . . . 75 PHE HN . 15208 1 882 . 1 1 74 74 PHE HA H 1 5.295 . . 1 . . . . 75 PHE HA . 15208 1 883 . 1 1 74 74 PHE HB2 H 1 3.181 . . 2 . . . . 75 PHE HB2 . 15208 1 884 . 1 1 74 74 PHE HB3 H 1 2.796 . . 2 . . . . 75 PHE HB3 . 15208 1 885 . 1 1 74 74 PHE HD1 H 1 6.654 . . 1 . . . . 75 PHE QD . 15208 1 886 . 1 1 74 74 PHE HD2 H 1 6.654 . . 1 . . . . 75 PHE QD . 15208 1 887 . 1 1 74 74 PHE HE1 H 1 7.031 . . 1 . . . . 75 PHE QE . 15208 1 888 . 1 1 74 74 PHE HE2 H 1 7.031 . . 1 . . . . 75 PHE QE . 15208 1 889 . 1 1 74 74 PHE HZ H 1 7.113 . . 1 . . . . 75 PHE HZ . 15208 1 890 . 1 1 74 74 PHE C C 13 173.974 . . 1 . . . . 75 PHE C . 15208 1 891 . 1 1 74 74 PHE CA C 13 55.123 . . 1 . . . . 75 PHE CA . 15208 1 892 . 1 1 74 74 PHE CB C 13 42.555 . . 1 . . . . 75 PHE CB . 15208 1 893 . 1 1 74 74 PHE CD1 C 13 131.834 . . 2 . . . . 75 PHE CD1 . 15208 1 894 . 1 1 74 74 PHE CE1 C 13 130.754 . . 2 . . . . 75 PHE CE1 . 15208 1 895 . 1 1 74 74 PHE CZ C 13 129.091 . . 1 . . . . 75 PHE CZ . 15208 1 896 . 1 1 74 74 PHE N N 15 120.385 . . 1 . . . . 75 PHE N . 15208 1 897 . 1 1 75 75 SER H H 1 8.561 . . 1 . . . . 76 SER HN . 15208 1 898 . 1 1 75 75 SER HA H 1 4.725 . . 1 . . . . 76 SER HA . 15208 1 899 . 1 1 75 75 SER HB2 H 1 3.641 . . 2 . . . . 76 SER HB2 . 15208 1 900 . 1 1 75 75 SER HB3 H 1 3.531 . . 2 . . . . 76 SER HB3 . 15208 1 901 . 1 1 75 75 SER C C 13 171.772 . . 1 . . . . 76 SER C . 15208 1 902 . 1 1 75 75 SER CA C 13 56.581 . . 1 . . . . 76 SER CA . 15208 1 903 . 1 1 75 75 SER CB C 13 65.724 . . 1 . . . . 76 SER CB . 15208 1 904 . 1 1 75 75 SER N N 15 122.140 . . 1 . . . . 76 SER N . 15208 1 905 . 1 1 76 76 ILE H H 1 8.172 . . 1 . . . . 77 ILE HN . 15208 1 906 . 1 1 76 76 ILE HA H 1 4.310 . . 1 . . . . 77 ILE HA . 15208 1 907 . 1 1 76 76 ILE HB H 1 1.648 . . 1 . . . . 77 ILE HB . 15208 1 908 . 1 1 76 76 ILE HG12 H 1 1.298 . . 9 . . . . 77 ILE HG12 . 15208 1 909 . 1 1 76 76 ILE HG13 H 1 0.866 . . 9 . . . . 77 ILE HG13 . 15208 1 910 . 1 1 76 76 ILE HG21 H 1 0.865 . . 1 . . . . 77 ILE QG2 . 15208 1 911 . 1 1 76 76 ILE HG22 H 1 0.865 . . 1 . . . . 77 ILE QG2 . 15208 1 912 . 1 1 76 76 ILE HG23 H 1 0.865 . . 1 . . . . 77 ILE QG2 . 15208 1 913 . 1 1 76 76 ILE HD11 H 1 0.893 . . 1 . . . . 77 ILE QD1 . 15208 1 914 . 1 1 76 76 ILE HD12 H 1 0.893 . . 1 . . . . 77 ILE QD1 . 15208 1 915 . 1 1 76 76 ILE HD13 H 1 0.893 . . 1 . . . . 77 ILE QD1 . 15208 1 916 . 1 1 76 76 ILE C C 13 175.403 . . 1 . . . . 77 ILE C . 15208 1 917 . 1 1 76 76 ILE CA C 13 60.872 . . 1 . . . . 77 ILE CA . 15208 1 918 . 1 1 76 76 ILE CB C 13 39.118 . . 1 . . . . 77 ILE CB . 15208 1 919 . 1 1 76 76 ILE CG1 C 13 28.234 . . 2 . . . . 77 ILE CG1 . 15208 1 920 . 1 1 76 76 ILE CG2 C 13 17.652 . . 2 . . . . 77 ILE CG2 . 15208 1 921 . 1 1 76 76 ILE CD1 C 13 13.526 . . 1 . . . . 77 ILE CD1 . 15208 1 922 . 1 1 76 76 ILE N N 15 122.917 . . 1 . . . . 77 ILE N . 15208 1 923 . 1 1 77 77 MET H H 1 8.502 . . 1 . . . . 78 MET HN . 15208 1 924 . 1 1 77 77 MET HA H 1 4.685 . . 1 . . . . 78 MET HA . 15208 1 925 . 1 1 77 77 MET HB2 H 1 2.069 . . 2 . . . . 78 MET HB2 . 15208 1 926 . 1 1 77 77 MET HB3 H 1 1.675 . . 2 . . . . 78 MET HB3 . 15208 1 927 . 1 1 77 77 MET HG2 H 1 2.406 . . 1 . . . . 78 MET QG . 15208 1 928 . 1 1 77 77 MET HG3 H 1 2.406 . . 1 . . . . 78 MET QG . 15208 1 929 . 1 1 77 77 MET HE1 H 1 2.008 . . 1 . . . . 78 MET QE . 15208 1 930 . 1 1 77 77 MET HE2 H 1 2.008 . . 1 . . . . 78 MET QE . 15208 1 931 . 1 1 77 77 MET HE3 H 1 2.008 . . 1 . . . . 78 MET QE . 15208 1 932 . 1 1 77 77 MET C C 13 174.931 . . 1 . . . . 78 MET C . 15208 1 933 . 1 1 77 77 MET CA C 13 53.897 . . 1 . . . . 78 MET CA . 15208 1 934 . 1 1 77 77 MET CB C 13 33.325 . . 1 . . . . 78 MET CB . 15208 1 935 . 1 1 77 77 MET CG C 13 32.406 . . 1 . . . . 78 MET CG . 15208 1 936 . 1 1 77 77 MET CE C 13 17.299 . . 1 . . . . 78 MET CE . 15208 1 937 . 1 1 77 77 MET N N 15 128.203 . . 1 . . . . 78 MET N . 15208 1 938 . 1 1 78 78 ASP H H 1 8.544 . . 1 . . . . 79 ASP HN . 15208 1 939 . 1 1 78 78 ASP HA H 1 4.211 . . 1 . . . . 79 ASP HA . 15208 1 940 . 1 1 78 78 ASP HB2 H 1 2.808 . . 1 . . . . 79 ASP QB . 15208 1 941 . 1 1 78 78 ASP HB3 H 1 2.808 . . 1 . . . . 79 ASP QB . 15208 1 942 . 1 1 78 78 ASP C C 13 176.261 . . 1 . . . . 79 ASP C . 15208 1 943 . 1 1 78 78 ASP CA C 13 57.111 . . 1 . . . . 79 ASP CA . 15208 1 944 . 1 1 78 78 ASP CB C 13 40.018 . . 1 . . . . 79 ASP CB . 15208 1 945 . 1 1 78 78 ASP N N 15 121.747 . . 1 . . . . 79 ASP N . 15208 1 946 . 1 1 79 79 GLU H H 1 8.374 . . 1 . . . . 80 GLU HN . 15208 1 947 . 1 1 79 79 GLU HA H 1 4.278 . . 1 . . . . 80 GLU HA . 15208 1 948 . 1 1 79 79 GLU HB2 H 1 2.048 . . 2 . . . . 80 GLU HB2 . 15208 1 949 . 1 1 79 79 GLU HB3 H 1 1.879 . . 2 . . . . 80 GLU HB3 . 15208 1 950 . 1 1 79 79 GLU HG2 H 1 2.074 . . 2 . . . . 80 GLU HG2 . 15208 1 951 . 1 1 79 79 GLU HG3 H 1 1.963 . . 2 . . . . 80 GLU HG3 . 15208 1 952 . 1 1 79 79 GLU C C 13 175.275 . . 1 . . . . 80 GLU C . 15208 1 953 . 1 1 79 79 GLU CA C 13 56.664 . . 1 . . . . 80 GLU CA . 15208 1 954 . 1 1 79 79 GLU CB C 13 29.697 . . 1 . . . . 80 GLU CB . 15208 1 955 . 1 1 79 79 GLU CG C 13 36.479 . . 1 . . . . 80 GLU CG . 15208 1 956 . 1 1 79 79 GLU N N 15 115.799 . . 1 . . . . 80 GLU N . 15208 1 957 . 1 1 80 80 PHE H H 1 7.630 . . 1 . . . . 81 PHE HN . 15208 1 958 . 1 1 80 80 PHE HA H 1 5.304 . . 1 . . . . 81 PHE HA . 15208 1 959 . 1 1 80 80 PHE HB2 H 1 3.072 . . 2 . . . . 81 PHE HB2 . 15208 1 960 . 1 1 80 80 PHE HB3 H 1 2.944 . . 2 . . . . 81 PHE HB3 . 15208 1 961 . 1 1 80 80 PHE HD1 H 1 7.119 . . 1 . . . . 81 PHE QD . 15208 1 962 . 1 1 80 80 PHE HD2 H 1 7.119 . . 1 . . . . 81 PHE QD . 15208 1 963 . 1 1 80 80 PHE HE1 H 1 7.369 . . 1 . . . . 81 PHE QE . 15208 1 964 . 1 1 80 80 PHE HE2 H 1 7.369 . . 1 . . . . 81 PHE QE . 15208 1 965 . 1 1 80 80 PHE HZ H 1 7.354 . . 1 . . . . 81 PHE HZ . 15208 1 966 . 1 1 80 80 PHE C C 13 173.974 . . 1 . . . . 81 PHE C . 15208 1 967 . 1 1 80 80 PHE CA C 13 56.736 . . 1 . . . . 81 PHE CA . 15208 1 968 . 1 1 80 80 PHE CB C 13 42.046 . . 1 . . . . 81 PHE CB . 15208 1 969 . 1 1 80 80 PHE CD1 C 13 132.316 . . 2 . . . . 81 PHE CD1 . 15208 1 970 . 1 1 80 80 PHE CE1 C 13 131.401 . . 2 . . . . 81 PHE CE1 . 15208 1 971 . 1 1 80 80 PHE CZ C 13 130.004 . . 1 . . . . 81 PHE CZ . 15208 1 972 . 1 1 80 80 PHE N N 15 116.948 . . 1 . . . . 81 PHE N . 15208 1 973 . 1 1 81 81 GLN H H 1 9.223 . . 1 . . . . 82 GLN HN . 15208 1 974 . 1 1 81 81 GLN HA H 1 4.937 . . 1 . . . . 82 GLN HA . 15208 1 975 . 1 1 81 81 GLN HB2 H 1 2.317 . . 2 . . . . 82 GLN HB2 . 15208 1 976 . 1 1 81 81 GLN HB3 H 1 2.062 . . 2 . . . . 82 GLN HB3 . 15208 1 977 . 1 1 81 81 GLN HG2 H 1 2.494 . . 2 . . . . 82 GLN HG2 . 15208 1 978 . 1 1 81 81 GLN HG3 H 1 2.354 . . 2 . . . . 82 GLN HG3 . 15208 1 979 . 1 1 81 81 GLN HE21 H 1 7.153 . . 2 . . . . 82 GLN HE21 . 15208 1 980 . 1 1 81 81 GLN HE22 H 1 7.077 . . 2 . . . . 82 GLN HE22 . 15208 1 981 . 1 1 81 81 GLN C C 13 174.488 . . 1 . . . . 82 GLN C . 15208 1 982 . 1 1 81 81 GLN CA C 13 54.353 . . 1 . . . . 82 GLN CA . 15208 1 983 . 1 1 81 81 GLN CB C 13 31.319 . . 1 . . . . 82 GLN CB . 15208 1 984 . 1 1 81 81 GLN CG C 13 34.232 . . 1 . . . . 82 GLN CG . 15208 1 985 . 1 1 81 81 GLN N N 15 118.660 . . 1 . . . . 82 GLN N . 15208 1 986 . 1 1 81 81 GLN NE2 N 15 110.492 . . 1 . . . . 82 GLN NE2 . 15208 1 987 . 1 1 82 82 GLU H H 1 8.935 . . 1 . . . . 83 GLU HN . 15208 1 988 . 1 1 82 82 GLU HA H 1 5.415 . . 1 . . . . 83 GLU HA . 15208 1 989 . 1 1 82 82 GLU HB2 H 1 1.935 . . 2 . . . . 83 GLU HB2 . 15208 1 990 . 1 1 82 82 GLU HB3 H 1 1.795 . . 2 . . . . 83 GLU HB3 . 15208 1 991 . 1 1 82 82 GLU HG2 H 1 2.254 . . 2 . . . . 83 GLU HG2 . 15208 1 992 . 1 1 82 82 GLU HG3 H 1 2.139 . . 2 . . . . 83 GLU HG3 . 15208 1 993 . 1 1 82 82 GLU C C 13 175.103 . . 1 . . . . 83 GLU C . 15208 1 994 . 1 1 82 82 GLU CA C 13 54.723 . . 1 . . . . 83 GLU CA . 15208 1 995 . 1 1 82 82 GLU CB C 13 32.746 . . 1 . . . . 83 GLU CB . 15208 1 996 . 1 1 82 82 GLU CG C 13 35.066 . . 1 . . . . 83 GLU CG . 15208 1 997 . 1 1 82 82 GLU N N 15 122.459 . . 1 . . . . 83 GLU N . 15208 1 998 . 1 1 83 83 TYR H H 1 9.375 . . 1 . . . . 84 TYR HN . 15208 1 999 . 1 1 83 83 TYR HA H 1 5.653 . . 1 . . . . 84 TYR HA . 15208 1 1000 . 1 1 83 83 TYR HB2 H 1 2.961 . . 1 . . . . 84 TYR QB . 15208 1 1001 . 1 1 83 83 TYR HB3 H 1 2.961 . . 1 . . . . 84 TYR QB . 15208 1 1002 . 1 1 83 83 TYR HD1 H 1 7.265 . . 1 . . . . 84 TYR QD . 15208 1 1003 . 1 1 83 83 TYR HD2 H 1 7.265 . . 1 . . . . 84 TYR QD . 15208 1 1004 . 1 1 83 83 TYR HE1 H 1 6.664 . . 1 . . . . 84 TYR QE . 15208 1 1005 . 1 1 83 83 TYR HE2 H 1 6.664 . . 1 . . . . 84 TYR QE . 15208 1 1006 . 1 1 83 83 TYR C C 13 176.404 . . 1 . . . . 84 TYR C . 15208 1 1007 . 1 1 83 83 TYR CA C 13 55.972 . . 1 . . . . 84 TYR CA . 15208 1 1008 . 1 1 83 83 TYR CB C 13 42.681 . . 1 . . . . 84 TYR CB . 15208 1 1009 . 1 1 83 83 TYR CD1 C 13 133.570 . . 2 . . . . 84 TYR CD1 . 15208 1 1010 . 1 1 83 83 TYR CE1 C 13 118.992 . . 2 . . . . 84 TYR CE1 . 15208 1 1011 . 1 1 83 83 TYR N N 15 125.223 . . 1 . . . . 84 TYR N . 15208 1 1012 . 1 1 84 84 THR H H 1 8.791 . . 1 . . . . 85 THR HN . 15208 1 1013 . 1 1 84 84 THR HA H 1 5.145 . . 1 . . . . 85 THR HA . 15208 1 1014 . 1 1 84 84 THR HB H 1 4.271 . . 1 . . . . 85 THR HB . 15208 1 1015 . 1 1 84 84 THR HG21 H 1 1.139 . . 1 . . . . 85 THR QG2 . 15208 1 1016 . 1 1 84 84 THR HG22 H 1 1.139 . . 1 . . . . 85 THR QG2 . 15208 1 1017 . 1 1 84 84 THR HG23 H 1 1.139 . . 1 . . . . 85 THR QG2 . 15208 1 1018 . 1 1 84 84 THR C C 13 172.387 . . 1 . . . . 85 THR C . 15208 1 1019 . 1 1 84 84 THR CA C 13 61.377 . . 1 . . . . 85 THR CA . 15208 1 1020 . 1 1 84 84 THR CB C 13 73.011 . . 1 . . . . 85 THR CB . 15208 1 1021 . 1 1 84 84 THR CG2 C 13 21.558 . . 1 . . . . 85 THR CG2 . 15208 1 1022 . 1 1 84 84 THR N N 15 111.879 . . 1 . . . . 85 THR N . 15208 1 1023 . 1 1 85 85 MET H H 1 8.519 . . 1 . . . . 86 MET HN . 15208 1 1024 . 1 1 85 85 MET HA H 1 5.303 . . 1 . . . . 86 MET HA . 15208 1 1025 . 1 1 85 85 MET HB2 H 1 2.080 . . 2 . . . . 86 MET HB2 . 15208 1 1026 . 1 1 85 85 MET HB3 H 1 1.944 . . 2 . . . . 86 MET HB3 . 15208 1 1027 . 1 1 85 85 MET HG2 H 1 2.349 . . 1 . . . . 86 MET QG . 15208 1 1028 . 1 1 85 85 MET HG3 H 1 2.349 . . 1 . . . . 86 MET QG . 15208 1 1029 . 1 1 85 85 MET HE1 H 1 1.817 . . 1 . . . . 86 MET QE . 15208 1 1030 . 1 1 85 85 MET HE2 H 1 1.817 . . 1 . . . . 86 MET QE . 15208 1 1031 . 1 1 85 85 MET HE3 H 1 1.817 . . 1 . . . . 86 MET QE . 15208 1 1032 . 1 1 85 85 MET C C 13 173.630 . . 1 . . . . 86 MET C . 15208 1 1033 . 1 1 85 85 MET CA C 13 54.998 . . 1 . . . . 86 MET CA . 15208 1 1034 . 1 1 85 85 MET CB C 13 38.833 . . 1 . . . . 86 MET CB . 15208 1 1035 . 1 1 85 85 MET CG C 13 30.746 . . 1 . . . . 86 MET CG . 15208 1 1036 . 1 1 85 85 MET CE C 13 15.711 . . 1 . . . . 86 MET CE . 15208 1 1037 . 1 1 85 85 MET N N 15 118.800 . . 1 . . . . 86 MET N . 15208 1 1038 . 1 1 86 86 LEU H H 1 9.119 . . 1 . . . . 87 LEU HN . 15208 1 1039 . 1 1 86 86 LEU HA H 1 4.861 . . 1 . . . . 87 LEU HA . 15208 1 1040 . 1 1 86 86 LEU HB2 H 1 1.874 . . 2 . . . . 87 LEU HB2 . 15208 1 1041 . 1 1 86 86 LEU HB3 H 1 1.492 . . 2 . . . . 87 LEU HB3 . 15208 1 1042 . 1 1 86 86 LEU HG H 1 1.494 . . 1 . . . . 87 LEU HG . 15208 1 1043 . 1 1 86 86 LEU HD11 H 1 0.876 . . 2 . . . . 87 LEU QD1 . 15208 1 1044 . 1 1 86 86 LEU HD12 H 1 0.876 . . 2 . . . . 87 LEU QD1 . 15208 1 1045 . 1 1 86 86 LEU HD13 H 1 0.876 . . 2 . . . . 87 LEU QD1 . 15208 1 1046 . 1 1 86 86 LEU HD21 H 1 0.853 . . 2 . . . . 87 LEU QD2 . 15208 1 1047 . 1 1 86 86 LEU HD22 H 1 0.853 . . 2 . . . . 87 LEU QD2 . 15208 1 1048 . 1 1 86 86 LEU HD23 H 1 0.853 . . 2 . . . . 87 LEU QD2 . 15208 1 1049 . 1 1 86 86 LEU C C 13 175.532 . . 1 . . . . 87 LEU C . 15208 1 1050 . 1 1 86 86 LEU CA C 13 55.337 . . 1 . . . . 87 LEU CA . 15208 1 1051 . 1 1 86 86 LEU CB C 13 44.674 . . 1 . . . . 87 LEU CB . 15208 1 1052 . 1 1 86 86 LEU CG C 13 27.571 . . 1 . . . . 87 LEU CG . 15208 1 1053 . 1 1 86 86 LEU CD1 C 13 25.589 . . 2 . . . . 87 LEU CD1 . 15208 1 1054 . 1 1 86 86 LEU CD2 C 13 24.243 . . 2 . . . . 87 LEU CD2 . 15208 1 1055 . 1 1 86 86 LEU N N 15 128.623 . . 1 . . . . 87 LEU N . 15208 1 1056 . 1 1 87 87 CYS H H 1 8.679 . . 1 . . . . 88 CYS HN . 15208 1 1057 . 1 1 87 87 CYS HA H 1 4.692 . . 1 . . . . 88 CYS HA . 15208 1 1058 . 1 1 87 87 CYS HB2 H 1 2.791 . . 2 . . . . 88 CYS HB2 . 15208 1 1059 . 1 1 87 87 CYS HB3 H 1 2.460 . . 2 . . . . 88 CYS HB3 . 15208 1 1060 . 1 1 87 87 CYS C C 13 174.688 . . 1 . . . . 88 CYS C . 15208 1 1061 . 1 1 87 87 CYS CA C 13 58.837 . . 1 . . . . 88 CYS CA . 15208 1 1062 . 1 1 87 87 CYS CB C 13 32.054 . . 1 . . . . 88 CYS CB . 15208 1 1063 . 1 1 87 87 CYS N N 15 130.163 . . 1 . . . . 88 CYS N . 15208 1 1064 . 1 1 88 88 LEU H H 1 9.601 . . 1 . . . . 89 LEU HN . 15208 1 1065 . 1 1 88 88 LEU HA H 1 2.246 . . 1 . . . . 89 LEU HA . 15208 1 1066 . 1 1 88 88 LEU HB2 H 1 1.443 . . 1 . . . . 89 LEU QB . 15208 1 1067 . 1 1 88 88 LEU HB3 H 1 1.443 . . 1 . . . . 89 LEU QB . 15208 1 1068 . 1 1 88 88 LEU HG H 1 1.312 . . 1 . . . . 89 LEU HG . 15208 1 1069 . 1 1 88 88 LEU HD11 H 1 0.817 . . 2 . . . . 89 LEU QD1 . 15208 1 1070 . 1 1 88 88 LEU HD12 H 1 0.817 . . 2 . . . . 89 LEU QD1 . 15208 1 1071 . 1 1 88 88 LEU HD13 H 1 0.817 . . 2 . . . . 89 LEU QD1 . 15208 1 1072 . 1 1 88 88 LEU HD21 H 1 0.783 . . 2 . . . . 89 LEU QD2 . 15208 1 1073 . 1 1 88 88 LEU HD22 H 1 0.783 . . 2 . . . . 89 LEU QD2 . 15208 1 1074 . 1 1 88 88 LEU HD23 H 1 0.783 . . 2 . . . . 89 LEU QD2 . 15208 1 1075 . 1 1 88 88 LEU C C 13 176.504 . . 1 . . . . 89 LEU C . 15208 1 1076 . 1 1 88 88 LEU CA C 13 59.056 . . 1 . . . . 89 LEU CA . 15208 1 1077 . 1 1 88 88 LEU CB C 13 42.634 . . 1 . . . . 89 LEU CB . 15208 1 1078 . 1 1 88 88 LEU CG C 13 26.747 . . 1 . . . . 89 LEU CG . 15208 1 1079 . 1 1 88 88 LEU CD1 C 13 26.353 . . 2 . . . . 89 LEU CD1 . 15208 1 1080 . 1 1 88 88 LEU CD2 C 13 25.749 . . 2 . . . . 89 LEU CD2 . 15208 1 1081 . 1 1 88 88 LEU N N 15 135.067 . . 1 . . . . 89 LEU N . 15208 1 1082 . 1 1 89 89 LEU H H 1 7.585 . . 1 . . . . 90 LEU HN . 15208 1 1083 . 1 1 89 89 LEU HA H 1 4.354 . . 1 . . . . 90 LEU HA . 15208 1 1084 . 1 1 89 89 LEU HB2 H 1 1.652 . . 2 . . . . 90 LEU HB2 . 15208 1 1085 . 1 1 89 89 LEU HB3 H 1 0.917 . . 2 . . . . 90 LEU HB3 . 15208 1 1086 . 1 1 89 89 LEU HG H 1 1.536 . . 1 . . . . 90 LEU HG . 15208 1 1087 . 1 1 89 89 LEU HD11 H 1 0.809 . . 2 . . . . 90 LEU QD1 . 15208 1 1088 . 1 1 89 89 LEU HD12 H 1 0.809 . . 2 . . . . 90 LEU QD1 . 15208 1 1089 . 1 1 89 89 LEU HD13 H 1 0.809 . . 2 . . . . 90 LEU QD1 . 15208 1 1090 . 1 1 89 89 LEU HD21 H 1 -0.048 . . 2 . . . . 90 LEU QD2 . 15208 1 1091 . 1 1 89 89 LEU HD22 H 1 -0.048 . . 2 . . . . 90 LEU QD2 . 15208 1 1092 . 1 1 89 89 LEU HD23 H 1 -0.048 . . 2 . . . . 90 LEU QD2 . 15208 1 1093 . 1 1 89 89 LEU C C 13 177.877 . . 1 . . . . 90 LEU C . 15208 1 1094 . 1 1 89 89 LEU CA C 13 56.818 . . 1 . . . . 90 LEU CA . 15208 1 1095 . 1 1 89 89 LEU CB C 13 43.701 . . 1 . . . . 90 LEU CB . 15208 1 1096 . 1 1 89 89 LEU CG C 13 27.261 . . 1 . . . . 90 LEU CG . 15208 1 1097 . 1 1 89 89 LEU CD1 C 13 23.665 . . 2 . . . . 90 LEU CD1 . 15208 1 1098 . 1 1 89 89 LEU CD2 C 13 25.761 . . 2 . . . . 90 LEU CD2 . 15208 1 1099 . 1 1 89 89 LEU N N 15 115.629 . . 1 . . . . 90 LEU N . 15208 1 1100 . 1 1 90 90 CYS H H 1 9.255 . . 1 . . . . 91 CYS HN . 15208 1 1101 . 1 1 90 90 CYS HA H 1 4.567 . . 1 . . . . 91 CYS HA . 15208 1 1102 . 1 1 90 90 CYS HB2 H 1 3.097 . . 2 . . . . 91 CYS HB2 . 15208 1 1103 . 1 1 90 90 CYS HB3 H 1 2.888 . . 2 . . . . 91 CYS HB3 . 15208 1 1104 . 1 1 90 90 CYS C C 13 175.260 . . 1 . . . . 91 CYS C . 15208 1 1105 . 1 1 90 90 CYS CA C 13 61.803 . . 1 . . . . 91 CYS CA . 15208 1 1106 . 1 1 90 90 CYS CB C 13 30.534 . . 1 . . . . 91 CYS CB . 15208 1 1107 . 1 1 90 90 CYS N N 15 116.966 . . 1 . . . . 91 CYS N . 15208 1 1108 . 1 1 91 91 GLY H H 1 8.725 . . 1 . . . . 92 GLY HN . 15208 1 1109 . 1 1 91 91 GLY HA2 H 1 5.004 . . 2 . . . . 92 GLY HA2 . 15208 1 1110 . 1 1 91 91 GLY HA3 H 1 3.552 . . 2 . . . . 92 GLY HA3 . 15208 1 1111 . 1 1 91 91 GLY C C 13 172.086 . . 1 . . . . 92 GLY C . 15208 1 1112 . 1 1 91 91 GLY CA C 13 44.575 . . 1 . . . . 92 GLY CA . 15208 1 1113 . 1 1 91 91 GLY N N 15 103.531 . . 1 . . . . 92 GLY N . 15208 1 1114 . 1 1 92 92 LYS H H 1 8.168 . . 1 . . . . 93 LYS HN . 15208 1 1115 . 1 1 92 92 LYS HA H 1 5.318 . . 1 . . . . 93 LYS HA . 15208 1 1116 . 1 1 92 92 LYS HB2 H 1 1.754 . . 2 . . . . 93 LYS HB2 . 15208 1 1117 . 1 1 92 92 LYS HB3 H 1 1.524 . . 2 . . . . 93 LYS HB3 . 15208 1 1118 . 1 1 92 92 LYS HG2 H 1 1.531 . . 2 . . . . 93 LYS HG2 . 15208 1 1119 . 1 1 92 92 LYS HG3 H 1 1.428 . . 2 . . . . 93 LYS HG3 . 15208 1 1120 . 1 1 92 92 LYS HD2 H 1 1.611 . . 1 . . . . 93 LYS QD . 15208 1 1121 . 1 1 92 92 LYS HD3 H 1 1.611 . . 1 . . . . 93 LYS QD . 15208 1 1122 . 1 1 92 92 LYS HE2 H 1 2.896 . . 1 . . . . 93 LYS QE . 15208 1 1123 . 1 1 92 92 LYS HE3 H 1 2.896 . . 1 . . . . 93 LYS QE . 15208 1 1124 . 1 1 92 92 LYS C C 13 174.760 . . 1 . . . . 93 LYS C . 15208 1 1125 . 1 1 92 92 LYS CA C 13 53.673 . . 1 . . . . 93 LYS CA . 15208 1 1126 . 1 1 92 92 LYS CB C 13 36.367 . . 1 . . . . 93 LYS CB . 15208 1 1127 . 1 1 92 92 LYS CG C 13 25.236 . . 1 . . . . 93 LYS CG . 15208 1 1128 . 1 1 92 92 LYS CD C 13 29.466 . . 1 . . . . 93 LYS CD . 15208 1 1129 . 1 1 92 92 LYS CE C 13 41.791 . . 1 . . . . 93 LYS CE . 15208 1 1130 . 1 1 92 92 LYS N N 15 119.229 . . 1 . . . . 93 LYS N . 15208 1 1131 . 1 1 93 93 ALA H H 1 8.767 . . 1 . . . . 94 ALA HN . 15208 1 1132 . 1 1 93 93 ALA HA H 1 4.728 . . 1 . . . . 94 ALA HA . 15208 1 1133 . 1 1 93 93 ALA HB1 H 1 1.118 . . 1 . . . . 94 ALA QB . 15208 1 1134 . 1 1 93 93 ALA HB2 H 1 1.118 . . 1 . . . . 94 ALA QB . 15208 1 1135 . 1 1 93 93 ALA HB3 H 1 1.118 . . 1 . . . . 94 ALA QB . 15208 1 1136 . 1 1 93 93 ALA C C 13 175.246 . . 1 . . . . 94 ALA C . 15208 1 1137 . 1 1 93 93 ALA CA C 13 51.399 . . 1 . . . . 94 ALA CA . 15208 1 1138 . 1 1 93 93 ALA CB C 13 26.673 . . 1 . . . . 94 ALA CB . 15208 1 1139 . 1 1 93 93 ALA N N 15 127.418 . . 1 . . . . 94 ALA N . 15208 1 1140 . 1 1 94 94 GLU H H 1 7.771 . . 1 . . . . 95 GLU HN . 15208 1 1141 . 1 1 94 94 GLU HA H 1 5.104 . . 1 . . . . 95 GLU HA . 15208 1 1142 . 1 1 94 94 GLU HB2 H 1 2.162 . . 2 . . . . 95 GLU HB2 . 15208 1 1143 . 1 1 94 94 GLU HB3 H 1 2.060 . . 2 . . . . 95 GLU HB3 . 15208 1 1144 . 1 1 94 94 GLU HG2 H 1 2.233 . . 1 . . . . 95 GLU QG . 15208 1 1145 . 1 1 94 94 GLU HG3 H 1 2.233 . . 1 . . . . 95 GLU QG . 15208 1 1146 . 1 1 94 94 GLU C C 13 173.731 . . 1 . . . . 95 GLU C . 15208 1 1147 . 1 1 94 94 GLU CA C 13 55.440 . . 1 . . . . 95 GLU CA . 15208 1 1148 . 1 1 94 94 GLU CB C 13 32.917 . . 1 . . . . 95 GLU CB . 15208 1 1149 . 1 1 94 94 GLU CG C 13 35.249 . . 1 . . . . 95 GLU CG . 15208 1 1150 . 1 1 94 94 GLU N N 15 115.801 . . 1 . . . . 95 GLU N . 15208 1 1151 . 1 1 95 95 ASP H H 1 8.935 . . 1 . . . . 96 ASP HN . 15208 1 1152 . 1 1 95 95 ASP HA H 1 5.156 . . 1 . . . . 96 ASP HA . 15208 1 1153 . 1 1 95 95 ASP HB2 H 1 2.961 . . 2 . . . . 96 ASP HB2 . 15208 1 1154 . 1 1 95 95 ASP HB3 H 1 2.615 . . 2 . . . . 96 ASP HB3 . 15208 1 1155 . 1 1 95 95 ASP C C 13 174.760 . . 1 . . . . 96 ASP C . 15208 1 1156 . 1 1 95 95 ASP CA C 13 53.961 . . 1 . . . . 96 ASP CA . 15208 1 1157 . 1 1 95 95 ASP CB C 13 45.072 . . 1 . . . . 96 ASP CB . 15208 1 1158 . 1 1 95 95 ASP N N 15 121.540 . . 1 . . . . 96 ASP N . 15208 1 1159 . 1 1 96 96 THR H H 1 8.208 . . 1 . . . . 97 THR HN . 15208 1 1160 . 1 1 96 96 THR HA H 1 5.421 . . 1 . . . . 97 THR HA . 15208 1 1161 . 1 1 96 96 THR HB H 1 3.878 . . 1 . . . . 97 THR HB . 15208 1 1162 . 1 1 96 96 THR HG21 H 1 1.062 . . 1 . . . . 97 THR QG2 . 15208 1 1163 . 1 1 96 96 THR HG22 H 1 1.062 . . 1 . . . . 97 THR QG2 . 15208 1 1164 . 1 1 96 96 THR HG23 H 1 1.062 . . 1 . . . . 97 THR QG2 . 15208 1 1165 . 1 1 96 96 THR C C 13 173.673 . . 1 . . . . 97 THR C . 15208 1 1166 . 1 1 96 96 THR CA C 13 61.485 . . 1 . . . . 97 THR CA . 15208 1 1167 . 1 1 96 96 THR CB C 13 71.253 . . 1 . . . . 97 THR CB . 15208 1 1168 . 1 1 96 96 THR CG2 C 13 21.894 . . 1 . . . . 97 THR CG2 . 15208 1 1169 . 1 1 96 96 THR N N 15 119.866 . . 1 . . . . 97 THR N . 15208 1 1170 . 1 1 97 97 ILE H H 1 9.373 . . 1 . . . . 98 ILE HN . 15208 1 1171 . 1 1 97 97 ILE HA H 1 4.660 . . 1 . . . . 98 ILE HA . 15208 1 1172 . 1 1 97 97 ILE HB H 1 2.051 . . 1 . . . . 98 ILE HB . 15208 1 1173 . 1 1 97 97 ILE HG12 H 1 1.621 . . 9 . . . . 98 ILE HG12 . 15208 1 1174 . 1 1 97 97 ILE HG13 H 1 1.289 . . 9 . . . . 98 ILE HG13 . 15208 1 1175 . 1 1 97 97 ILE HG21 H 1 1.068 . . 1 . . . . 98 ILE QG2 . 15208 1 1176 . 1 1 97 97 ILE HG22 H 1 1.068 . . 1 . . . . 98 ILE QG2 . 15208 1 1177 . 1 1 97 97 ILE HG23 H 1 1.068 . . 1 . . . . 98 ILE QG2 . 15208 1 1178 . 1 1 97 97 ILE HD11 H 1 0.990 . . 1 . . . . 98 ILE QD1 . 15208 1 1179 . 1 1 97 97 ILE HD12 H 1 0.990 . . 1 . . . . 98 ILE QD1 . 15208 1 1180 . 1 1 97 97 ILE HD13 H 1 0.990 . . 1 . . . . 98 ILE QD1 . 15208 1 1181 . 1 1 97 97 ILE C C 13 175.561 . . 1 . . . . 98 ILE C . 15208 1 1182 . 1 1 97 97 ILE CA C 13 59.941 . . 1 . . . . 98 ILE CA . 15208 1 1183 . 1 1 97 97 ILE CB C 13 41.708 . . 1 . . . . 98 ILE CB . 15208 1 1184 . 1 1 97 97 ILE CG1 C 13 27.499 . . 2 . . . . 98 ILE CG1 . 15208 1 1185 . 1 1 97 97 ILE CG2 C 13 17.662 . . 2 . . . . 98 ILE CG2 . 15208 1 1186 . 1 1 97 97 ILE CD1 C 13 13.498 . . 1 . . . . 98 ILE CD1 . 15208 1 1187 . 1 1 97 97 ILE N N 15 125.974 . . 1 . . . . 98 ILE N . 15208 1 1188 . 1 1 98 98 SER H H 1 8.894 . . 1 . . . . 99 SER HN . 15208 1 1189 . 1 1 98 98 SER HA H 1 4.676 . . 1 . . . . 99 SER HA . 15208 1 1190 . 1 1 98 98 SER HB2 H 1 3.886 . . 1 . . . . 99 SER QB . 15208 1 1191 . 1 1 98 98 SER HB3 H 1 3.886 . . 1 . . . . 99 SER QB . 15208 1 1192 . 1 1 98 98 SER C C 13 174.588 . . 1 . . . . 99 SER C . 15208 1 1193 . 1 1 98 98 SER CA C 13 58.587 . . 1 . . . . 99 SER CA . 15208 1 1194 . 1 1 98 98 SER CB C 13 63.709 . . 1 . . . . 99 SER CB . 15208 1 1195 . 1 1 98 98 SER N N 15 122.066 . . 1 . . . . 99 SER N . 15208 1 1196 . 1 1 99 99 ILE H H 1 8.045 . . 1 . . . . 100 ILE HN . 15208 1 1197 . 1 1 99 99 ILE HA H 1 4.239 . . 1 . . . . 100 ILE HA . 15208 1 1198 . 1 1 99 99 ILE HB H 1 1.793 . . 1 . . . . 100 ILE HB . 15208 1 1199 . 1 1 99 99 ILE HG12 H 1 1.360 . . 9 . . . . 100 ILE HG12 . 15208 1 1200 . 1 1 99 99 ILE HG13 H 1 1.028 . . 9 . . . . 100 ILE HG13 . 15208 1 1201 . 1 1 99 99 ILE HG21 H 1 0.877 . . 1 . . . . 100 ILE QG2 . 15208 1 1202 . 1 1 99 99 ILE HG22 H 1 0.877 . . 1 . . . . 100 ILE QG2 . 15208 1 1203 . 1 1 99 99 ILE HG23 H 1 0.877 . . 1 . . . . 100 ILE QG2 . 15208 1 1204 . 1 1 99 99 ILE HD11 H 1 0.814 . . 1 . . . . 100 ILE QD1 . 15208 1 1205 . 1 1 99 99 ILE HD12 H 1 0.814 . . 1 . . . . 100 ILE QD1 . 15208 1 1206 . 1 1 99 99 ILE HD13 H 1 0.814 . . 1 . . . . 100 ILE QD1 . 15208 1 1207 . 1 1 99 99 ILE C C 13 175.689 . . 1 . . . . 100 ILE C . 15208 1 1208 . 1 1 99 99 ILE CA C 13 61.150 . . 1 . . . . 100 ILE CA . 15208 1 1209 . 1 1 99 99 ILE CB C 13 38.664 . . 1 . . . . 100 ILE CB . 15208 1 1210 . 1 1 99 99 ILE CG1 C 13 27.385 . . 2 . . . . 100 ILE CG1 . 15208 1 1211 . 1 1 99 99 ILE CG2 C 13 17.547 . . 2 . . . . 100 ILE CG2 . 15208 1 1212 . 1 1 99 99 ILE CD1 C 13 13.484 . . 1 . . . . 100 ILE CD1 . 15208 1 1213 . 1 1 99 99 ILE N N 15 123.517 . . 1 . . . . 100 ILE N . 15208 1 1214 . 1 1 100 100 LEU H H 1 8.316 . . 1 . . . . 101 LEU HN . 15208 1 1215 . 1 1 100 100 LEU HA H 1 4.675 . . 1 . . . . 101 LEU HA . 15208 1 1216 . 1 1 100 100 LEU HB2 H 1 1.642 . . 2 . . . . 101 LEU HB2 . 15208 1 1217 . 1 1 100 100 LEU HB3 H 1 1.580 . . 2 . . . . 101 LEU HB3 . 15208 1 1218 . 1 1 100 100 LEU HG H 1 1.672 . . 1 . . . . 101 LEU HG . 15208 1 1219 . 1 1 100 100 LEU HD11 H 1 0.962 . . 2 . . . . 101 LEU QD1 . 15208 1 1220 . 1 1 100 100 LEU HD12 H 1 0.962 . . 2 . . . . 101 LEU QD1 . 15208 1 1221 . 1 1 100 100 LEU HD13 H 1 0.962 . . 2 . . . . 101 LEU QD1 . 15208 1 1222 . 1 1 100 100 LEU HD21 H 1 0.925 . . 2 . . . . 101 LEU QD2 . 15208 1 1223 . 1 1 100 100 LEU HD22 H 1 0.925 . . 2 . . . . 101 LEU QD2 . 15208 1 1224 . 1 1 100 100 LEU HD23 H 1 0.925 . . 2 . . . . 101 LEU QD2 . 15208 1 1225 . 1 1 100 100 LEU C C 13 175.202 . . 1 . . . . 101 LEU C . 15208 1 1226 . 1 1 100 100 LEU CA C 13 52.645 . . 1 . . . . 101 LEU CA . 15208 1 1227 . 1 1 100 100 LEU CB C 13 41.615 . . 1 . . . . 101 LEU CB . 15208 1 1228 . 1 1 100 100 LEU CG C 13 27.031 . . 1 . . . . 101 LEU CG . 15208 1 1229 . 1 1 100 100 LEU CD1 C 13 25.184 . . 2 . . . . 101 LEU CD1 . 15208 1 1230 . 1 1 100 100 LEU CD2 C 13 23.332 . . 2 . . . . 101 LEU CD2 . 15208 1 1231 . 1 1 100 100 LEU N N 15 127.125 . . 1 . . . . 101 LEU N . 15208 1 1232 . 1 1 101 101 PRO HA H 1 4.433 . . 1 . . . . 102 PRO HA . 15208 1 1233 . 1 1 101 101 PRO HB2 H 1 2.302 . . 2 . . . . 102 PRO HB2 . 15208 1 1234 . 1 1 101 101 PRO HB3 H 1 1.942 . . 2 . . . . 102 PRO HB3 . 15208 1 1235 . 1 1 101 101 PRO HG2 H 1 2.041 . . 1 . . . . 102 PRO QG . 15208 1 1236 . 1 1 101 101 PRO HG3 H 1 2.041 . . 1 . . . . 102 PRO QG . 15208 1 1237 . 1 1 101 101 PRO HD2 H 1 3.879 . . 2 . . . . 102 PRO HD2 . 15208 1 1238 . 1 1 101 101 PRO HD3 H 1 3.688 . . 2 . . . . 102 PRO HD3 . 15208 1 1239 . 1 1 101 101 PRO C C 13 176.547 . . 1 . . . . 102 PRO C . 15208 1 1240 . 1 1 101 101 PRO CA C 13 63.065 . . 1 . . . . 102 PRO CA . 15208 1 1241 . 1 1 101 101 PRO CB C 13 32.111 . . 1 . . . . 102 PRO CB . 15208 1 1242 . 1 1 101 101 PRO CG C 13 27.315 . . 1 . . . . 102 PRO CG . 15208 1 1243 . 1 1 101 101 PRO CD C 13 50.603 . . 1 . . . . 102 PRO CD . 15208 1 1244 . 1 1 102 102 ASP H H 1 8.318 . . 1 . . . . 103 ASP HN . 15208 1 1245 . 1 1 102 102 ASP HA H 1 4.557 . . 1 . . . . 103 ASP HA . 15208 1 1246 . 1 1 102 102 ASP HB2 H 1 2.666 . . 2 . . . . 103 ASP HB2 . 15208 1 1247 . 1 1 102 102 ASP HB3 H 1 2.581 . . 2 . . . . 103 ASP HB3 . 15208 1 1248 . 1 1 102 102 ASP C C 13 175.589 . . 1 . . . . 103 ASP C . 15208 1 1249 . 1 1 102 102 ASP CA C 13 54.100 . . 1 . . . . 103 ASP CA . 15208 1 1250 . 1 1 102 102 ASP CB C 13 41.127 . . 1 . . . . 103 ASP CB . 15208 1 1251 . 1 1 102 102 ASP N N 15 120.044 . . 1 . . . . 103 ASP N . 15208 1 1252 . 1 1 103 103 ASP H H 1 8.143 . . 1 . . . . 104 ASP HN . 15208 1 1253 . 1 1 103 103 ASP HA H 1 4.881 . . 1 . . . . 104 ASP HA . 15208 1 1254 . 1 1 103 103 ASP HB2 H 1 2.771 . . 2 . . . . 104 ASP HB2 . 15208 1 1255 . 1 1 103 103 ASP HB3 H 1 2.552 . . 2 . . . . 104 ASP HB3 . 15208 1 1256 . 1 1 103 103 ASP C C 13 174.526 . . 1 . . . . 104 ASP C . 15208 1 1257 . 1 1 103 103 ASP CA C 13 52.135 . . 1 . . . . 104 ASP CA . 15208 1 1258 . 1 1 103 103 ASP CB C 13 41.293 . . 1 . . . . 104 ASP CB . 15208 1 1259 . 1 1 103 103 ASP N N 15 121.836 . . 1 . . . . 104 ASP N . 15208 1 1260 . 1 1 104 104 PRO HA H 1 4.476 . . 1 . . . . 105 PRO HA . 15208 1 1261 . 1 1 104 104 PRO HB2 H 1 2.302 . . 2 . . . . 105 PRO HB2 . 15208 1 1262 . 1 1 104 104 PRO HB3 H 1 2.003 . . 2 . . . . 105 PRO HB3 . 15208 1 1263 . 1 1 104 104 PRO HG2 H 1 2.039 . . 1 . . . . 105 PRO QG . 15208 1 1264 . 1 1 104 104 PRO HG3 H 1 2.039 . . 1 . . . . 105 PRO QG . 15208 1 1265 . 1 1 104 104 PRO HD2 H 1 3.859 . . 2 . . . . 105 PRO HD2 . 15208 1 1266 . 1 1 104 104 PRO HD3 H 1 3.808 . . 2 . . . . 105 PRO HD3 . 15208 1 1267 . 1 1 104 104 PRO C C 13 177.005 . . 1 . . . . 105 PRO C . 15208 1 1268 . 1 1 104 104 PRO CA C 13 63.356 . . 1 . . . . 105 PRO CA . 15208 1 1269 . 1 1 104 104 PRO CB C 13 32.112 . . 1 . . . . 105 PRO CB . 15208 1 1270 . 1 1 104 104 PRO CG C 13 27.141 . . 1 . . . . 105 PRO CG . 15208 1 1271 . 1 1 104 104 PRO CD C 13 50.704 . . 1 . . . . 105 PRO CD . 15208 1 1272 . 1 1 105 105 ARG H H 1 8.454 . . 1 . . . . 106 ARG HN . 15208 1 1273 . 1 1 105 105 ARG HA H 1 4.310 . . 1 . . . . 106 ARG HA . 15208 1 1274 . 1 1 105 105 ARG HB2 H 1 1.930 . . 2 . . . . 106 ARG HB2 . 15208 1 1275 . 1 1 105 105 ARG HB3 H 1 1.831 . . 2 . . . . 106 ARG HB3 . 15208 1 1276 . 1 1 105 105 ARG HG2 H 1 1.696 . . 1 . . . . 106 ARG QG . 15208 1 1277 . 1 1 105 105 ARG HG3 H 1 1.696 . . 1 . . . . 106 ARG QG . 15208 1 1278 . 1 1 105 105 ARG HD2 H 1 3.231 . . 1 . . . . 106 ARG QD . 15208 1 1279 . 1 1 105 105 ARG HD3 H 1 3.231 . . 1 . . . . 106 ARG QD . 15208 1 1280 . 1 1 105 105 ARG HE H 1 7.390 . . 1 . . . . 106 ARG HE . 15208 1 1281 . 1 1 105 105 ARG C C 13 175.603 . . 1 . . . . 106 ARG C . 15208 1 1282 . 1 1 105 105 ARG CA C 13 56.145 . . 1 . . . . 106 ARG CA . 15208 1 1283 . 1 1 105 105 ARG CB C 13 30.413 . . 1 . . . . 106 ARG CB . 15208 1 1284 . 1 1 105 105 ARG CG C 13 27.031 . . 1 . . . . 106 ARG CG . 15208 1 1285 . 1 1 105 105 ARG CD C 13 43.214 . . 1 . . . . 106 ARG CD . 15208 1 1286 . 1 1 105 105 ARG N N 15 121.421 . . 1 . . . . 106 ARG N . 15208 1 1287 . 1 1 105 105 ARG NE N 15 85.123 . . 1 . . . . 106 ARG NE . 15208 1 1288 . 1 1 106 106 GLN H H 1 7.883 . . 1 . . . . 107 GLN HN . 15208 1 1289 . 1 1 106 106 GLN HA H 1 4.173 . . 1 . . . . 107 GLN HA . 15208 1 1290 . 1 1 106 106 GLN HB2 H 1 2.140 . . 2 . . . . 107 GLN HB2 . 15208 1 1291 . 1 1 106 106 GLN HB3 H 1 1.941 . . 2 . . . . 107 GLN HB3 . 15208 1 1292 . 1 1 106 106 GLN HG2 H 1 2.315 . . 1 . . . . 107 GLN QG . 15208 1 1293 . 1 1 106 106 GLN HG3 H 1 2.315 . . 1 . . . . 107 GLN QG . 15208 1 1294 . 1 1 106 106 GLN HE21 H 1 7.556 . . 2 . . . . 107 GLN HE21 . 15208 1 1295 . 1 1 106 106 GLN HE22 H 1 6.816 . . 2 . . . . 107 GLN HE22 . 15208 1 1296 . 1 1 106 106 GLN C C 13 174.281 . . 1 . . . . 107 GLN C . 15208 1 1297 . 1 1 106 106 GLN CA C 13 57.259 . . 1 . . . . 107 GLN CA . 15208 1 1298 . 1 1 106 106 GLN CB C 13 30.438 . . 1 . . . . 107 GLN CB . 15208 1 1299 . 1 1 106 106 GLN CG C 13 34.221 . . 1 . . . . 107 GLN CG . 15208 1 1300 . 1 1 106 106 GLN N N 15 125.813 . . 1 . . . . 107 GLN N . 15208 1 1301 . 1 1 106 106 GLN NE2 N 15 112.446 . . 1 . . . . 107 GLN NE2 . 15208 1 stop_ save_