data_25762 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25762 _Entry.Title ; Structure of Pleiotrophin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-08-20 _Entry.Accession_date 2015-08-20 _Entry.Last_release_date 2016-03-29 _Entry.Original_release_date 2016-03-29 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'Solution Structure of Pleiotrophin' _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.ORCID _Entry_author.Entry_ID 1 Eathen Ryan . O. . . 25762 2 Di Shen . . . . 25762 3 Xu Wang . . . . 25762 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 1 'not applicable' 'not applicable' . 25762 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID angiogenesis . 25762 cytokine . 25762 'glycosaminoglycan-binding protein' . 25762 mitogen . 25762 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25762 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 533 25762 '15N chemical shifts' 127 25762 '1H chemical shifts' 620 25762 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 . . 2016-08-05 2015-08-20 update BMRB 'update entry citation' 25762 1 . . 2016-03-29 2015-08-20 original author 'original release' 25762 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N6F 'BMRB Entry Tracking System' 25762 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25762 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26896299 _Citation.Full_citation . _Citation.Title ; Structural Studies Reveal an Important Role for the Pleiotrophin C Terminus in Mediating Interactions with Chondroitin Sulfate. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS J.' _Citation.Journal_name_full 'FEBS Journal' _Citation.Journal_volume 283 _Citation.Journal_issue 8 _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 1488 _Citation.Page_last 1503 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Eathen Ryan . O. . . 25762 1 2 Di Shen . . . . 25762 1 3 Xu Wang . . . . 25762 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25762 _Assembly.ID 1 _Assembly.Name Pleiotrophin _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 Pleiotrophin 1 $PTN A . yes native no no . . . 25762 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 15 15 SG . 1 . 1 CYS 44 44 SG . . . . . . . . . . 25762 1 2 disulfide single . 1 . 1 CYS 23 23 SG . 1 . 1 CYS 53 53 SG . . . . . . . . . . 25762 1 3 disulfide single . 1 . 1 CYS 30 30 SG . 1 . 1 CYS 57 57 SG . . . . . . . . . . 25762 1 4 disulfide single . 1 . 1 CYS 67 67 SG . 1 . 1 CYS 99 99 SG . . . . . . . . . . 25762 1 5 disulfide single . 1 . 1 CYS 77 77 SG . 1 . 1 CYS 109 109 SG . . . . . . . . . . 25762 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PTN _Entity.Sf_category entity _Entity.Sf_framecode PTN _Entity.Entry_ID 25762 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PTN _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 ; GKKEKPEKKVKKSDCGEWQW SVCVPTSGDCGLGTREGTRT GAECKQTMKTQRCKIPCNWK KQFGAECKYQFQAWGECDLN TALKTRTGSLKRALHNAECQ KTVTISKPCGKLTKPKPQAE SKKKKKEGKKQEKMLD ; _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 136 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15347.028 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes UNP P21246 . pleiotrophin . . . . . . . . . . . . . . 25762 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 25762 1 2 2 LYS . 25762 1 3 3 LYS . 25762 1 4 4 GLU . 25762 1 5 5 LYS . 25762 1 6 6 PRO . 25762 1 7 7 GLU . 25762 1 8 8 LYS . 25762 1 9 9 LYS . 25762 1 10 10 VAL . 25762 1 11 11 LYS . 25762 1 12 12 LYS . 25762 1 13 13 SER . 25762 1 14 14 ASP . 25762 1 15 15 CYS . 25762 1 16 16 GLY . 25762 1 17 17 GLU . 25762 1 18 18 TRP . 25762 1 19 19 GLN . 25762 1 20 20 TRP . 25762 1 21 21 SER . 25762 1 22 22 VAL . 25762 1 23 23 CYS . 25762 1 24 24 VAL . 25762 1 25 25 PRO . 25762 1 26 26 THR . 25762 1 27 27 SER . 25762 1 28 28 GLY . 25762 1 29 29 ASP . 25762 1 30 30 CYS . 25762 1 31 31 GLY . 25762 1 32 32 LEU . 25762 1 33 33 GLY . 25762 1 34 34 THR . 25762 1 35 35 ARG . 25762 1 36 36 GLU . 25762 1 37 37 GLY . 25762 1 38 38 THR . 25762 1 39 39 ARG . 25762 1 40 40 THR . 25762 1 41 41 GLY . 25762 1 42 42 ALA . 25762 1 43 43 GLU . 25762 1 44 44 CYS . 25762 1 45 45 LYS . 25762 1 46 46 GLN . 25762 1 47 47 THR . 25762 1 48 48 MET . 25762 1 49 49 LYS . 25762 1 50 50 THR . 25762 1 51 51 GLN . 25762 1 52 52 ARG . 25762 1 53 53 CYS . 25762 1 54 54 LYS . 25762 1 55 55 ILE . 25762 1 56 56 PRO . 25762 1 57 57 CYS . 25762 1 58 58 ASN . 25762 1 59 59 TRP . 25762 1 60 60 LYS . 25762 1 61 61 LYS . 25762 1 62 62 GLN . 25762 1 63 63 PHE . 25762 1 64 64 GLY . 25762 1 65 65 ALA . 25762 1 66 66 GLU . 25762 1 67 67 CYS . 25762 1 68 68 LYS . 25762 1 69 69 TYR . 25762 1 70 70 GLN . 25762 1 71 71 PHE . 25762 1 72 72 GLN . 25762 1 73 73 ALA . 25762 1 74 74 TRP . 25762 1 75 75 GLY . 25762 1 76 76 GLU . 25762 1 77 77 CYS . 25762 1 78 78 ASP . 25762 1 79 79 LEU . 25762 1 80 80 ASN . 25762 1 81 81 THR . 25762 1 82 82 ALA . 25762 1 83 83 LEU . 25762 1 84 84 LYS . 25762 1 85 85 THR . 25762 1 86 86 ARG . 25762 1 87 87 THR . 25762 1 88 88 GLY . 25762 1 89 89 SER . 25762 1 90 90 LEU . 25762 1 91 91 LYS . 25762 1 92 92 ARG . 25762 1 93 93 ALA . 25762 1 94 94 LEU . 25762 1 95 95 HIS . 25762 1 96 96 ASN . 25762 1 97 97 ALA . 25762 1 98 98 GLU . 25762 1 99 99 CYS . 25762 1 100 100 GLN . 25762 1 101 101 LYS . 25762 1 102 102 THR . 25762 1 103 103 VAL . 25762 1 104 104 THR . 25762 1 105 105 ILE . 25762 1 106 106 SER . 25762 1 107 107 LYS . 25762 1 108 108 PRO . 25762 1 109 109 CYS . 25762 1 110 110 GLY . 25762 1 111 111 LYS . 25762 1 112 112 LEU . 25762 1 113 113 THR . 25762 1 114 114 LYS . 25762 1 115 115 PRO . 25762 1 116 116 LYS . 25762 1 117 117 PRO . 25762 1 118 118 GLN . 25762 1 119 119 ALA . 25762 1 120 120 GLU . 25762 1 121 121 SER . 25762 1 122 122 LYS . 25762 1 123 123 LYS . 25762 1 124 124 LYS . 25762 1 125 125 LYS . 25762 1 126 126 LYS . 25762 1 127 127 GLU . 25762 1 128 128 GLY . 25762 1 129 129 LYS . 25762 1 130 130 LYS . 25762 1 131 131 GLN . 25762 1 132 132 GLU . 25762 1 133 133 LYS . 25762 1 134 134 MET . 25762 1 135 135 LEU . 25762 1 136 136 ASP . 25762 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 . GLY 1 1 25762 1 . LYS 2 2 25762 1 . LYS 3 3 25762 1 . GLU 4 4 25762 1 . LYS 5 5 25762 1 . PRO 6 6 25762 1 . GLU 7 7 25762 1 . LYS 8 8 25762 1 . LYS 9 9 25762 1 . VAL 10 10 25762 1 . LYS 11 11 25762 1 . LYS 12 12 25762 1 . SER 13 13 25762 1 . ASP 14 14 25762 1 . CYS 15 15 25762 1 . GLY 16 16 25762 1 . GLU 17 17 25762 1 . TRP 18 18 25762 1 . GLN 19 19 25762 1 . TRP 20 20 25762 1 . SER 21 21 25762 1 . VAL 22 22 25762 1 . CYS 23 23 25762 1 . VAL 24 24 25762 1 . PRO 25 25 25762 1 . THR 26 26 25762 1 . SER 27 27 25762 1 . GLY 28 28 25762 1 . ASP 29 29 25762 1 . CYS 30 30 25762 1 . GLY 31 31 25762 1 . LEU 32 32 25762 1 . GLY 33 33 25762 1 . THR 34 34 25762 1 . ARG 35 35 25762 1 . GLU 36 36 25762 1 . GLY 37 37 25762 1 . THR 38 38 25762 1 . ARG 39 39 25762 1 . THR 40 40 25762 1 . GLY 41 41 25762 1 . ALA 42 42 25762 1 . GLU 43 43 25762 1 . CYS 44 44 25762 1 . LYS 45 45 25762 1 . GLN 46 46 25762 1 . THR 47 47 25762 1 . MET 48 48 25762 1 . LYS 49 49 25762 1 . THR 50 50 25762 1 . GLN 51 51 25762 1 . ARG 52 52 25762 1 . CYS 53 53 25762 1 . LYS 54 54 25762 1 . ILE 55 55 25762 1 . PRO 56 56 25762 1 . CYS 57 57 25762 1 . ASN 58 58 25762 1 . TRP 59 59 25762 1 . LYS 60 60 25762 1 . LYS 61 61 25762 1 . GLN 62 62 25762 1 . PHE 63 63 25762 1 . GLY 64 64 25762 1 . ALA 65 65 25762 1 . GLU 66 66 25762 1 . CYS 67 67 25762 1 . LYS 68 68 25762 1 . TYR 69 69 25762 1 . GLN 70 70 25762 1 . PHE 71 71 25762 1 . GLN 72 72 25762 1 . ALA 73 73 25762 1 . TRP 74 74 25762 1 . GLY 75 75 25762 1 . GLU 76 76 25762 1 . CYS 77 77 25762 1 . ASP 78 78 25762 1 . LEU 79 79 25762 1 . ASN 80 80 25762 1 . THR 81 81 25762 1 . ALA 82 82 25762 1 . LEU 83 83 25762 1 . LYS 84 84 25762 1 . THR 85 85 25762 1 . ARG 86 86 25762 1 . THR 87 87 25762 1 . GLY 88 88 25762 1 . SER 89 89 25762 1 . LEU 90 90 25762 1 . LYS 91 91 25762 1 . ARG 92 92 25762 1 . ALA 93 93 25762 1 . LEU 94 94 25762 1 . HIS 95 95 25762 1 . ASN 96 96 25762 1 . ALA 97 97 25762 1 . GLU 98 98 25762 1 . CYS 99 99 25762 1 . GLN 100 100 25762 1 . LYS 101 101 25762 1 . THR 102 102 25762 1 . VAL 103 103 25762 1 . THR 104 104 25762 1 . ILE 105 105 25762 1 . SER 106 106 25762 1 . LYS 107 107 25762 1 . PRO 108 108 25762 1 . CYS 109 109 25762 1 . GLY 110 110 25762 1 . LYS 111 111 25762 1 . LEU 112 112 25762 1 . THR 113 113 25762 1 . LYS 114 114 25762 1 . PRO 115 115 25762 1 . LYS 116 116 25762 1 . PRO 117 117 25762 1 . GLN 118 118 25762 1 . ALA 119 119 25762 1 . GLU 120 120 25762 1 . SER 121 121 25762 1 . LYS 122 122 25762 1 . LYS 123 123 25762 1 . LYS 124 124 25762 1 . LYS 125 125 25762 1 . LYS 126 126 25762 1 . GLU 127 127 25762 1 . GLY 128 128 25762 1 . LYS 129 129 25762 1 . LYS 130 130 25762 1 . GLN 131 131 25762 1 . GLU 132 132 25762 1 . LYS 133 133 25762 1 . MET 134 134 25762 1 . LEU 135 135 25762 1 . ASP 136 136 25762 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25762 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PTN . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . ptn . 25762 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 25762 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PTN . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'Origami BL21(DE3)' . . . . . pET-15b . . . 25762 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25762 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PTN '[U-100% 13C; U-100% 15N]' . . 1 $PTN . . 0.6 . . mM 0.05 . . . 25762 1 2 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25762 1 3 MES 'natural abundance' . . . . . . 10 . . mM . . . . 25762 1 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 25762 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25762 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 25762 _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' 0.15 . M 25762 1 pH 6.0 . pH 25762 1 pressure 1 . atm 25762 1 temperature 298 . K 25762 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25762 _Software.ID 1 _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' . . 25762 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25762 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 25762 _Software.ID 2 _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' . . 25762 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25762 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25762 _Software.ID 3 _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' . . 25762 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25762 3 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 25762 _Software.ID 4 _Software.Name X-PLOR_NIH _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 25762 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25762 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25762 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25762 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 25762 _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 Avance . 600 . . . 25762 1 2 spectrometer_2 Varian INOVA . 800 . . . 25762 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 25762 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 4 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 7 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25762 1 8 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25762 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 25762 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 25762 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 25762 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 25762 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 25762 _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 0.04 _Assigned_chem_shift_list.Chem_shift_13C_err 0.5 _Assigned_chem_shift_list.Chem_shift_15N_err 0.5 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25762 1 2 '3D HNCACB' . . . 25762 1 3 '3D CBCA(CO)NH' . . . 25762 1 4 '3D H(CCO)NH' . . . 25762 1 5 '3D 1H-13C NOESY' . . . 25762 1 6 '3D HCCH-TOCSY' . . . 25762 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $NMRView . . 25762 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 GLY C C 13 173.9470 0.5 . 1 . . . A 1 GLY C . 25762 1 2 . 1 1 2 2 LYS H H 1 8.2290 0.04 . 1 . . . A 2 LYS H . 25762 1 3 . 1 1 2 2 LYS CA C 13 56.2980 0.5 . 1 . . . A 2 LYS CA . 25762 1 4 . 1 1 2 2 LYS CB C 13 33.3840 0.5 . 1 . . . A 2 LYS CB . 25762 1 5 . 1 1 2 2 LYS N N 15 121.7400 0.5 . 1 . . . A 2 LYS N . 25762 1 6 . 1 1 6 6 PRO HA H 1 4.4000 0.04 . 1 . . . A 6 PRO HA . 25762 1 7 . 1 1 6 6 PRO HB2 H 1 2.2800 0.04 . 2 . . . A 6 PRO HB2 . 25762 1 8 . 1 1 6 6 PRO HG2 H 1 2.0000 0.04 . 2 . . . A 6 PRO HG2 . 25762 1 9 . 1 1 6 6 PRO HG3 H 1 1.9400 0.04 . 2 . . . A 6 PRO HG3 . 25762 1 10 . 1 1 6 6 PRO HD2 H 1 3.6800 0.04 . 2 . . . A 6 PRO HD2 . 25762 1 11 . 1 1 6 6 PRO C C 13 176.9640 0.5 . 1 . . . A 6 PRO C . 25762 1 12 . 1 1 6 6 PRO CA C 13 63.2000 0.5 . 1 . . . A 6 PRO CA . 25762 1 13 . 1 1 6 6 PRO CB C 13 32.1000 0.5 . 1 . . . A 6 PRO CB . 25762 1 14 . 1 1 6 6 PRO CG C 13 27.3000 0.5 . 1 . . . A 6 PRO CG . 25762 1 15 . 1 1 6 6 PRO CD C 13 50.7000 0.5 . 1 . . . A 6 PRO CD . 25762 1 16 . 1 1 7 7 GLU H H 1 8.5510 0.04 . 1 . . . A 7 GLU H . 25762 1 17 . 1 1 7 7 GLU HA H 1 4.2600 0.04 . 1 . . . A 7 GLU HA . 25762 1 18 . 1 1 7 7 GLU HB2 H 1 2.0000 0.04 . 2 . . . A 7 GLU HB2 . 25762 1 19 . 1 1 7 7 GLU HG2 H 1 2.2600 0.04 . 2 . . . A 7 GLU HG2 . 25762 1 20 . 1 1 7 7 GLU C C 13 176.2260 0.5 . 1 . . . A 7 GLU C . 25762 1 21 . 1 1 7 7 GLU CA C 13 56.4930 0.5 . 1 . . . A 7 GLU CA . 25762 1 22 . 1 1 7 7 GLU CB C 13 30.6100 0.5 . 1 . . . A 7 GLU CB . 25762 1 23 . 1 1 7 7 GLU CG C 13 36.2000 0.5 . 1 . . . A 7 GLU CG . 25762 1 24 . 1 1 7 7 GLU N N 15 122.2850 0.5 . 1 . . . A 7 GLU N . 25762 1 25 . 1 1 8 8 LYS H H 1 8.3460 0.04 . 1 . . . A 8 LYS H . 25762 1 26 . 1 1 8 8 LYS HA H 1 4.3100 0.04 . 1 . . . A 8 LYS HA . 25762 1 27 . 1 1 8 8 LYS HB2 H 1 1.7600 0.04 . 2 . . . A 8 LYS HB2 . 25762 1 28 . 1 1 8 8 LYS HG2 H 1 1.4100 0.04 . 2 . . . A 8 LYS HG2 . 25762 1 29 . 1 1 8 8 LYS HE2 H 1 3.0000 0.04 . 2 . . . A 8 LYS HE2 . 25762 1 30 . 1 1 8 8 LYS C C 13 176.5410 0.5 . 1 . . . A 8 LYS C . 25762 1 31 . 1 1 8 8 LYS CA C 13 56.4400 0.5 . 1 . . . A 8 LYS CA . 25762 1 32 . 1 1 8 8 LYS CB C 13 33.1950 0.5 . 1 . . . A 8 LYS CB . 25762 1 33 . 1 1 8 8 LYS CG C 13 24.8000 0.5 . 1 . . . A 8 LYS CG . 25762 1 34 . 1 1 8 8 LYS CD C 13 29.2000 0.5 . 1 . . . A 8 LYS CD . 25762 1 35 . 1 1 8 8 LYS CE C 13 42.0000 0.5 . 1 . . . A 8 LYS CE . 25762 1 36 . 1 1 8 8 LYS N N 15 122.5720 0.5 . 1 . . . A 8 LYS N . 25762 1 37 . 1 1 9 9 LYS H H 1 8.5050 0.04 . 1 . . . A 9 LYS H . 25762 1 38 . 1 1 9 9 LYS HA H 1 4.3300 0.04 . 1 . . . A 9 LYS HA . 25762 1 39 . 1 1 9 9 LYS HB2 H 1 1.7400 0.04 . 2 . . . A 9 LYS HB2 . 25762 1 40 . 1 1 9 9 LYS HG2 H 1 1.4000 0.04 . 2 . . . A 9 LYS HG2 . 25762 1 41 . 1 1 9 9 LYS HE2 H 1 2.9800 0.04 . 2 . . . A 9 LYS HE2 . 25762 1 42 . 1 1 9 9 LYS C C 13 176.3900 0.5 . 1 . . . A 9 LYS C . 25762 1 43 . 1 1 9 9 LYS CA C 13 56.5370 0.5 . 1 . . . A 9 LYS CA . 25762 1 44 . 1 1 9 9 LYS CB C 13 33.1600 0.5 . 1 . . . A 9 LYS CB . 25762 1 45 . 1 1 9 9 LYS CG C 13 24.7000 0.5 . 1 . . . A 9 LYS CG . 25762 1 46 . 1 1 9 9 LYS CD C 13 28.9000 0.5 . 1 . . . A 9 LYS CD . 25762 1 47 . 1 1 9 9 LYS CE C 13 42.1000 0.5 . 1 . . . A 9 LYS CE . 25762 1 48 . 1 1 9 9 LYS N N 15 123.8430 0.5 . 1 . . . A 9 LYS N . 25762 1 49 . 1 1 10 10 VAL H H 1 8.2060 0.04 . 1 . . . A 10 VAL H . 25762 1 50 . 1 1 10 10 VAL HA H 1 4.0800 0.04 . 1 . . . A 10 VAL HA . 25762 1 51 . 1 1 10 10 VAL HB H 1 2.0100 0.04 . 1 . . . A 10 VAL HB . 25762 1 52 . 1 1 10 10 VAL HG11 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG11 . 25762 1 53 . 1 1 10 10 VAL HG12 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG12 . 25762 1 54 . 1 1 10 10 VAL HG13 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG13 . 25762 1 55 . 1 1 10 10 VAL HG21 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG21 . 25762 1 56 . 1 1 10 10 VAL HG22 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG22 . 25762 1 57 . 1 1 10 10 VAL HG23 H 1 0.9000 0.04 . 2 . . . A 10 VAL HG23 . 25762 1 58 . 1 1 10 10 VAL C C 13 175.8870 0.5 . 1 . . . A 10 VAL C . 25762 1 59 . 1 1 10 10 VAL CA C 13 62.1590 0.5 . 1 . . . A 10 VAL CA . 25762 1 60 . 1 1 10 10 VAL CB C 13 33.0800 0.5 . 1 . . . A 10 VAL CB . 25762 1 61 . 1 1 10 10 VAL CG1 C 13 20.9000 0.5 . 2 . . . A 10 VAL CG1 . 25762 1 62 . 1 1 10 10 VAL CG2 C 13 20.9000 0.5 . 2 . . . A 10 VAL CG2 . 25762 1 63 . 1 1 10 10 VAL N N 15 123.0430 0.5 . 1 . . . A 10 VAL N . 25762 1 64 . 1 1 11 11 LYS H H 1 8.4330 0.04 . 1 . . . A 11 LYS H . 25762 1 65 . 1 1 11 11 LYS HA H 1 4.3200 0.04 . 1 . . . A 11 LYS HA . 25762 1 66 . 1 1 11 11 LYS HB2 H 1 1.7400 0.04 . 2 . . . A 11 LYS HB2 . 25762 1 67 . 1 1 11 11 LYS HG2 H 1 1.4000 0.04 . 2 . . . A 11 LYS HG2 . 25762 1 68 . 1 1 11 11 LYS HE2 H 1 2.9700 0.04 . 2 . . . A 11 LYS HE2 . 25762 1 69 . 1 1 11 11 LYS C C 13 176.2570 0.5 . 1 . . . A 11 LYS C . 25762 1 70 . 1 1 11 11 LYS CA C 13 56.0850 0.5 . 1 . . . A 11 LYS CA . 25762 1 71 . 1 1 11 11 LYS CB C 13 33.3200 0.5 . 1 . . . A 11 LYS CB . 25762 1 72 . 1 1 11 11 LYS CG C 13 24.6000 0.5 . 1 . . . A 11 LYS CG . 25762 1 73 . 1 1 11 11 LYS CD C 13 28.9000 0.5 . 1 . . . A 11 LYS CD . 25762 1 74 . 1 1 11 11 LYS CE C 13 42.0000 0.5 . 1 . . . A 11 LYS CE . 25762 1 75 . 1 1 11 11 LYS N N 15 126.9520 0.5 . 1 . . . A 11 LYS N . 25762 1 76 . 1 1 12 12 LYS H H 1 8.4460 0.04 . 1 . . . A 12 LYS H . 25762 1 77 . 1 1 12 12 LYS HA H 1 4.2600 0.04 . 1 . . . A 12 LYS HA . 25762 1 78 . 1 1 12 12 LYS HB2 H 1 1.7500 0.04 . 2 . . . A 12 LYS HB2 . 25762 1 79 . 1 1 12 12 LYS HG2 H 1 1.4100 0.04 . 2 . . . A 12 LYS HG2 . 25762 1 80 . 1 1 12 12 LYS HE2 H 1 2.9800 0.04 . 2 . . . A 12 LYS HE2 . 25762 1 81 . 1 1 12 12 LYS C C 13 176.3060 0.5 . 1 . . . A 12 LYS C . 25762 1 82 . 1 1 12 12 LYS CA C 13 56.6050 0.5 . 1 . . . A 12 LYS CA . 25762 1 83 . 1 1 12 12 LYS CB C 13 33.4430 0.5 . 1 . . . A 12 LYS CB . 25762 1 84 . 1 1 12 12 LYS CG C 13 24.5000 0.5 . 1 . . . A 12 LYS CG . 25762 1 85 . 1 1 12 12 LYS CD C 13 28.9000 0.5 . 1 . . . A 12 LYS CD . 25762 1 86 . 1 1 12 12 LYS CE C 13 42.1000 0.5 . 1 . . . A 12 LYS CE . 25762 1 87 . 1 1 12 12 LYS N N 15 125.0230 0.5 . 1 . . . A 12 LYS N . 25762 1 88 . 1 1 13 13 SER H H 1 8.3530 0.04 . 1 . . . A 13 SER H . 25762 1 89 . 1 1 13 13 SER HA H 1 4.4600 0.04 . 1 . . . A 13 SER HA . 25762 1 90 . 1 1 13 13 SER HB2 H 1 3.8400 0.04 . 2 . . . A 13 SER HB2 . 25762 1 91 . 1 1 13 13 SER C C 13 174.4560 0.5 . 1 . . . A 13 SER C . 25762 1 92 . 1 1 13 13 SER CA C 13 57.9500 0.5 . 1 . . . A 13 SER CA . 25762 1 93 . 1 1 13 13 SER CB C 13 64.0480 0.5 . 1 . . . A 13 SER CB . 25762 1 94 . 1 1 13 13 SER N N 15 117.8360 0.5 . 1 . . . A 13 SER N . 25762 1 95 . 1 1 14 14 ASP H H 1 8.4790 0.04 . 1 . . . A 14 ASP H . 25762 1 96 . 1 1 14 14 ASP HA H 1 4.5700 0.04 . 1 . . . A 14 ASP HA . 25762 1 97 . 1 1 14 14 ASP HB2 H 1 2.6000 0.04 . 2 . . . A 14 ASP HB2 . 25762 1 98 . 1 1 14 14 ASP C C 13 175.5590 0.5 . 1 . . . A 14 ASP C . 25762 1 99 . 1 1 14 14 ASP CA C 13 54.0450 0.5 . 1 . . . A 14 ASP CA . 25762 1 100 . 1 1 14 14 ASP CB C 13 41.0370 0.5 . 1 . . . A 14 ASP CB . 25762 1 101 . 1 1 14 14 ASP N N 15 124.2560 0.5 . 1 . . . A 14 ASP N . 25762 1 102 . 1 1 15 15 CYS H H 1 7.9010 0.04 . 1 . . . A 15 CYS H . 25762 1 103 . 1 1 15 15 CYS HA H 1 4.6500 0.04 . 1 . . . A 15 CYS HA . 25762 1 104 . 1 1 15 15 CYS HB2 H 1 2.6400 0.04 . 2 . . . A 15 CYS HB2 . 25762 1 105 . 1 1 15 15 CYS C C 13 175.3540 0.5 . 1 . . . A 15 CYS C . 25762 1 106 . 1 1 15 15 CYS CA C 13 55.4130 0.5 . 1 . . . A 15 CYS CA . 25762 1 107 . 1 1 15 15 CYS CB C 13 43.4970 0.5 . 1 . . . A 15 CYS CB . 25762 1 108 . 1 1 15 15 CYS N N 15 117.9540 0.5 . 1 . . . A 15 CYS N . 25762 1 109 . 1 1 16 16 GLY H H 1 8.4470 0.04 . 1 . . . A 16 GLY H . 25762 1 110 . 1 1 16 16 GLY HA2 H 1 3.8000 0.04 . 2 . . . A 16 GLY HA2 . 25762 1 111 . 1 1 16 16 GLY C C 13 172.3000 0.5 . 1 . . . A 16 GLY C . 25762 1 112 . 1 1 16 16 GLY CA C 13 44.2240 0.5 . 1 . . . A 16 GLY CA . 25762 1 113 . 1 1 16 16 GLY N N 15 112.6940 0.5 . 1 . . . A 16 GLY N . 25762 1 114 . 1 1 17 17 GLU H H 1 8.2500 0.04 . 1 . . . A 17 GLU H . 25762 1 115 . 1 1 17 17 GLU HA H 1 4.0900 0.04 . 1 . . . A 17 GLU HA . 25762 1 116 . 1 1 17 17 GLU HB2 H 1 1.8300 0.04 . 2 . . . A 17 GLU HB2 . 25762 1 117 . 1 1 17 17 GLU HB3 H 1 2.0200 0.04 . 2 . . . A 17 GLU HB3 . 25762 1 118 . 1 1 17 17 GLU HG2 H 1 2.3700 0.04 . 2 . . . A 17 GLU HG2 . 25762 1 119 . 1 1 17 17 GLU C C 13 177.5710 0.5 . 1 . . . A 17 GLU C . 25762 1 120 . 1 1 17 17 GLU CA C 13 55.9000 0.5 . 1 . . . A 17 GLU CA . 25762 1 121 . 1 1 17 17 GLU CB C 13 30.5000 0.5 . 1 . . . A 17 GLU CB . 25762 1 122 . 1 1 17 17 GLU CG C 13 36.2000 0.5 . 1 . . . A 17 GLU CG . 25762 1 123 . 1 1 17 17 GLU N N 15 118.5000 0.5 . 1 . . . A 17 GLU N . 25762 1 124 . 1 1 18 18 TRP H H 1 8.3190 0.04 . 1 . . . A 18 TRP H . 25762 1 125 . 1 1 18 18 TRP HA H 1 4.0400 0.04 . 1 . . . A 18 TRP HA . 25762 1 126 . 1 1 18 18 TRP HB2 H 1 2.8800 0.04 . 2 . . . A 18 TRP HB2 . 25762 1 127 . 1 1 18 18 TRP HB3 H 1 2.8600 0.04 . 2 . . . A 18 TRP HB3 . 25762 1 128 . 1 1 18 18 TRP HD1 H 1 7.4400 0.04 . 1 . . . A 18 TRP HD1 . 25762 1 129 . 1 1 18 18 TRP HE1 H 1 10.1000 0.04 . 1 . . . A 18 TRP HE1 . 25762 1 130 . 1 1 18 18 TRP HE3 H 1 6.4100 0.04 . 1 . . . A 18 TRP HE3 . 25762 1 131 . 1 1 18 18 TRP HZ2 H 1 7.2700 0.04 . 1 . . . A 18 TRP HZ2 . 25762 1 132 . 1 1 18 18 TRP HZ3 H 1 6.4800 0.04 . 1 . . . A 18 TRP HZ3 . 25762 1 133 . 1 1 18 18 TRP HH2 H 1 6.5000 0.04 . 1 . . . A 18 TRP HH2 . 25762 1 134 . 1 1 18 18 TRP C C 13 176.3100 0.5 . 1 . . . A 18 TRP C . 25762 1 135 . 1 1 18 18 TRP CA C 13 58.5150 0.5 . 1 . . . A 18 TRP CA . 25762 1 136 . 1 1 18 18 TRP CB C 13 30.3650 0.5 . 1 . . . A 18 TRP CB . 25762 1 137 . 1 1 18 18 TRP CD1 C 13 128.0000 0.5 . 1 . . . A 18 TRP CD1 . 25762 1 138 . 1 1 18 18 TRP CE3 C 13 121.6000 0.5 . 1 . . . A 18 TRP CE3 . 25762 1 139 . 1 1 18 18 TRP CZ2 C 13 114.2000 0.5 . 1 . . . A 18 TRP CZ2 . 25762 1 140 . 1 1 18 18 TRP CZ3 C 13 118.9000 0.5 . 1 . . . A 18 TRP CZ3 . 25762 1 141 . 1 1 18 18 TRP CH2 C 13 123.5000 0.5 . 1 . . . A 18 TRP CH2 . 25762 1 142 . 1 1 18 18 TRP N N 15 122.7180 0.5 . 1 . . . A 18 TRP N . 25762 1 143 . 1 1 18 18 TRP NE1 N 15 128.6000 0.5 . 1 . . . A 18 TRP NE1 . 25762 1 144 . 1 1 19 19 GLN H H 1 9.1400 0.04 . 1 . . . A 19 GLN H . 25762 1 145 . 1 1 19 19 GLN HA H 1 4.5300 0.04 . 1 . . . A 19 GLN HA . 25762 1 146 . 1 1 19 19 GLN HB2 H 1 2.0600 0.04 . 2 . . . A 19 GLN HB2 . 25762 1 147 . 1 1 19 19 GLN HG2 H 1 2.3400 0.04 . 2 . . . A 19 GLN HG2 . 25762 1 148 . 1 1 19 19 GLN C C 13 175.5710 0.5 . 1 . . . A 19 GLN C . 25762 1 149 . 1 1 19 19 GLN CA C 13 54.1860 0.5 . 1 . . . A 19 GLN CA . 25762 1 150 . 1 1 19 19 GLN CB C 13 29.8970 0.5 . 1 . . . A 19 GLN CB . 25762 1 151 . 1 1 19 19 GLN CG C 13 33.6000 0.5 . 1 . . . A 19 GLN CG . 25762 1 152 . 1 1 19 19 GLN N N 15 123.3050 0.5 . 1 . . . A 19 GLN N . 25762 1 153 . 1 1 20 20 TRP H H 1 8.7830 0.04 . 1 . . . A 20 TRP H . 25762 1 154 . 1 1 20 20 TRP HA H 1 5.2900 0.04 . 1 . . . A 20 TRP HA . 25762 1 155 . 1 1 20 20 TRP HB2 H 1 3.2400 0.04 . 2 . . . A 20 TRP HB2 . 25762 1 156 . 1 1 20 20 TRP HB3 H 1 3.0000 0.04 . 2 . . . A 20 TRP HB3 . 25762 1 157 . 1 1 20 20 TRP HD1 H 1 7.2100 0.04 . 1 . . . A 20 TRP HD1 . 25762 1 158 . 1 1 20 20 TRP HE1 H 1 9.9500 0.04 . 1 . . . A 20 TRP HE1 . 25762 1 159 . 1 1 20 20 TRP HE3 H 1 7.0200 0.04 . 1 . . . A 20 TRP HE3 . 25762 1 160 . 1 1 20 20 TRP HZ2 H 1 6.6900 0.04 . 1 . . . A 20 TRP HZ2 . 25762 1 161 . 1 1 20 20 TRP HZ3 H 1 6.5100 0.04 . 1 . . . A 20 TRP HZ3 . 25762 1 162 . 1 1 20 20 TRP HH2 H 1 6.0300 0.04 . 1 . . . A 20 TRP HH2 . 25762 1 163 . 1 1 20 20 TRP C C 13 177.5960 0.5 . 1 . . . A 20 TRP C . 25762 1 164 . 1 1 20 20 TRP CA C 13 56.6510 0.5 . 1 . . . A 20 TRP CA . 25762 1 165 . 1 1 20 20 TRP CB C 13 32.7200 0.5 . 1 . . . A 20 TRP CB . 25762 1 166 . 1 1 20 20 TRP CD1 C 13 127.5000 0.5 . 1 . . . A 20 TRP CD1 . 25762 1 167 . 1 1 20 20 TRP CE3 C 13 119.1000 0.5 . 1 . . . A 20 TRP CE3 . 25762 1 168 . 1 1 20 20 TRP CZ2 C 13 113.9000 0.5 . 1 . . . A 20 TRP CZ2 . 25762 1 169 . 1 1 20 20 TRP CZ3 C 13 120.8000 0.5 . 1 . . . A 20 TRP CZ3 . 25762 1 170 . 1 1 20 20 TRP CH2 C 13 122.7000 0.5 . 1 . . . A 20 TRP CH2 . 25762 1 171 . 1 1 20 20 TRP N N 15 125.3110 0.5 . 1 . . . A 20 TRP N . 25762 1 172 . 1 1 20 20 TRP NE1 N 15 129.0000 0.5 . 1 . . . A 20 TRP NE1 . 25762 1 173 . 1 1 21 21 SER H H 1 9.1730 0.04 . 1 . . . A 21 SER H . 25762 1 174 . 1 1 21 21 SER HA H 1 4.4400 0.04 . 1 . . . A 21 SER HA . 25762 1 175 . 1 1 21 21 SER HB2 H 1 4.2200 0.04 . 2 . . . A 21 SER HB2 . 25762 1 176 . 1 1 21 21 SER C C 13 173.7950 0.5 . 1 . . . A 21 SER C . 25762 1 177 . 1 1 21 21 SER CA C 13 57.2920 0.5 . 1 . . . A 21 SER CA . 25762 1 178 . 1 1 21 21 SER CB C 13 65.4350 0.5 . 1 . . . A 21 SER CB . 25762 1 179 . 1 1 21 21 SER N N 15 120.0410 0.5 . 1 . . . A 21 SER N . 25762 1 180 . 1 1 22 22 VAL H H 1 8.0990 0.04 . 1 . . . A 22 VAL H . 25762 1 181 . 1 1 22 22 VAL HA H 1 4.1300 0.04 . 1 . . . A 22 VAL HA . 25762 1 182 . 1 1 22 22 VAL HB H 1 2.2000 0.04 . 1 . . . A 22 VAL HB . 25762 1 183 . 1 1 22 22 VAL HG21 H 1 0.9700 0.04 . 2 . . . A 22 VAL HG21 . 25762 1 184 . 1 1 22 22 VAL HG22 H 1 0.9700 0.04 . 2 . . . A 22 VAL HG22 . 25762 1 185 . 1 1 22 22 VAL HG23 H 1 0.9700 0.04 . 2 . . . A 22 VAL HG23 . 25762 1 186 . 1 1 22 22 VAL C C 13 175.1830 0.5 . 1 . . . A 22 VAL C . 25762 1 187 . 1 1 22 22 VAL CA C 13 62.0080 0.5 . 1 . . . A 22 VAL CA . 25762 1 188 . 1 1 22 22 VAL CB C 13 32.8590 0.5 . 1 . . . A 22 VAL CB . 25762 1 189 . 1 1 22 22 VAL CG2 C 13 21.0000 0.5 . 2 . . . A 22 VAL CG2 . 25762 1 190 . 1 1 22 22 VAL N N 15 115.3360 0.5 . 1 . . . A 22 VAL N . 25762 1 191 . 1 1 23 23 CYS H H 1 8.4330 0.04 . 1 . . . A 23 CYS H . 25762 1 192 . 1 1 23 23 CYS HA H 1 4.3300 0.04 . 1 . . . A 23 CYS HA . 25762 1 193 . 1 1 23 23 CYS HB2 H 1 2.8400 0.04 . 2 . . . A 23 CYS HB2 . 25762 1 194 . 1 1 23 23 CYS C C 13 173.3350 0.5 . 1 . . . A 23 CYS C . 25762 1 195 . 1 1 23 23 CYS CA C 13 56.5980 0.5 . 1 . . . A 23 CYS CA . 25762 1 196 . 1 1 23 23 CYS CB C 13 42.1660 0.5 . 1 . . . A 23 CYS CB . 25762 1 197 . 1 1 23 23 CYS N N 15 122.1540 0.5 . 1 . . . A 23 CYS N . 25762 1 198 . 1 1 24 24 VAL H H 1 8.7900 0.04 . 1 . . . A 24 VAL H . 25762 1 199 . 1 1 24 24 VAL HA H 1 4.2600 0.04 . 1 . . . A 24 VAL HA . 25762 1 200 . 1 1 24 24 VAL HB H 1 1.7900 0.04 . 1 . . . A 24 VAL HB . 25762 1 201 . 1 1 24 24 VAL HG11 H 1 0.8400 0.04 . 2 . . . A 24 VAL HG11 . 25762 1 202 . 1 1 24 24 VAL HG12 H 1 0.8400 0.04 . 2 . . . A 24 VAL HG12 . 25762 1 203 . 1 1 24 24 VAL HG13 H 1 0.8400 0.04 . 2 . . . A 24 VAL HG13 . 25762 1 204 . 1 1 24 24 VAL CA C 13 59.4090 0.5 . 1 . . . A 24 VAL CA . 25762 1 205 . 1 1 24 24 VAL CB C 13 33.5720 0.5 . 1 . . . A 24 VAL CB . 25762 1 206 . 1 1 24 24 VAL N N 15 133.0080 0.5 . 1 . . . A 24 VAL N . 25762 1 207 . 1 1 25 25 PRO HA H 1 4.3800 0.04 . 1 . . . A 25 PRO HA . 25762 1 208 . 1 1 25 25 PRO HB2 H 1 1.6000 0.04 . 2 . . . A 25 PRO HB2 . 25762 1 209 . 1 1 25 25 PRO C C 13 176.8530 0.5 . 1 . . . A 25 PRO C . 25762 1 210 . 1 1 25 25 PRO CA C 13 62.7000 0.5 . 1 . . . A 25 PRO CA . 25762 1 211 . 1 1 25 25 PRO CB C 13 31.6000 0.5 . 1 . . . A 25 PRO CB . 25762 1 212 . 1 1 25 25 PRO CG C 13 27.1000 0.5 . 1 . . . A 25 PRO CG . 25762 1 213 . 1 1 26 26 THR H H 1 9.1990 0.04 . 1 . . . A 26 THR H . 25762 1 214 . 1 1 26 26 THR HA H 1 3.9700 0.04 . 1 . . . A 26 THR HA . 25762 1 215 . 1 1 26 26 THR HB H 1 3.9700 0.04 . 1 . . . A 26 THR HB . 25762 1 216 . 1 1 26 26 THR HG21 H 1 1.2400 0.04 . 1 . . . A 26 THR HG21 . 25762 1 217 . 1 1 26 26 THR HG22 H 1 1.2400 0.04 . 1 . . . A 26 THR HG22 . 25762 1 218 . 1 1 26 26 THR HG23 H 1 1.2400 0.04 . 1 . . . A 26 THR HG23 . 25762 1 219 . 1 1 26 26 THR C C 13 174.8910 0.5 . 1 . . . A 26 THR C . 25762 1 220 . 1 1 26 26 THR CA C 13 65.5980 0.5 . 1 . . . A 26 THR CA . 25762 1 221 . 1 1 26 26 THR CB C 13 69.1360 0.5 . 1 . . . A 26 THR CB . 25762 1 222 . 1 1 26 26 THR CG2 C 13 22.4000 0.5 . 1 . . . A 26 THR CG2 . 25762 1 223 . 1 1 26 26 THR N N 15 121.7290 0.5 . 1 . . . A 26 THR N . 25762 1 224 . 1 1 27 27 SER H H 1 8.6760 0.04 . 1 . . . A 27 SER H . 25762 1 225 . 1 1 27 27 SER HA H 1 4.5900 0.04 . 1 . . . A 27 SER HA . 25762 1 226 . 1 1 27 27 SER HB2 H 1 3.7700 0.04 . 2 . . . A 27 SER HB2 . 25762 1 227 . 1 1 27 27 SER HB3 H 1 3.7200 0.04 . 2 . . . A 27 SER HB3 . 25762 1 228 . 1 1 27 27 SER C C 13 173.7000 0.5 . 1 . . . A 27 SER C . 25762 1 229 . 1 1 27 27 SER CA C 13 57.3260 0.5 . 1 . . . A 27 SER CA . 25762 1 230 . 1 1 27 27 SER CB C 13 64.7490 0.5 . 1 . . . A 27 SER CB . 25762 1 231 . 1 1 27 27 SER N N 15 115.4950 0.5 . 1 . . . A 27 SER N . 25762 1 232 . 1 1 28 28 GLY H H 1 8.4820 0.04 . 1 . . . A 28 GLY H . 25762 1 233 . 1 1 28 28 GLY HA2 H 1 3.7400 0.04 . 2 . . . A 28 GLY HA2 . 25762 1 234 . 1 1 28 28 GLY HA3 H 1 4.0900 0.04 . 2 . . . A 28 GLY HA3 . 25762 1 235 . 1 1 28 28 GLY C C 13 173.8030 0.5 . 1 . . . A 28 GLY C . 25762 1 236 . 1 1 28 28 GLY CA C 13 45.9650 0.5 . 1 . . . A 28 GLY CA . 25762 1 237 . 1 1 28 28 GLY N N 15 111.4920 0.5 . 1 . . . A 28 GLY N . 25762 1 238 . 1 1 29 29 ASP H H 1 8.4120 0.04 . 1 . . . A 29 ASP H . 25762 1 239 . 1 1 29 29 ASP HA H 1 4.7500 0.04 . 1 . . . A 29 ASP HA . 25762 1 240 . 1 1 29 29 ASP HB2 H 1 2.6200 0.04 . 2 . . . A 29 ASP HB2 . 25762 1 241 . 1 1 29 29 ASP HB3 H 1 2.7900 0.04 . 2 . . . A 29 ASP HB3 . 25762 1 242 . 1 1 29 29 ASP C C 13 175.8060 0.5 . 1 . . . A 29 ASP C . 25762 1 243 . 1 1 29 29 ASP CA C 13 53.4760 0.5 . 1 . . . A 29 ASP CA . 25762 1 244 . 1 1 29 29 ASP CB C 13 42.1400 0.5 . 1 . . . A 29 ASP CB . 25762 1 245 . 1 1 29 29 ASP N N 15 118.8930 0.5 . 1 . . . A 29 ASP N . 25762 1 246 . 1 1 30 30 CYS H H 1 7.9830 0.04 . 1 . . . A 30 CYS H . 25762 1 247 . 1 1 30 30 CYS HA H 1 3.8400 0.04 . 1 . . . A 30 CYS HA . 25762 1 248 . 1 1 30 30 CYS HB2 H 1 2.8700 0.04 . 2 . . . A 30 CYS HB2 . 25762 1 249 . 1 1 30 30 CYS C C 13 170.7670 0.5 . 1 . . . A 30 CYS C . 25762 1 250 . 1 1 30 30 CYS CA C 13 56.0600 0.5 . 1 . . . A 30 CYS CA . 25762 1 251 . 1 1 30 30 CYS CB C 13 47.9000 0.5 . 1 . . . A 30 CYS CB . 25762 1 252 . 1 1 30 30 CYS N N 15 113.9370 0.5 . 1 . . . A 30 CYS N . 25762 1 253 . 1 1 31 31 GLY H H 1 9.3760 0.04 . 1 . . . A 31 GLY H . 25762 1 254 . 1 1 31 31 GLY HA2 H 1 3.7400 0.04 . 2 . . . A 31 GLY HA2 . 25762 1 255 . 1 1 31 31 GLY HA3 H 1 4.5900 0.04 . 2 . . . A 31 GLY HA3 . 25762 1 256 . 1 1 31 31 GLY C C 13 173.8040 0.5 . 1 . . . A 31 GLY C . 25762 1 257 . 1 1 31 31 GLY CA C 13 44.0430 0.5 . 1 . . . A 31 GLY CA . 25762 1 258 . 1 1 31 31 GLY N N 15 110.9720 0.5 . 1 . . . A 31 GLY N . 25762 1 259 . 1 1 32 32 LEU H H 1 8.4930 0.04 . 1 . . . A 32 LEU H . 25762 1 260 . 1 1 32 32 LEU HA H 1 4.4400 0.04 . 1 . . . A 32 LEU HA . 25762 1 261 . 1 1 32 32 LEU HB2 H 1 1.7400 0.04 . 2 . . . A 32 LEU HB2 . 25762 1 262 . 1 1 32 32 LEU HD11 H 1 0.9100 0.04 . 2 . . . A 32 LEU HD11 . 25762 1 263 . 1 1 32 32 LEU HD12 H 1 0.9100 0.04 . 2 . . . A 32 LEU HD12 . 25762 1 264 . 1 1 32 32 LEU HD13 H 1 0.9100 0.04 . 2 . . . A 32 LEU HD13 . 25762 1 265 . 1 1 32 32 LEU HD21 H 1 0.8400 0.04 . 2 . . . A 32 LEU HD21 . 25762 1 266 . 1 1 32 32 LEU HD22 H 1 0.8400 0.04 . 2 . . . A 32 LEU HD22 . 25762 1 267 . 1 1 32 32 LEU HD23 H 1 0.8400 0.04 . 2 . . . A 32 LEU HD23 . 25762 1 268 . 1 1 32 32 LEU C C 13 177.8020 0.5 . 1 . . . A 32 LEU C . 25762 1 269 . 1 1 32 32 LEU CA C 13 55.9040 0.5 . 1 . . . A 32 LEU CA . 25762 1 270 . 1 1 32 32 LEU CB C 13 42.8250 0.5 . 1 . . . A 32 LEU CB . 25762 1 271 . 1 1 32 32 LEU CG C 13 27.1000 0.5 . 1 . . . A 32 LEU CG . 25762 1 272 . 1 1 32 32 LEU CD1 C 13 23.6000 0.5 . 2 . . . A 32 LEU CD1 . 25762 1 273 . 1 1 32 32 LEU CD2 C 13 23.6000 0.5 . 2 . . . A 32 LEU CD2 . 25762 1 274 . 1 1 32 32 LEU N N 15 123.0770 0.5 . 1 . . . A 32 LEU N . 25762 1 275 . 1 1 33 33 GLY H H 1 8.6580 0.04 . 1 . . . A 33 GLY H . 25762 1 276 . 1 1 33 33 GLY HA2 H 1 3.9900 0.04 . 2 . . . A 33 GLY HA2 . 25762 1 277 . 1 1 33 33 GLY HA3 H 1 4.7500 0.04 . 2 . . . A 33 GLY HA3 . 25762 1 278 . 1 1 33 33 GLY C C 13 174.2790 0.5 . 1 . . . A 33 GLY C . 25762 1 279 . 1 1 33 33 GLY CA C 13 45.9300 0.5 . 1 . . . A 33 GLY CA . 25762 1 280 . 1 1 33 33 GLY N N 15 110.4360 0.5 . 1 . . . A 33 GLY N . 25762 1 281 . 1 1 34 34 THR H H 1 8.0400 0.04 . 1 . . . A 34 THR H . 25762 1 282 . 1 1 34 34 THR HA H 1 5.1660 0.04 . 1 . . . A 34 THR HA . 25762 1 283 . 1 1 34 34 THR HB H 1 3.9060 0.04 . 1 . . . A 34 THR HB . 25762 1 284 . 1 1 34 34 THR HG21 H 1 1.0700 0.04 . 1 . . . A 34 THR HG21 . 25762 1 285 . 1 1 34 34 THR HG22 H 1 1.0700 0.04 . 1 . . . A 34 THR HG22 . 25762 1 286 . 1 1 34 34 THR HG23 H 1 1.0700 0.04 . 1 . . . A 34 THR HG23 . 25762 1 287 . 1 1 34 34 THR C C 13 173.2460 0.5 . 1 . . . A 34 THR C . 25762 1 288 . 1 1 34 34 THR CA C 13 60.7760 0.5 . 1 . . . A 34 THR CA . 25762 1 289 . 1 1 34 34 THR CB C 13 72.8920 0.5 . 1 . . . A 34 THR CB . 25762 1 290 . 1 1 34 34 THR CG2 C 13 22.4000 0.5 . 1 . . . A 34 THR CG2 . 25762 1 291 . 1 1 34 34 THR N N 15 113.1180 0.5 . 1 . . . A 34 THR N . 25762 1 292 . 1 1 35 35 ARG H H 1 9.1040 0.04 . 1 . . . A 35 ARG H . 25762 1 293 . 1 1 35 35 ARG HA H 1 4.9800 0.04 . 1 . . . A 35 ARG HA . 25762 1 294 . 1 1 35 35 ARG HB2 H 1 1.7600 0.04 . 2 . . . A 35 ARG HB2 . 25762 1 295 . 1 1 35 35 ARG C C 13 173.8020 0.5 . 1 . . . A 35 ARG C . 25762 1 296 . 1 1 35 35 ARG CA C 13 54.1000 0.5 . 1 . . . A 35 ARG CA . 25762 1 297 . 1 1 35 35 ARG CB C 13 33.7900 0.5 . 1 . . . A 35 ARG CB . 25762 1 298 . 1 1 35 35 ARG N N 15 120.3710 0.5 . 1 . . . A 35 ARG N . 25762 1 299 . 1 1 36 36 GLU H H 1 8.7500 0.04 . 1 . . . A 36 GLU H . 25762 1 300 . 1 1 36 36 GLU HA H 1 5.1600 0.04 . 1 . . . A 36 GLU HA . 25762 1 301 . 1 1 36 36 GLU HB2 H 1 2.0300 0.04 . 2 . . . A 36 GLU HB2 . 25762 1 302 . 1 1 36 36 GLU HG2 H 1 2.2300 0.04 . 2 . . . A 36 GLU HG2 . 25762 1 303 . 1 1 36 36 GLU C C 13 175.9600 0.5 . 1 . . . A 36 GLU C . 25762 1 304 . 1 1 36 36 GLU CA C 13 55.2090 0.5 . 1 . . . A 36 GLU CA . 25762 1 305 . 1 1 36 36 GLU CB C 13 32.6520 0.5 . 1 . . . A 36 GLU CB . 25762 1 306 . 1 1 36 36 GLU CG C 13 36.3400 0.5 . 1 . . . A 36 GLU CG . 25762 1 307 . 1 1 36 36 GLU N N 15 122.2590 0.5 . 1 . . . A 36 GLU N . 25762 1 308 . 1 1 37 37 GLY H H 1 9.4790 0.04 . 1 . . . A 37 GLY H . 25762 1 309 . 1 1 37 37 GLY HA3 H 1 4.8400 0.04 . 2 . . . A 37 GLY HA3 . 25762 1 310 . 1 1 37 37 GLY C C 13 173.0970 0.5 . 1 . . . A 37 GLY C . 25762 1 311 . 1 1 37 37 GLY CA C 13 44.1950 0.5 . 1 . . . A 37 GLY CA . 25762 1 312 . 1 1 37 37 GLY N N 15 116.8950 0.5 . 1 . . . A 37 GLY N . 25762 1 313 . 1 1 38 38 THR H H 1 8.4850 0.04 . 1 . . . A 38 THR H . 25762 1 314 . 1 1 38 38 THR HA H 1 5.5400 0.04 . 1 . . . A 38 THR HA . 25762 1 315 . 1 1 38 38 THR HB H 1 4.1300 0.04 . 1 . . . A 38 THR HB . 25762 1 316 . 1 1 38 38 THR HG21 H 1 1.2100 0.04 . 1 . . . A 38 THR HG21 . 25762 1 317 . 1 1 38 38 THR HG22 H 1 1.2100 0.04 . 1 . . . A 38 THR HG22 . 25762 1 318 . 1 1 38 38 THR HG23 H 1 1.2100 0.04 . 1 . . . A 38 THR HG23 . 25762 1 319 . 1 1 38 38 THR C C 13 173.0040 0.5 . 1 . . . A 38 THR C . 25762 1 320 . 1 1 38 38 THR CA C 13 59.7510 0.5 . 1 . . . A 38 THR CA . 25762 1 321 . 1 1 38 38 THR CB C 13 72.6660 0.5 . 1 . . . A 38 THR CB . 25762 1 322 . 1 1 38 38 THR CG2 C 13 21.7700 0.5 . 1 . . . A 38 THR CG2 . 25762 1 323 . 1 1 38 38 THR N N 15 114.8480 0.5 . 1 . . . A 38 THR N . 25762 1 324 . 1 1 39 39 ARG H H 1 8.2310 0.04 . 1 . . . A 39 ARG H . 25762 1 325 . 1 1 39 39 ARG HA H 1 4.6400 0.04 . 1 . . . A 39 ARG HA . 25762 1 326 . 1 1 39 39 ARG HB2 H 1 0.9270 0.04 . 2 . . . A 39 ARG HB2 . 25762 1 327 . 1 1 39 39 ARG C C 13 174.6490 0.5 . 1 . . . A 39 ARG C . 25762 1 328 . 1 1 39 39 ARG CA C 13 54.5870 0.5 . 1 . . . A 39 ARG CA . 25762 1 329 . 1 1 39 39 ARG CB C 13 33.2850 0.5 . 1 . . . A 39 ARG CB . 25762 1 330 . 1 1 39 39 ARG CG C 13 24.4900 0.5 . 1 . . . A 39 ARG CG . 25762 1 331 . 1 1 39 39 ARG CD C 13 42.7400 0.5 . 1 . . . A 39 ARG CD . 25762 1 332 . 1 1 39 39 ARG N N 15 119.0720 0.5 . 1 . . . A 39 ARG N . 25762 1 333 . 1 1 40 40 THR H H 1 8.0970 0.04 . 1 . . . A 40 THR H . 25762 1 334 . 1 1 40 40 THR HA H 1 4.4400 0.04 . 1 . . . A 40 THR HA . 25762 1 335 . 1 1 40 40 THR HB H 1 4.1500 0.04 . 1 . . . A 40 THR HB . 25762 1 336 . 1 1 40 40 THR HG21 H 1 1.1100 0.04 . 1 . . . A 40 THR HG21 . 25762 1 337 . 1 1 40 40 THR HG22 H 1 1.1100 0.04 . 1 . . . A 40 THR HG22 . 25762 1 338 . 1 1 40 40 THR HG23 H 1 1.1100 0.04 . 1 . . . A 40 THR HG23 . 25762 1 339 . 1 1 40 40 THR C C 13 173.8900 0.5 . 1 . . . A 40 THR C . 25762 1 340 . 1 1 40 40 THR CA C 13 60.4310 0.5 . 1 . . . A 40 THR CA . 25762 1 341 . 1 1 40 40 THR CB C 13 71.1630 0.5 . 1 . . . A 40 THR CB . 25762 1 342 . 1 1 40 40 THR CG2 C 13 21.3020 0.5 . 1 . . . A 40 THR CG2 . 25762 1 343 . 1 1 40 40 THR N N 15 111.0090 0.5 . 1 . . . A 40 THR N . 25762 1 344 . 1 1 41 41 GLY H H 1 8.1460 0.04 . 1 . . . A 41 GLY H . 25762 1 345 . 1 1 41 41 GLY HA2 H 1 3.5900 0.04 . 2 . . . A 41 GLY HA2 . 25762 1 346 . 1 1 41 41 GLY HA3 H 1 4.4600 0.04 . 2 . . . A 41 GLY HA3 . 25762 1 347 . 1 1 41 41 GLY C C 13 174.4890 0.5 . 1 . . . A 41 GLY C . 25762 1 348 . 1 1 41 41 GLY CA C 13 45.4870 0.5 . 1 . . . A 41 GLY CA . 25762 1 349 . 1 1 41 41 GLY N N 15 110.0940 0.5 . 1 . . . A 41 GLY N . 25762 1 350 . 1 1 42 42 ALA H H 1 8.8440 0.04 . 1 . . . A 42 ALA H . 25762 1 351 . 1 1 42 42 ALA HA H 1 4.1500 0.04 . 1 . . . A 42 ALA HA . 25762 1 352 . 1 1 42 42 ALA HB1 H 1 1.4400 0.04 . 1 . . . A 42 ALA HB1 . 25762 1 353 . 1 1 42 42 ALA HB2 H 1 1.4400 0.04 . 1 . . . A 42 ALA HB2 . 25762 1 354 . 1 1 42 42 ALA HB3 H 1 1.4400 0.04 . 1 . . . A 42 ALA HB3 . 25762 1 355 . 1 1 42 42 ALA C C 13 179.0630 0.5 . 1 . . . A 42 ALA C . 25762 1 356 . 1 1 42 42 ALA CA C 13 54.7370 0.5 . 1 . . . A 42 ALA CA . 25762 1 357 . 1 1 42 42 ALA CB C 13 19.2580 0.5 . 1 . . . A 42 ALA CB . 25762 1 358 . 1 1 42 42 ALA N N 15 130.0300 0.5 . 1 . . . A 42 ALA N . 25762 1 359 . 1 1 43 43 GLU H H 1 9.0700 0.04 . 1 . . . A 43 GLU H . 25762 1 360 . 1 1 43 43 GLU HA H 1 4.3500 0.04 . 1 . . . A 43 GLU HA . 25762 1 361 . 1 1 43 43 GLU HB2 H 1 1.6700 0.04 . 2 . . . A 43 GLU HB2 . 25762 1 362 . 1 1 43 43 GLU HG2 H 1 2.1700 0.04 . 2 . . . A 43 GLU HG2 . 25762 1 363 . 1 1 43 43 GLU C C 13 175.8250 0.5 . 1 . . . A 43 GLU C . 25762 1 364 . 1 1 43 43 GLU CA C 13 54.9640 0.5 . 1 . . . A 43 GLU CA . 25762 1 365 . 1 1 43 43 GLU CB C 13 29.3720 0.5 . 1 . . . A 43 GLU CB . 25762 1 366 . 1 1 43 43 GLU CG C 13 36.4100 0.5 . 1 . . . A 43 GLU CG . 25762 1 367 . 1 1 43 43 GLU N N 15 116.7210 0.5 . 1 . . . A 43 GLU N . 25762 1 368 . 1 1 44 44 CYS H H 1 7.4270 0.04 . 1 . . . A 44 CYS H . 25762 1 369 . 1 1 44 44 CYS C C 13 174.8870 0.5 . 1 . . . A 44 CYS C . 25762 1 370 . 1 1 44 44 CYS CA C 13 55.2870 0.5 . 1 . . . A 44 CYS CA . 25762 1 371 . 1 1 44 44 CYS CB C 13 41.2150 0.5 . 1 . . . A 44 CYS CB . 25762 1 372 . 1 1 44 44 CYS N N 15 120.0310 0.5 . 1 . . . A 44 CYS N . 25762 1 373 . 1 1 45 45 LYS H H 1 8.6550 0.04 . 1 . . . A 45 LYS H . 25762 1 374 . 1 1 45 45 LYS HA H 1 4.2200 0.04 . 1 . . . A 45 LYS HA . 25762 1 375 . 1 1 45 45 LYS HB2 H 1 1.8600 0.04 . 2 . . . A 45 LYS HB2 . 25762 1 376 . 1 1 45 45 LYS HG2 H 1 1.4900 0.04 . 2 . . . A 45 LYS HG2 . 25762 1 377 . 1 1 45 45 LYS HD2 H 1 1.6700 0.04 . 2 . . . A 45 LYS HD2 . 25762 1 378 . 1 1 45 45 LYS HE2 H 1 3.0100 0.04 . 2 . . . A 45 LYS HE2 . 25762 1 379 . 1 1 45 45 LYS C C 13 176.4640 0.5 . 1 . . . A 45 LYS C . 25762 1 380 . 1 1 45 45 LYS CA C 13 57.7930 0.5 . 1 . . . A 45 LYS CA . 25762 1 381 . 1 1 45 45 LYS CB C 13 32.2510 0.5 . 1 . . . A 45 LYS CB . 25762 1 382 . 1 1 45 45 LYS CG C 13 24.7900 0.5 . 1 . . . A 45 LYS CG . 25762 1 383 . 1 1 45 45 LYS CD C 13 28.6000 0.5 . 1 . . . A 45 LYS CD . 25762 1 384 . 1 1 45 45 LYS CE C 13 42.3100 0.5 . 1 . . . A 45 LYS CE . 25762 1 385 . 1 1 45 45 LYS N N 15 127.1920 0.5 . 1 . . . A 45 LYS N . 25762 1 386 . 1 1 46 46 GLN H H 1 7.8310 0.04 . 1 . . . A 46 GLN H . 25762 1 387 . 1 1 46 46 GLN HA H 1 4.6900 0.04 . 1 . . . A 46 GLN HA . 25762 1 388 . 1 1 46 46 GLN HB2 H 1 2.1300 0.04 . 2 . . . A 46 GLN HB2 . 25762 1 389 . 1 1 46 46 GLN HG2 H 1 2.3800 0.04 . 2 . . . A 46 GLN HG2 . 25762 1 390 . 1 1 46 46 GLN HG3 H 1 2.5800 0.04 . 2 . . . A 46 GLN HG3 . 25762 1 391 . 1 1 46 46 GLN C C 13 175.5240 0.5 . 1 . . . A 46 GLN C . 25762 1 392 . 1 1 46 46 GLN CA C 13 55.7590 0.5 . 1 . . . A 46 GLN CA . 25762 1 393 . 1 1 46 46 GLN CB C 13 29.6720 0.5 . 1 . . . A 46 GLN CB . 25762 1 394 . 1 1 46 46 GLN CG C 13 33.8400 0.5 . 1 . . . A 46 GLN CG . 25762 1 395 . 1 1 46 46 GLN N N 15 119.4540 0.5 . 1 . . . A 46 GLN N . 25762 1 396 . 1 1 47 47 THR H H 1 8.6330 0.04 . 1 . . . A 47 THR H . 25762 1 397 . 1 1 47 47 THR HA H 1 4.7010 0.04 . 1 . . . A 47 THR HA . 25762 1 398 . 1 1 47 47 THR HB H 1 4.0990 0.04 . 1 . . . A 47 THR HB . 25762 1 399 . 1 1 47 47 THR HG21 H 1 0.9710 0.04 . 1 . . . A 47 THR HG21 . 25762 1 400 . 1 1 47 47 THR HG22 H 1 0.9710 0.04 . 1 . . . A 47 THR HG22 . 25762 1 401 . 1 1 47 47 THR HG23 H 1 0.9710 0.04 . 1 . . . A 47 THR HG23 . 25762 1 402 . 1 1 47 47 THR C C 13 173.4580 0.5 . 1 . . . A 47 THR C . 25762 1 403 . 1 1 47 47 THR CA C 13 61.6930 0.5 . 1 . . . A 47 THR CA . 25762 1 404 . 1 1 47 47 THR CB C 13 69.7730 0.5 . 1 . . . A 47 THR CB . 25762 1 405 . 1 1 47 47 THR CG2 C 13 22.2200 0.5 . 1 . . . A 47 THR CG2 . 25762 1 406 . 1 1 47 47 THR N N 15 116.1220 0.5 . 1 . . . A 47 THR N . 25762 1 407 . 1 1 48 48 MET H H 1 7.8380 0.04 . 1 . . . A 48 MET H . 25762 1 408 . 1 1 48 48 MET HA H 1 5.6100 0.04 . 1 . . . A 48 MET HA . 25762 1 409 . 1 1 48 48 MET HB2 H 1 2.1100 0.04 . 2 . . . A 48 MET HB2 . 25762 1 410 . 1 1 48 48 MET HB3 H 1 2.0600 0.04 . 2 . . . A 48 MET HB3 . 25762 1 411 . 1 1 48 48 MET HG2 H 1 2.6100 0.04 . 2 . . . A 48 MET HG2 . 25762 1 412 . 1 1 48 48 MET C C 13 174.8500 0.5 . 1 . . . A 48 MET C . 25762 1 413 . 1 1 48 48 MET CA C 13 55.3210 0.5 . 1 . . . A 48 MET CA . 25762 1 414 . 1 1 48 48 MET CB C 13 36.5290 0.5 . 1 . . . A 48 MET CB . 25762 1 415 . 1 1 48 48 MET CG C 13 32.0000 0.5 . 1 . . . A 48 MET CG . 25762 1 416 . 1 1 48 48 MET N N 15 121.3780 0.5 . 1 . . . A 48 MET N . 25762 1 417 . 1 1 49 49 LYS H H 1 8.5390 0.04 . 1 . . . A 49 LYS H . 25762 1 418 . 1 1 49 49 LYS HA H 1 4.5600 0.04 . 1 . . . A 49 LYS HA . 25762 1 419 . 1 1 49 49 LYS HB2 H 1 1.3900 0.04 . 2 . . . A 49 LYS HB2 . 25762 1 420 . 1 1 49 49 LYS HG2 H 1 0.6400 0.04 . 2 . . . A 49 LYS HG2 . 25762 1 421 . 1 1 49 49 LYS HD2 H 1 1.0700 0.04 . 2 . . . A 49 LYS HD2 . 25762 1 422 . 1 1 49 49 LYS C C 13 173.7730 0.5 . 1 . . . A 49 LYS C . 25762 1 423 . 1 1 49 49 LYS CA C 13 55.8990 0.5 . 1 . . . A 49 LYS CA . 25762 1 424 . 1 1 49 49 LYS CB C 13 36.0320 0.5 . 1 . . . A 49 LYS CB . 25762 1 425 . 1 1 49 49 LYS CG C 13 23.8300 0.5 . 1 . . . A 49 LYS CG . 25762 1 426 . 1 1 49 49 LYS CD C 13 29.4500 0.5 . 1 . . . A 49 LYS CD . 25762 1 427 . 1 1 49 49 LYS CE C 13 43.9900 0.5 . 1 . . . A 49 LYS CE . 25762 1 428 . 1 1 49 49 LYS N N 15 123.7480 0.5 . 1 . . . A 49 LYS N . 25762 1 429 . 1 1 50 50 THR H H 1 8.4160 0.04 . 1 . . . A 50 THR H . 25762 1 430 . 1 1 50 50 THR HA H 1 5.3300 0.04 . 1 . . . A 50 THR HA . 25762 1 431 . 1 1 50 50 THR HB H 1 3.9600 0.04 . 1 . . . A 50 THR HB . 25762 1 432 . 1 1 50 50 THR HG21 H 1 1.2100 0.04 . 1 . . . A 50 THR HG21 . 25762 1 433 . 1 1 50 50 THR HG22 H 1 1.2100 0.04 . 1 . . . A 50 THR HG22 . 25762 1 434 . 1 1 50 50 THR HG23 H 1 1.2100 0.04 . 1 . . . A 50 THR HG23 . 25762 1 435 . 1 1 50 50 THR C C 13 174.0470 0.5 . 1 . . . A 50 THR C . 25762 1 436 . 1 1 50 50 THR CA C 13 61.1690 0.5 . 1 . . . A 50 THR CA . 25762 1 437 . 1 1 50 50 THR CB C 13 71.0190 0.5 . 1 . . . A 50 THR CB . 25762 1 438 . 1 1 50 50 THR CG2 C 13 21.8600 0.5 . 1 . . . A 50 THR CG2 . 25762 1 439 . 1 1 50 50 THR N N 15 117.2760 0.5 . 1 . . . A 50 THR N . 25762 1 440 . 1 1 51 51 GLN H H 1 9.0340 0.04 . 1 . . . A 51 GLN H . 25762 1 441 . 1 1 51 51 GLN HA H 1 4.6800 0.04 . 1 . . . A 51 GLN HA . 25762 1 442 . 1 1 51 51 GLN C C 13 174.4530 0.5 . 1 . . . A 51 GLN C . 25762 1 443 . 1 1 51 51 GLN CA C 13 54.0790 0.5 . 1 . . . A 51 GLN CA . 25762 1 444 . 1 1 51 51 GLN CB C 13 34.3520 0.5 . 1 . . . A 51 GLN CB . 25762 1 445 . 1 1 51 51 GLN N N 15 123.9960 0.5 . 1 . . . A 51 GLN N . 25762 1 446 . 1 1 52 52 ARG H H 1 8.5200 0.04 . 1 . . . A 52 ARG H . 25762 1 447 . 1 1 52 52 ARG HA H 1 4.6000 0.04 . 1 . . . A 52 ARG HA . 25762 1 448 . 1 1 52 52 ARG HB2 H 1 1.8100 0.04 . 2 . . . A 52 ARG HB2 . 25762 1 449 . 1 1 52 52 ARG HG2 H 1 1.6000 0.04 . 2 . . . A 52 ARG HG2 . 25762 1 450 . 1 1 52 52 ARG HD2 H 1 3.2100 0.04 . 2 . . . A 52 ARG HD2 . 25762 1 451 . 1 1 52 52 ARG C C 13 174.9780 0.5 . 1 . . . A 52 ARG C . 25762 1 452 . 1 1 52 52 ARG CA C 13 56.6000 0.5 . 1 . . . A 52 ARG CA . 25762 1 453 . 1 1 52 52 ARG CB C 13 30.8120 0.5 . 1 . . . A 52 ARG CB . 25762 1 454 . 1 1 52 52 ARG CG C 13 27.1700 0.5 . 1 . . . A 52 ARG CG . 25762 1 455 . 1 1 52 52 ARG CD C 13 43.4300 0.5 . 1 . . . A 52 ARG CD . 25762 1 456 . 1 1 52 52 ARG N N 15 124.7590 0.5 . 1 . . . A 52 ARG N . 25762 1 457 . 1 1 53 53 CYS H H 1 8.1670 0.04 . 1 . . . A 53 CYS H . 25762 1 458 . 1 1 53 53 CYS HA H 1 4.1300 0.04 . 1 . . . A 53 CYS HA . 25762 1 459 . 1 1 53 53 CYS HB2 H 1 2.9800 0.04 . 2 . . . A 53 CYS HB2 . 25762 1 460 . 1 1 53 53 CYS HB3 H 1 3.1100 0.04 . 2 . . . A 53 CYS HB3 . 25762 1 461 . 1 1 53 53 CYS C C 13 170.7550 0.5 . 1 . . . A 53 CYS C . 25762 1 462 . 1 1 53 53 CYS CA C 13 54.5740 0.5 . 1 . . . A 53 CYS CA . 25762 1 463 . 1 1 53 53 CYS CB C 13 47.1780 0.5 . 1 . . . A 53 CYS CB . 25762 1 464 . 1 1 53 53 CYS N N 15 120.1580 0.5 . 1 . . . A 53 CYS N . 25762 1 465 . 1 1 54 54 LYS H H 1 8.4890 0.04 . 1 . . . A 54 LYS H . 25762 1 466 . 1 1 54 54 LYS HA H 1 4.8400 0.04 . 1 . . . A 54 LYS HA . 25762 1 467 . 1 1 54 54 LYS HB2 H 1 1.5600 0.04 . 2 . . . A 54 LYS HB2 . 25762 1 468 . 1 1 54 54 LYS HB3 H 1 1.6100 0.04 . 2 . . . A 54 LYS HB3 . 25762 1 469 . 1 1 54 54 LYS HG2 H 1 1.1000 0.04 . 2 . . . A 54 LYS HG2 . 25762 1 470 . 1 1 54 54 LYS HG3 H 1 1.1000 0.04 . 2 . . . A 54 LYS HG3 . 25762 1 471 . 1 1 54 54 LYS HE2 H 1 2.8200 0.04 . 2 . . . A 54 LYS HE2 . 25762 1 472 . 1 1 54 54 LYS C C 13 175.1660 0.5 . 1 . . . A 54 LYS C . 25762 1 473 . 1 1 54 54 LYS CA C 13 55.6110 0.5 . 1 . . . A 54 LYS CA . 25762 1 474 . 1 1 54 54 LYS CB C 13 36.0660 0.5 . 1 . . . A 54 LYS CB . 25762 1 475 . 1 1 54 54 LYS CG C 13 24.8300 0.5 . 1 . . . A 54 LYS CG . 25762 1 476 . 1 1 54 54 LYS CD C 13 29.3000 0.5 . 1 . . . A 54 LYS CD . 25762 1 477 . 1 1 54 54 LYS CE C 13 41.0700 0.5 . 1 . . . A 54 LYS CE . 25762 1 478 . 1 1 54 54 LYS N N 15 120.2830 0.5 . 1 . . . A 54 LYS N . 25762 1 479 . 1 1 55 55 ILE H H 1 8.6730 0.04 . 1 . . . A 55 ILE H . 25762 1 480 . 1 1 55 55 ILE HA H 1 4.6000 0.04 . 1 . . . A 55 ILE HA . 25762 1 481 . 1 1 55 55 ILE HB H 1 1.6000 0.04 . 1 . . . A 55 ILE HB . 25762 1 482 . 1 1 55 55 ILE HG12 H 1 1.3200 0.04 . 2 . . . A 55 ILE HG12 . 25762 1 483 . 1 1 55 55 ILE HG21 H 1 1.0500 0.04 . 1 . . . A 55 ILE HG21 . 25762 1 484 . 1 1 55 55 ILE HG22 H 1 1.0500 0.04 . 1 . . . A 55 ILE HG22 . 25762 1 485 . 1 1 55 55 ILE HG23 H 1 1.0500 0.04 . 1 . . . A 55 ILE HG23 . 25762 1 486 . 1 1 55 55 ILE HD11 H 1 0.6700 0.04 . 1 . . . A 55 ILE HD11 . 25762 1 487 . 1 1 55 55 ILE HD12 H 1 0.6700 0.04 . 1 . . . A 55 ILE HD12 . 25762 1 488 . 1 1 55 55 ILE HD13 H 1 0.6700 0.04 . 1 . . . A 55 ILE HD13 . 25762 1 489 . 1 1 55 55 ILE CA C 13 57.2990 0.5 . 1 . . . A 55 ILE CA . 25762 1 490 . 1 1 55 55 ILE CB C 13 41.7590 0.5 . 1 . . . A 55 ILE CB . 25762 1 491 . 1 1 55 55 ILE CG1 C 13 27.4000 0.5 . 1 . . . A 55 ILE CG1 . 25762 1 492 . 1 1 55 55 ILE CG2 C 13 16.7000 0.5 . 1 . . . A 55 ILE CG2 . 25762 1 493 . 1 1 55 55 ILE CD1 C 13 14.2000 0.5 . 1 . . . A 55 ILE CD1 . 25762 1 494 . 1 1 55 55 ILE N N 15 126.7940 0.5 . 1 . . . A 55 ILE N . 25762 1 495 . 1 1 56 56 PRO HA H 1 4.3600 0.04 . 1 . . . A 56 PRO HA . 25762 1 496 . 1 1 56 56 PRO HB2 H 1 2.2800 0.04 . 2 . . . A 56 PRO HB2 . 25762 1 497 . 1 1 56 56 PRO HG2 H 1 1.8500 0.04 . 2 . . . A 56 PRO HG2 . 25762 1 498 . 1 1 56 56 PRO C C 13 176.7480 0.5 . 1 . . . A 56 PRO C . 25762 1 499 . 1 1 56 56 PRO CA C 13 63.7900 0.5 . 1 . . . A 56 PRO CA . 25762 1 500 . 1 1 56 56 PRO CB C 13 32.2000 0.5 . 1 . . . A 56 PRO CB . 25762 1 501 . 1 1 56 56 PRO CG C 13 27.5600 0.5 . 1 . . . A 56 PRO CG . 25762 1 502 . 1 1 56 56 PRO CD C 13 51.9000 0.5 . 1 . . . A 56 PRO CD . 25762 1 503 . 1 1 57 57 CYS H H 1 8.7820 0.04 . 1 . . . A 57 CYS H . 25762 1 504 . 1 1 57 57 CYS HA H 1 4.1600 0.04 . 1 . . . A 57 CYS HA . 25762 1 505 . 1 1 57 57 CYS HB2 H 1 2.7500 0.04 . 2 . . . A 57 CYS HB2 . 25762 1 506 . 1 1 57 57 CYS C C 13 174.8670 0.5 . 1 . . . A 57 CYS C . 25762 1 507 . 1 1 57 57 CYS CA C 13 54.4900 0.5 . 1 . . . A 57 CYS CA . 25762 1 508 . 1 1 57 57 CYS CB C 13 43.0900 0.5 . 1 . . . A 57 CYS CB . 25762 1 509 . 1 1 57 57 CYS N N 15 121.4110 0.5 . 1 . . . A 57 CYS N . 25762 1 510 . 1 1 58 58 ASN H H 1 8.5510 0.04 . 1 . . . A 58 ASN H . 25762 1 511 . 1 1 58 58 ASN HA H 1 4.6200 0.04 . 1 . . . A 58 ASN HA . 25762 1 512 . 1 1 58 58 ASN HB2 H 1 2.7800 0.04 . 2 . . . A 58 ASN HB2 . 25762 1 513 . 1 1 58 58 ASN HD21 H 1 6.8800 0.04 . 2 . . . A 58 ASN HD21 . 25762 1 514 . 1 1 58 58 ASN HD22 H 1 7.6400 0.04 . 2 . . . A 58 ASN HD22 . 25762 1 515 . 1 1 58 58 ASN C C 13 175.1290 0.5 . 1 . . . A 58 ASN C . 25762 1 516 . 1 1 58 58 ASN CA C 13 53.8320 0.5 . 1 . . . A 58 ASN CA . 25762 1 517 . 1 1 58 58 ASN CB C 13 38.6340 0.5 . 1 . . . A 58 ASN CB . 25762 1 518 . 1 1 58 58 ASN N N 15 120.9180 0.5 . 1 . . . A 58 ASN N . 25762 1 519 . 1 1 58 58 ASN ND2 N 15 113.4000 0.5 . 1 . . . A 58 ASN ND2 . 25762 1 520 . 1 1 59 59 TRP H H 1 8.0100 0.04 . 1 . . . A 59 TRP H . 25762 1 521 . 1 1 59 59 TRP HA H 1 4.6040 0.04 . 1 . . . A 59 TRP HA . 25762 1 522 . 1 1 59 59 TRP HB2 H 1 3.2900 0.04 . 2 . . . A 59 TRP HB2 . 25762 1 523 . 1 1 59 59 TRP HB3 H 1 3.2000 0.04 . 2 . . . A 59 TRP HB3 . 25762 1 524 . 1 1 59 59 TRP HD1 H 1 7.2800 0.04 . 1 . . . A 59 TRP HD1 . 25762 1 525 . 1 1 59 59 TRP HE1 H 1 10.2000 0.04 . 1 . . . A 59 TRP HE1 . 25762 1 526 . 1 1 59 59 TRP HE3 H 1 7.5000 0.04 . 1 . . . A 59 TRP HE3 . 25762 1 527 . 1 1 59 59 TRP HZ2 H 1 7.4500 0.04 . 1 . . . A 59 TRP HZ2 . 25762 1 528 . 1 1 59 59 TRP HZ3 H 1 7.0200 0.04 . 1 . . . A 59 TRP HZ3 . 25762 1 529 . 1 1 59 59 TRP HH2 H 1 7.1400 0.04 . 1 . . . A 59 TRP HH2 . 25762 1 530 . 1 1 59 59 TRP C C 13 176.3740 0.5 . 1 . . . A 59 TRP C . 25762 1 531 . 1 1 59 59 TRP CA C 13 57.6050 0.5 . 1 . . . A 59 TRP CA . 25762 1 532 . 1 1 59 59 TRP CB C 13 29.4870 0.5 . 1 . . . A 59 TRP CB . 25762 1 533 . 1 1 59 59 TRP CD1 C 13 127.3000 0.5 . 1 . . . A 59 TRP CD1 . 25762 1 534 . 1 1 59 59 TRP CE3 C 13 120.9000 0.5 . 1 . . . A 59 TRP CE3 . 25762 1 535 . 1 1 59 59 TRP CZ2 C 13 114.7000 0.5 . 1 . . . A 59 TRP CZ2 . 25762 1 536 . 1 1 59 59 TRP CZ3 C 13 122.0000 0.5 . 1 . . . A 59 TRP CZ3 . 25762 1 537 . 1 1 59 59 TRP CH2 C 13 124.6000 0.5 . 1 . . . A 59 TRP CH2 . 25762 1 538 . 1 1 59 59 TRP N N 15 121.7910 0.5 . 1 . . . A 59 TRP N . 25762 1 539 . 1 1 59 59 TRP NE1 N 15 129.8000 0.5 . 1 . . . A 59 TRP NE1 . 25762 1 540 . 1 1 60 60 LYS H H 1 7.7510 0.04 . 1 . . . A 60 LYS H . 25762 1 541 . 1 1 60 60 LYS HA H 1 4.0700 0.04 . 1 . . . A 60 LYS HA . 25762 1 542 . 1 1 60 60 LYS HB2 H 1 1.6500 0.04 . 2 . . . A 60 LYS HB2 . 25762 1 543 . 1 1 60 60 LYS HG2 H 1 0.9800 0.04 . 2 . . . A 60 LYS HG2 . 25762 1 544 . 1 1 60 60 LYS HD2 H 1 1.5010 0.04 . 2 . . . A 60 LYS HD2 . 25762 1 545 . 1 1 60 60 LYS HE2 H 1 2.8020 0.04 . 2 . . . A 60 LYS HE2 . 25762 1 546 . 1 1 60 60 LYS C C 13 176.6850 0.5 . 1 . . . A 60 LYS C . 25762 1 547 . 1 1 60 60 LYS CA C 13 56.9260 0.5 . 1 . . . A 60 LYS CA . 25762 1 548 . 1 1 60 60 LYS CB C 13 32.8770 0.5 . 1 . . . A 60 LYS CB . 25762 1 549 . 1 1 60 60 LYS CG C 13 24.5600 0.5 . 1 . . . A 60 LYS CG . 25762 1 550 . 1 1 60 60 LYS CD C 13 29.0000 0.5 . 1 . . . A 60 LYS CD . 25762 1 551 . 1 1 60 60 LYS CE C 13 42.1800 0.5 . 1 . . . A 60 LYS CE . 25762 1 552 . 1 1 60 60 LYS N N 15 122.2890 0.5 . 1 . . . A 60 LYS N . 25762 1 553 . 1 1 61 61 LYS H H 1 7.9630 0.04 . 1 . . . A 61 LYS H . 25762 1 554 . 1 1 61 61 LYS HA H 1 4.1600 0.04 . 1 . . . A 61 LYS HA . 25762 1 555 . 1 1 61 61 LYS HB2 H 1 1.7100 0.04 . 2 . . . A 61 LYS HB2 . 25762 1 556 . 1 1 61 61 LYS HG2 H 1 1.3500 0.04 . 2 . . . A 61 LYS HG2 . 25762 1 557 . 1 1 61 61 LYS HD2 H 1 1.5200 0.04 . 2 . . . A 61 LYS HD2 . 25762 1 558 . 1 1 61 61 LYS HE2 H 1 2.9500 0.04 . 2 . . . A 61 LYS HE2 . 25762 1 559 . 1 1 61 61 LYS C C 13 176.7310 0.5 . 1 . . . A 61 LYS C . 25762 1 560 . 1 1 61 61 LYS CA C 13 56.8040 0.5 . 1 . . . A 61 LYS CA . 25762 1 561 . 1 1 61 61 LYS CB C 13 32.9100 0.5 . 1 . . . A 61 LYS CB . 25762 1 562 . 1 1 61 61 LYS CG C 13 24.7700 0.5 . 1 . . . A 61 LYS CG . 25762 1 563 . 1 1 61 61 LYS CD C 13 29.2100 0.5 . 1 . . . A 61 LYS CD . 25762 1 564 . 1 1 61 61 LYS CE C 13 42.2800 0.5 . 1 . . . A 61 LYS CE . 25762 1 565 . 1 1 61 61 LYS N N 15 121.6910 0.5 . 1 . . . A 61 LYS N . 25762 1 566 . 1 1 62 62 GLN H H 1 8.1770 0.04 . 1 . . . A 62 GLN H . 25762 1 567 . 1 1 62 62 GLN HA H 1 4.2400 0.04 . 1 . . . A 62 GLN HA . 25762 1 568 . 1 1 62 62 GLN HB2 H 1 1.9200 0.04 . 2 . . . A 62 GLN HB2 . 25762 1 569 . 1 1 62 62 GLN HG2 H 1 2.1800 0.04 . 2 . . . A 62 GLN HG2 . 25762 1 570 . 1 1 62 62 GLN C C 13 175.6960 0.5 . 1 . . . A 62 GLN C . 25762 1 571 . 1 1 62 62 GLN CA C 13 56.4160 0.5 . 1 . . . A 62 GLN CA . 25762 1 572 . 1 1 62 62 GLN CB C 13 29.7220 0.5 . 1 . . . A 62 GLN CB . 25762 1 573 . 1 1 62 62 GLN CG C 13 33.6400 0.5 . 1 . . . A 62 GLN CG . 25762 1 574 . 1 1 62 62 GLN N N 15 120.6110 0.5 . 1 . . . A 62 GLN N . 25762 1 575 . 1 1 63 63 PHE H H 1 7.9900 0.04 . 1 . . . A 63 PHE H . 25762 1 576 . 1 1 63 63 PHE HA H 1 4.7500 0.04 . 1 . . . A 63 PHE HA . 25762 1 577 . 1 1 63 63 PHE HB2 H 1 3.0800 0.04 . 2 . . . A 63 PHE HB2 . 25762 1 578 . 1 1 63 63 PHE HB3 H 1 3.3000 0.04 . 2 . . . A 63 PHE HB3 . 25762 1 579 . 1 1 63 63 PHE HD1 H 1 7.2700 0.04 . 3 . . . A 63 PHE HD1 . 25762 1 580 . 1 1 63 63 PHE HE1 H 1 7.3200 0.04 . 3 . . . A 63 PHE HE1 . 25762 1 581 . 1 1 63 63 PHE C C 13 175.9580 0.5 . 1 . . . A 63 PHE C . 25762 1 582 . 1 1 63 63 PHE CA C 13 57.3390 0.5 . 1 . . . A 63 PHE CA . 25762 1 583 . 1 1 63 63 PHE CB C 13 39.8130 0.5 . 1 . . . A 63 PHE CB . 25762 1 584 . 1 1 63 63 PHE CD1 C 13 132.1000 0.5 . 2 . . . A 63 PHE CD1 . 25762 1 585 . 1 1 63 63 PHE CE1 C 13 131.3000 0.5 . 3 . . . A 63 PHE CE1 . 25762 1 586 . 1 1 63 63 PHE N N 15 119.9640 0.5 . 3 . . . A 63 PHE N . 25762 1 587 . 1 1 64 64 GLY H H 1 8.4270 0.04 . 1 . . . A 64 GLY H . 25762 1 588 . 1 1 64 64 GLY HA2 H 1 4.0340 0.04 . 2 . . . A 64 GLY HA2 . 25762 1 589 . 1 1 64 64 GLY C C 13 174.2970 0.5 . 1 . . . A 64 GLY C . 25762 1 590 . 1 1 64 64 GLY CA C 13 45.3060 0.5 . 1 . . . A 64 GLY CA . 25762 1 591 . 1 1 64 64 GLY N N 15 110.6740 0.5 . 1 . . . A 64 GLY N . 25762 1 592 . 1 1 65 65 ALA H H 1 8.3160 0.04 . 1 . . . A 65 ALA H . 25762 1 593 . 1 1 65 65 ALA HA H 1 4.2600 0.04 . 1 . . . A 65 ALA HA . 25762 1 594 . 1 1 65 65 ALA HB1 H 1 1.4100 0.04 . 1 . . . A 65 ALA HB1 . 25762 1 595 . 1 1 65 65 ALA HB2 H 1 1.4100 0.04 . 1 . . . A 65 ALA HB2 . 25762 1 596 . 1 1 65 65 ALA HB3 H 1 1.4100 0.04 . 1 . . . A 65 ALA HB3 . 25762 1 597 . 1 1 65 65 ALA C C 13 178.0280 0.5 . 1 . . . A 65 ALA C . 25762 1 598 . 1 1 65 65 ALA CA C 13 53.4000 0.5 . 1 . . . A 65 ALA CA . 25762 1 599 . 1 1 65 65 ALA CB C 13 19.3720 0.5 . 1 . . . A 65 ALA CB . 25762 1 600 . 1 1 65 65 ALA N N 15 124.2130 0.5 . 1 . . . A 65 ALA N . 25762 1 601 . 1 1 66 66 GLU H H 1 8.6970 0.04 . 1 . . . A 66 GLU H . 25762 1 602 . 1 1 66 66 GLU HA H 1 4.2400 0.04 . 1 . . . A 66 GLU HA . 25762 1 603 . 1 1 66 66 GLU HB2 H 1 1.8900 0.04 . 2 . . . A 66 GLU HB2 . 25762 1 604 . 1 1 66 66 GLU HG2 H 1 2.2500 0.04 . 2 . . . A 66 GLU HG2 . 25762 1 605 . 1 1 66 66 GLU C C 13 175.1270 0.5 . 1 . . . A 66 GLU C . 25762 1 606 . 1 1 66 66 GLU CA C 13 57.2050 0.5 . 1 . . . A 66 GLU CA . 25762 1 607 . 1 1 66 66 GLU CB C 13 29.9240 0.5 . 1 . . . A 66 GLU CB . 25762 1 608 . 1 1 66 66 GLU CG C 13 36.3500 0.5 . 1 . . . A 66 GLU CG . 25762 1 609 . 1 1 66 66 GLU N N 15 117.4890 0.5 . 1 . . . A 66 GLU N . 25762 1 610 . 1 1 67 67 CYS H H 1 7.7580 0.04 . 1 . . . A 67 CYS H . 25762 1 611 . 1 1 67 67 CYS HA H 1 4.3100 0.04 . 1 . . . A 67 CYS HA . 25762 1 612 . 1 1 67 67 CYS HB2 H 1 3.0300 0.04 . 2 . . . A 67 CYS HB2 . 25762 1 613 . 1 1 67 67 CYS C C 13 172.4360 0.5 . 1 . . . A 67 CYS C . 25762 1 614 . 1 1 67 67 CYS CA C 13 53.3000 0.5 . 1 . . . A 67 CYS CA . 25762 1 615 . 1 1 67 67 CYS CB C 13 41.1220 0.5 . 1 . . . A 67 CYS CB . 25762 1 616 . 1 1 67 67 CYS N N 15 119.3050 0.5 . 1 . . . A 67 CYS N . 25762 1 617 . 1 1 68 68 LYS H H 1 8.1740 0.04 . 1 . . . A 68 LYS H . 25762 1 618 . 1 1 68 68 LYS HA H 1 4.6800 0.04 . 1 . . . A 68 LYS HA . 25762 1 619 . 1 1 68 68 LYS HB2 H 1 1.6600 0.04 . 2 . . . A 68 LYS HB2 . 25762 1 620 . 1 1 68 68 LYS HG2 H 1 1.2700 0.04 . 2 . . . A 68 LYS HG2 . 25762 1 621 . 1 1 68 68 LYS HG3 H 1 1.3100 0.04 . 2 . . . A 68 LYS HG3 . 25762 1 622 . 1 1 68 68 LYS HE2 H 1 2.8800 0.04 . 2 . . . A 68 LYS HE2 . 25762 1 623 . 1 1 68 68 LYS C C 13 174.8040 0.5 . 1 . . . A 68 LYS C . 25762 1 624 . 1 1 68 68 LYS CA C 13 54.0090 0.5 . 1 . . . A 68 LYS CA . 25762 1 625 . 1 1 68 68 LYS CB C 13 33.6510 0.5 . 1 . . . A 68 LYS CB . 25762 1 626 . 1 1 68 68 LYS CG C 13 24.1100 0.5 . 1 . . . A 68 LYS CG . 25762 1 627 . 1 1 68 68 LYS CD C 13 28.4400 0.5 . 1 . . . A 68 LYS CD . 25762 1 628 . 1 1 68 68 LYS CE C 13 44.3100 0.5 . 1 . . . A 68 LYS CE . 25762 1 629 . 1 1 68 68 LYS N N 15 123.2480 0.5 . 1 . . . A 68 LYS N . 25762 1 630 . 1 1 69 69 TYR H H 1 8.7690 0.04 . 1 . . . A 69 TYR H . 25762 1 631 . 1 1 69 69 TYR HA H 1 4.4100 0.04 . 1 . . . A 69 TYR HA . 25762 1 632 . 1 1 69 69 TYR HB2 H 1 2.7400 0.04 . 2 . . . A 69 TYR HB2 . 25762 1 633 . 1 1 69 69 TYR HB3 H 1 2.8500 0.04 . 2 . . . A 69 TYR HB3 . 25762 1 634 . 1 1 69 69 TYR HD1 H 1 6.4000 0.04 . 3 . . . A 69 TYR HD1 . 25762 1 635 . 1 1 69 69 TYR HE1 H 1 6.3600 0.04 . 3 . . . A 69 TYR HE1 . 25762 1 636 . 1 1 69 69 TYR C C 13 174.6020 0.5 . 1 . . . A 69 TYR C . 25762 1 637 . 1 1 69 69 TYR CA C 13 58.2040 0.5 . 1 . . . A 69 TYR CA . 25762 1 638 . 1 1 69 69 TYR CB C 13 42.1000 0.5 . 1 . . . A 69 TYR CB . 25762 1 639 . 1 1 69 69 TYR CD1 C 13 132.1000 0.5 . 2 . . . A 69 TYR CD1 . 25762 1 640 . 1 1 69 69 TYR CE1 C 13 117.8000 0.5 . 3 . . . A 69 TYR CE1 . 25762 1 641 . 1 1 69 69 TYR N N 15 122.6350 0.5 . 3 . . . A 69 TYR N . 25762 1 642 . 1 1 70 70 GLN H H 1 8.5730 0.04 . 1 . . . A 70 GLN H . 25762 1 643 . 1 1 70 70 GLN HA H 1 4.5900 0.04 . 1 . . . A 70 GLN HA . 25762 1 644 . 1 1 70 70 GLN HB2 H 1 1.8100 0.04 . 2 . . . A 70 GLN HB2 . 25762 1 645 . 1 1 70 70 GLN HB3 H 1 1.9900 0.04 . 2 . . . A 70 GLN HB3 . 25762 1 646 . 1 1 70 70 GLN HG2 H 1 2.2030 0.04 . 2 . . . A 70 GLN HG2 . 25762 1 647 . 1 1 70 70 GLN C C 13 175.6340 0.5 . 1 . . . A 70 GLN C . 25762 1 648 . 1 1 70 70 GLN CA C 13 54.1080 0.5 . 1 . . . A 70 GLN CA . 25762 1 649 . 1 1 70 70 GLN CB C 13 29.9000 0.5 . 1 . . . A 70 GLN CB . 25762 1 650 . 1 1 70 70 GLN CG C 13 33.4500 0.5 . 1 . . . A 70 GLN CG . 25762 1 651 . 1 1 70 70 GLN N N 15 120.9840 0.5 . 1 . . . A 70 GLN N . 25762 1 652 . 1 1 71 71 PHE H H 1 9.2550 0.04 . 1 . . . A 71 PHE H . 25762 1 653 . 1 1 71 71 PHE HA H 1 4.9700 0.04 . 1 . . . A 71 PHE HA . 25762 1 654 . 1 1 71 71 PHE HB2 H 1 2.6900 0.04 . 2 . . . A 71 PHE HB2 . 25762 1 655 . 1 1 71 71 PHE HB3 H 1 2.8500 0.04 . 2 . . . A 71 PHE HB3 . 25762 1 656 . 1 1 71 71 PHE HD1 H 1 6.8800 0.04 . 3 . . . A 71 PHE HD1 . 25762 1 657 . 1 1 71 71 PHE C C 13 177.1490 0.5 . 1 . . . A 71 PHE C . 25762 1 658 . 1 1 71 71 PHE CA C 13 58.9760 0.5 . 1 . . . A 71 PHE CA . 25762 1 659 . 1 1 71 71 PHE CB C 13 40.8370 0.5 . 1 . . . A 71 PHE CB . 25762 1 660 . 1 1 71 71 PHE CD1 C 13 129.6000 0.5 . 2 . . . A 71 PHE CD1 . 25762 1 661 . 1 1 71 71 PHE N N 15 127.3890 0.5 . 3 . . . A 71 PHE N . 25762 1 662 . 1 1 72 72 GLN H H 1 8.2730 0.04 . 1 . . . A 72 GLN H . 25762 1 663 . 1 1 72 72 GLN HA H 1 4.4400 0.04 . 1 . . . A 72 GLN HA . 25762 1 664 . 1 1 72 72 GLN HB2 H 1 1.9200 0.04 . 2 . . . A 72 GLN HB2 . 25762 1 665 . 1 1 72 72 GLN HB3 H 1 2.0400 0.04 . 2 . . . A 72 GLN HB3 . 25762 1 666 . 1 1 72 72 GLN HG2 H 1 2.4400 0.04 . 2 . . . A 72 GLN HG2 . 25762 1 667 . 1 1 72 72 GLN HG3 H 1 2.2100 0.04 . 2 . . . A 72 GLN HG3 . 25762 1 668 . 1 1 72 72 GLN C C 13 176.7210 0.5 . 1 . . . A 72 GLN C . 25762 1 669 . 1 1 72 72 GLN CA C 13 54.7070 0.5 . 1 . . . A 72 GLN CA . 25762 1 670 . 1 1 72 72 GLN CB C 13 29.9830 0.5 . 1 . . . A 72 GLN CB . 25762 1 671 . 1 1 72 72 GLN CG C 13 34.7000 0.5 . 1 . . . A 72 GLN CG . 25762 1 672 . 1 1 72 72 GLN N N 15 121.5140 0.5 . 1 . . . A 72 GLN N . 25762 1 673 . 1 1 73 73 ALA H H 1 8.2930 0.04 . 1 . . . A 73 ALA H . 25762 1 674 . 1 1 73 73 ALA HA H 1 4.2200 0.04 . 1 . . . A 73 ALA HA . 25762 1 675 . 1 1 73 73 ALA HB1 H 1 1.4600 0.04 . 1 . . . A 73 ALA HB1 . 25762 1 676 . 1 1 73 73 ALA HB2 H 1 1.4600 0.04 . 1 . . . A 73 ALA HB2 . 25762 1 677 . 1 1 73 73 ALA HB3 H 1 1.4600 0.04 . 1 . . . A 73 ALA HB3 . 25762 1 678 . 1 1 73 73 ALA C C 13 178.7760 0.5 . 1 . . . A 73 ALA C . 25762 1 679 . 1 1 73 73 ALA CA C 13 52.7510 0.5 . 1 . . . A 73 ALA CA . 25762 1 680 . 1 1 73 73 ALA CB C 13 19.5590 0.5 . 1 . . . A 73 ALA CB . 25762 1 681 . 1 1 73 73 ALA N N 15 122.4140 0.5 . 1 . . . A 73 ALA N . 25762 1 682 . 1 1 74 74 TRP H H 1 8.1360 0.04 . 1 . . . A 74 TRP H . 25762 1 683 . 1 1 74 74 TRP HA H 1 4.2600 0.04 . 1 . . . A 74 TRP HA . 25762 1 684 . 1 1 74 74 TRP HB2 H 1 3.1300 0.04 . 2 . . . A 74 TRP HB2 . 25762 1 685 . 1 1 74 74 TRP HB3 H 1 3.2800 0.04 . 2 . . . A 74 TRP HB3 . 25762 1 686 . 1 1 74 74 TRP HE1 H 1 10.2000 0.04 . 1 . . . A 74 TRP HE1 . 25762 1 687 . 1 1 74 74 TRP HZ2 H 1 7.3400 0.04 . 1 . . . A 74 TRP HZ2 . 25762 1 688 . 1 1 74 74 TRP HZ3 H 1 7.0300 0.04 . 1 . . . A 74 TRP HZ3 . 25762 1 689 . 1 1 74 74 TRP HH2 H 1 6.7500 0.04 . 1 . . . A 74 TRP HH2 . 25762 1 690 . 1 1 74 74 TRP C C 13 178.2900 0.5 . 1 . . . A 74 TRP C . 25762 1 691 . 1 1 74 74 TRP CA C 13 58.9820 0.5 . 1 . . . A 74 TRP CA . 25762 1 692 . 1 1 74 74 TRP CB C 13 30.6330 0.5 . 1 . . . A 74 TRP CB . 25762 1 693 . 1 1 74 74 TRP CZ2 C 13 114.7000 0.5 . 1 . . . A 74 TRP CZ2 . 25762 1 694 . 1 1 74 74 TRP CZ3 C 13 123.4000 0.5 . 1 . . . A 74 TRP CZ3 . 25762 1 695 . 1 1 74 74 TRP CH2 C 13 124.4000 0.5 . 1 . . . A 74 TRP CH2 . 25762 1 696 . 1 1 74 74 TRP N N 15 120.4120 0.5 . 1 . . . A 74 TRP N . 25762 1 697 . 1 1 74 74 TRP NE1 N 15 129.8000 0.5 . 1 . . . A 74 TRP NE1 . 25762 1 698 . 1 1 75 75 GLY H H 1 8.7630 0.04 . 1 . . . A 75 GLY H . 25762 1 699 . 1 1 75 75 GLY HA2 H 1 4.1600 0.04 . 2 . . . A 75 GLY HA2 . 25762 1 700 . 1 1 75 75 GLY HA3 H 1 4.4200 0.04 . 2 . . . A 75 GLY HA3 . 25762 1 701 . 1 1 75 75 GLY C C 13 177.7000 0.5 . 1 . . . A 75 GLY C . 25762 1 702 . 1 1 75 75 GLY CA C 13 44.2870 0.5 . 1 . . . A 75 GLY CA . 25762 1 703 . 1 1 75 75 GLY N N 15 109.8810 0.5 . 1 . . . A 75 GLY N . 25762 1 704 . 1 1 76 76 GLU H H 1 8.4000 0.04 . 1 . . . A 76 GLU H . 25762 1 705 . 1 1 76 76 GLU HA H 1 4.2300 0.04 . 1 . . . A 76 GLU HA . 25762 1 706 . 1 1 76 76 GLU HB2 H 1 1.9600 0.04 . 2 . . . A 76 GLU HB2 . 25762 1 707 . 1 1 76 76 GLU HB3 H 1 2.0600 0.04 . 2 . . . A 76 GLU HB3 . 25762 1 708 . 1 1 76 76 GLU HG2 H 1 2.3700 0.04 . 2 . . . A 76 GLU HG2 . 25762 1 709 . 1 1 76 76 GLU C C 13 177.7700 0.5 . 1 . . . A 76 GLU C . 25762 1 710 . 1 1 76 76 GLU CA C 13 55.7000 0.5 . 1 . . . A 76 GLU CA . 25762 1 711 . 1 1 76 76 GLU CB C 13 30.6000 0.5 . 1 . . . A 76 GLU CB . 25762 1 712 . 1 1 76 76 GLU CG C 13 36.1100 0.5 . 1 . . . A 76 GLU CG . 25762 1 713 . 1 1 76 76 GLU N N 15 116.9000 0.5 . 1 . . . A 76 GLU N . 25762 1 714 . 1 1 77 77 CYS H H 1 8.9800 0.04 . 1 . . . A 77 CYS H . 25762 1 715 . 1 1 77 77 CYS HA H 1 4.1500 0.04 . 1 . . . A 77 CYS HA . 25762 1 716 . 1 1 77 77 CYS HB2 H 1 2.7900 0.04 . 2 . . . A 77 CYS HB2 . 25762 1 717 . 1 1 77 77 CYS HB3 H 1 2.9400 0.04 . 2 . . . A 77 CYS HB3 . 25762 1 718 . 1 1 77 77 CYS C C 13 174.1170 0.5 . 1 . . . A 77 CYS C . 25762 1 719 . 1 1 77 77 CYS CA C 13 56.7060 0.5 . 1 . . . A 77 CYS CA . 25762 1 720 . 1 1 77 77 CYS CB C 13 41.0560 0.5 . 1 . . . A 77 CYS CB . 25762 1 721 . 1 1 77 77 CYS N N 15 121.8460 0.5 . 1 . . . A 77 CYS N . 25762 1 722 . 1 1 78 78 ASP H H 1 8.2790 0.04 . 1 . . . A 78 ASP H . 25762 1 723 . 1 1 78 78 ASP HA H 1 4.6800 0.04 . 1 . . . A 78 ASP HA . 25762 1 724 . 1 1 78 78 ASP HB2 H 1 2.6400 0.04 . 2 . . . A 78 ASP HB2 . 25762 1 725 . 1 1 78 78 ASP C C 13 176.8900 0.5 . 1 . . . A 78 ASP C . 25762 1 726 . 1 1 78 78 ASP CA C 13 53.4920 0.5 . 1 . . . A 78 ASP CA . 25762 1 727 . 1 1 78 78 ASP CB C 13 41.8190 0.5 . 1 . . . A 78 ASP CB . 25762 1 728 . 1 1 78 78 ASP N N 15 131.7280 0.5 . 1 . . . A 78 ASP N . 25762 1 729 . 1 1 79 79 LEU H H 1 8.7630 0.04 . 1 . . . A 79 LEU H . 25762 1 730 . 1 1 79 79 LEU HA H 1 3.9900 0.04 . 1 . . . A 79 LEU HA . 25762 1 731 . 1 1 79 79 LEU HB2 H 1 1.6500 0.04 . 2 . . . A 79 LEU HB2 . 25762 1 732 . 1 1 79 79 LEU HB3 H 1 1.6800 0.04 . 2 . . . A 79 LEU HB3 . 25762 1 733 . 1 1 79 79 LEU HG H 1 1.5200 0.04 . 1 . . . A 79 LEU HG . 25762 1 734 . 1 1 79 79 LEU HD11 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD11 . 25762 1 735 . 1 1 79 79 LEU HD12 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD12 . 25762 1 736 . 1 1 79 79 LEU HD13 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD13 . 25762 1 737 . 1 1 79 79 LEU HD21 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD21 . 25762 1 738 . 1 1 79 79 LEU HD22 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD22 . 25762 1 739 . 1 1 79 79 LEU HD23 H 1 0.8900 0.04 . 2 . . . A 79 LEU HD23 . 25762 1 740 . 1 1 79 79 LEU C C 13 178.6270 0.5 . 1 . . . A 79 LEU C . 25762 1 741 . 1 1 79 79 LEU CA C 13 57.1790 0.5 . 1 . . . A 79 LEU CA . 25762 1 742 . 1 1 79 79 LEU CB C 13 41.6420 0.5 . 1 . . . A 79 LEU CB . 25762 1 743 . 1 1 79 79 LEU CG C 13 26.8900 0.5 . 1 . . . A 79 LEU CG . 25762 1 744 . 1 1 79 79 LEU CD1 C 13 22.9200 0.5 . 2 . . . A 79 LEU CD1 . 25762 1 745 . 1 1 79 79 LEU CD2 C 13 24.8100 0.5 . 2 . . . A 79 LEU CD2 . 25762 1 746 . 1 1 79 79 LEU N N 15 127.1910 0.5 . 1 . . . A 79 LEU N . 25762 1 747 . 1 1 80 80 ASN H H 1 8.7460 0.04 . 1 . . . A 80 ASN H . 25762 1 748 . 1 1 80 80 ASN HA H 1 4.5900 0.04 . 1 . . . A 80 ASN HA . 25762 1 749 . 1 1 80 80 ASN HB2 H 1 2.8030 0.04 . 2 . . . A 80 ASN HB2 . 25762 1 750 . 1 1 80 80 ASN HB3 H 1 3.0400 0.04 . 2 . . . A 80 ASN HB3 . 25762 1 751 . 1 1 80 80 ASN C C 13 176.9050 0.5 . 1 . . . A 80 ASN C . 25762 1 752 . 1 1 80 80 ASN CA C 13 55.8000 0.5 . 1 . . . A 80 ASN CA . 25762 1 753 . 1 1 80 80 ASN CB C 13 39.1510 0.5 . 1 . . . A 80 ASN CB . 25762 1 754 . 1 1 80 80 ASN N N 15 116.2380 0.5 . 1 . . . A 80 ASN N . 25762 1 755 . 1 1 81 81 THR H H 1 7.6660 0.04 . 1 . . . A 81 THR H . 25762 1 756 . 1 1 81 81 THR HA H 1 4.2400 0.04 . 1 . . . A 81 THR HA . 25762 1 757 . 1 1 81 81 THR HB H 1 4.1900 0.04 . 1 . . . A 81 THR HB . 25762 1 758 . 1 1 81 81 THR HG21 H 1 1.1400 0.04 . 1 . . . A 81 THR HG21 . 25762 1 759 . 1 1 81 81 THR HG22 H 1 1.1400 0.04 . 1 . . . A 81 THR HG22 . 25762 1 760 . 1 1 81 81 THR HG23 H 1 1.1400 0.04 . 1 . . . A 81 THR HG23 . 25762 1 761 . 1 1 81 81 THR C C 13 174.7270 0.5 . 1 . . . A 81 THR C . 25762 1 762 . 1 1 81 81 THR CA C 13 61.5400 0.5 . 1 . . . A 81 THR CA . 25762 1 763 . 1 1 81 81 THR CB C 13 70.9000 0.5 . 1 . . . A 81 THR CB . 25762 1 764 . 1 1 81 81 THR CG2 C 13 21.7200 0.5 . 1 . . . A 81 THR CG2 . 25762 1 765 . 1 1 81 81 THR N N 15 108.4590 0.5 . 1 . . . A 81 THR N . 25762 1 766 . 1 1 82 82 ALA H H 1 8.6870 0.04 . 1 . . . A 82 ALA H . 25762 1 767 . 1 1 82 82 ALA HA H 1 3.8200 0.04 . 1 . . . A 82 ALA HA . 25762 1 768 . 1 1 82 82 ALA HB1 H 1 1.4900 0.04 . 1 . . . A 82 ALA HB1 . 25762 1 769 . 1 1 82 82 ALA HB2 H 1 1.4900 0.04 . 1 . . . A 82 ALA HB2 . 25762 1 770 . 1 1 82 82 ALA HB3 H 1 1.4900 0.04 . 1 . . . A 82 ALA HB3 . 25762 1 771 . 1 1 82 82 ALA C C 13 176.5060 0.5 . 1 . . . A 82 ALA C . 25762 1 772 . 1 1 82 82 ALA CA C 13 53.6030 0.5 . 1 . . . A 82 ALA CA . 25762 1 773 . 1 1 82 82 ALA CB C 13 17.0130 0.5 . 1 . . . A 82 ALA CB . 25762 1 774 . 1 1 82 82 ALA N N 15 122.8700 0.5 . 1 . . . A 82 ALA N . 25762 1 775 . 1 1 83 83 LEU H H 1 7.3530 0.04 . 1 . . . A 83 LEU H . 25762 1 776 . 1 1 83 83 LEU HA H 1 5.0310 0.04 . 1 . . . A 83 LEU HA . 25762 1 777 . 1 1 83 83 LEU HB2 H 1 1.5900 0.04 . 2 . . . A 83 LEU HB2 . 25762 1 778 . 1 1 83 83 LEU HG H 1 1.1400 0.04 . 1 . . . A 83 LEU HG . 25762 1 779 . 1 1 83 83 LEU HD11 H 1 0.6500 0.04 . 2 . . . A 83 LEU HD11 . 25762 1 780 . 1 1 83 83 LEU HD12 H 1 0.6500 0.04 . 2 . . . A 83 LEU HD12 . 25762 1 781 . 1 1 83 83 LEU HD13 H 1 0.6500 0.04 . 2 . . . A 83 LEU HD13 . 25762 1 782 . 1 1 83 83 LEU HD21 H 1 0.7300 0.04 . 2 . . . A 83 LEU HD21 . 25762 1 783 . 1 1 83 83 LEU HD22 H 1 0.7300 0.04 . 2 . . . A 83 LEU HD22 . 25762 1 784 . 1 1 83 83 LEU HD23 H 1 0.7300 0.04 . 2 . . . A 83 LEU HD23 . 25762 1 785 . 1 1 83 83 LEU C C 13 177.6160 0.5 . 1 . . . A 83 LEU C . 25762 1 786 . 1 1 83 83 LEU CA C 13 54.0980 0.5 . 1 . . . A 83 LEU CA . 25762 1 787 . 1 1 83 83 LEU CB C 13 46.6220 0.5 . 1 . . . A 83 LEU CB . 25762 1 788 . 1 1 83 83 LEU CG C 13 25.3600 0.5 . 1 . . . A 83 LEU CG . 25762 1 789 . 1 1 83 83 LEU CD1 C 13 22.9200 0.5 . 2 . . . A 83 LEU CD1 . 25762 1 790 . 1 1 83 83 LEU CD2 C 13 23.4000 0.5 . 2 . . . A 83 LEU CD2 . 25762 1 791 . 1 1 83 83 LEU N N 15 117.3740 0.5 . 1 . . . A 83 LEU N . 25762 1 792 . 1 1 84 84 LYS H H 1 9.0430 0.04 . 1 . . . A 84 LYS H . 25762 1 793 . 1 1 84 84 LYS HA H 1 4.9400 0.04 . 1 . . . A 84 LYS HA . 25762 1 794 . 1 1 84 84 LYS HB2 H 1 1.6600 0.04 . 2 . . . A 84 LYS HB2 . 25762 1 795 . 1 1 84 84 LYS HG2 H 1 1.1200 0.04 . 2 . . . A 84 LYS HG2 . 25762 1 796 . 1 1 84 84 LYS HD2 H 1 1.2900 0.04 . 2 . . . A 84 LYS HD2 . 25762 1 797 . 1 1 84 84 LYS C C 13 175.4490 0.5 . 1 . . . A 84 LYS C . 25762 1 798 . 1 1 84 84 LYS CA C 13 54.2870 0.5 . 1 . . . A 84 LYS CA . 25762 1 799 . 1 1 84 84 LYS CB C 13 36.0600 0.5 . 1 . . . A 84 LYS CB . 25762 1 800 . 1 1 84 84 LYS CG C 13 23.7800 0.5 . 1 . . . A 84 LYS CG . 25762 1 801 . 1 1 84 84 LYS CD C 13 29.9300 0.5 . 1 . . . A 84 LYS CD . 25762 1 802 . 1 1 84 84 LYS CE C 13 41.7600 0.5 . 1 . . . A 84 LYS CE . 25762 1 803 . 1 1 84 84 LYS N N 15 122.0530 0.5 . 1 . . . A 84 LYS N . 25762 1 804 . 1 1 85 85 THR H H 1 9.0110 0.04 . 1 . . . A 85 THR H . 25762 1 805 . 1 1 85 85 THR HA H 1 5.8200 0.04 . 1 . . . A 85 THR HA . 25762 1 806 . 1 1 85 85 THR HB H 1 3.9500 0.04 . 1 . . . A 85 THR HB . 25762 1 807 . 1 1 85 85 THR HG21 H 1 1.1400 0.04 . 1 . . . A 85 THR HG21 . 25762 1 808 . 1 1 85 85 THR HG22 H 1 1.1400 0.04 . 1 . . . A 85 THR HG22 . 25762 1 809 . 1 1 85 85 THR HG23 H 1 1.1400 0.04 . 1 . . . A 85 THR HG23 . 25762 1 810 . 1 1 85 85 THR C C 13 174.1230 0.5 . 1 . . . A 85 THR C . 25762 1 811 . 1 1 85 85 THR CA C 13 61.2260 0.5 . 1 . . . A 85 THR CA . 25762 1 812 . 1 1 85 85 THR CB C 13 72.8570 0.5 . 1 . . . A 85 THR CB . 25762 1 813 . 1 1 85 85 THR CG2 C 13 21.8600 0.5 . 1 . . . A 85 THR CG2 . 25762 1 814 . 1 1 85 85 THR N N 15 114.8960 0.5 . 1 . . . A 85 THR N . 25762 1 815 . 1 1 86 86 ARG H H 1 9.0560 0.04 . 1 . . . A 86 ARG H . 25762 1 816 . 1 1 86 86 ARG C C 13 173.7920 0.5 . 1 . . . A 86 ARG C . 25762 1 817 . 1 1 86 86 ARG CA C 13 56.7200 0.5 . 1 . . . A 86 ARG CA . 25762 1 818 . 1 1 86 86 ARG CB C 13 33.1850 0.5 . 1 . . . A 86 ARG CB . 25762 1 819 . 1 1 86 86 ARG N N 15 123.8040 0.5 . 1 . . . A 86 ARG N . 25762 1 820 . 1 1 87 87 THR H H 1 8.3870 0.04 . 1 . . . A 87 THR H . 25762 1 821 . 1 1 87 87 THR HA H 1 5.2700 0.04 . 1 . . . A 87 THR HA . 25762 1 822 . 1 1 87 87 THR HB H 1 3.9200 0.04 . 1 . . . A 87 THR HB . 25762 1 823 . 1 1 87 87 THR HG21 H 1 1.1400 0.04 . 1 . . . A 87 THR HG21 . 25762 1 824 . 1 1 87 87 THR HG22 H 1 1.1400 0.04 . 1 . . . A 87 THR HG22 . 25762 1 825 . 1 1 87 87 THR HG23 H 1 1.1400 0.04 . 1 . . . A 87 THR HG23 . 25762 1 826 . 1 1 87 87 THR C C 13 173.9390 0.5 . 1 . . . A 87 THR C . 25762 1 827 . 1 1 87 87 THR CA C 13 61.0030 0.5 . 1 . . . A 87 THR CA . 25762 1 828 . 1 1 87 87 THR CB C 13 71.0910 0.5 . 1 . . . A 87 THR CB . 25762 1 829 . 1 1 87 87 THR CG2 C 13 21.5300 0.5 . 1 . . . A 87 THR CG2 . 25762 1 830 . 1 1 87 87 THR N N 15 117.7960 0.5 . 1 . . . A 87 THR N . 25762 1 831 . 1 1 88 88 GLY H H 1 9.0740 0.04 . 1 . . . A 88 GLY H . 25762 1 832 . 1 1 88 88 GLY HA2 H 1 4.7030 0.04 . 2 . . . A 88 GLY HA2 . 25762 1 833 . 1 1 88 88 GLY C C 13 171.6450 0.5 . 1 . . . A 88 GLY C . 25762 1 834 . 1 1 88 88 GLY CA C 13 44.6570 0.5 . 1 . . . A 88 GLY CA . 25762 1 835 . 1 1 88 88 GLY N N 15 112.5010 0.5 . 1 . . . A 88 GLY N . 25762 1 836 . 1 1 89 89 SER H H 1 8.2170 0.04 . 1 . . . A 89 SER H . 25762 1 837 . 1 1 89 89 SER HA H 1 5.2600 0.04 . 1 . . . A 89 SER HA . 25762 1 838 . 1 1 89 89 SER HB2 H 1 3.7700 0.04 . 2 . . . A 89 SER HB2 . 25762 1 839 . 1 1 89 89 SER C C 13 174.7670 0.5 . 1 . . . A 89 SER C . 25762 1 840 . 1 1 89 89 SER CA C 13 56.5120 0.5 . 1 . . . A 89 SER CA . 25762 1 841 . 1 1 89 89 SER CB C 13 65.4340 0.5 . 1 . . . A 89 SER CB . 25762 1 842 . 1 1 89 89 SER N N 15 115.8020 0.5 . 1 . . . A 89 SER N . 25762 1 843 . 1 1 90 90 LEU H H 1 8.5550 0.04 . 1 . . . A 90 LEU H . 25762 1 844 . 1 1 90 90 LEU HA H 1 3.4200 0.04 . 1 . . . A 90 LEU HA . 25762 1 845 . 1 1 90 90 LEU HB2 H 1 1.6400 0.04 . 2 . . . A 90 LEU HB2 . 25762 1 846 . 1 1 90 90 LEU HG H 1 0.6200 0.04 . 1 . . . A 90 LEU HG . 25762 1 847 . 1 1 90 90 LEU HD11 H 1 0.3170 0.04 . 2 . . . A 90 LEU HD11 . 25762 1 848 . 1 1 90 90 LEU HD12 H 1 0.3170 0.04 . 2 . . . A 90 LEU HD12 . 25762 1 849 . 1 1 90 90 LEU HD13 H 1 0.3170 0.04 . 2 . . . A 90 LEU HD13 . 25762 1 850 . 1 1 90 90 LEU C C 13 176.3990 0.5 . 1 . . . A 90 LEU C . 25762 1 851 . 1 1 90 90 LEU CA C 13 56.5580 0.5 . 1 . . . A 90 LEU CA . 25762 1 852 . 1 1 90 90 LEU CB C 13 43.0060 0.5 . 1 . . . A 90 LEU CB . 25762 1 853 . 1 1 90 90 LEU CG C 13 26.5800 0.5 . 1 . . . A 90 LEU CG . 25762 1 854 . 1 1 90 90 LEU CD1 C 13 21.9600 0.5 . 2 . . . A 90 LEU CD1 . 25762 1 855 . 1 1 90 90 LEU N N 15 128.5950 0.5 . 1 . . . A 90 LEU N . 25762 1 856 . 1 1 91 91 LYS H H 1 9.0650 0.04 . 1 . . . A 91 LYS H . 25762 1 857 . 1 1 91 91 LYS HA H 1 4.3300 0.04 . 1 . . . A 91 LYS HA . 25762 1 858 . 1 1 91 91 LYS HB2 H 1 1.5500 0.04 . 2 . . . A 91 LYS HB2 . 25762 1 859 . 1 1 91 91 LYS HG2 H 1 1.2800 0.04 . 2 . . . A 91 LYS HG2 . 25762 1 860 . 1 1 91 91 LYS HD2 H 1 1.4030 0.04 . 2 . . . A 91 LYS HD2 . 25762 1 861 . 1 1 91 91 LYS HE2 H 1 2.8500 0.04 . 2 . . . A 91 LYS HE2 . 25762 1 862 . 1 1 91 91 LYS C C 13 176.3180 0.5 . 1 . . . A 91 LYS C . 25762 1 863 . 1 1 91 91 LYS CA C 13 56.1030 0.5 . 1 . . . A 91 LYS CA . 25762 1 864 . 1 1 91 91 LYS CB C 13 33.5650 0.5 . 1 . . . A 91 LYS CB . 25762 1 865 . 1 1 91 91 LYS CG C 13 24.4900 0.5 . 1 . . . A 91 LYS CG . 25762 1 866 . 1 1 91 91 LYS CD C 13 28.5400 0.5 . 1 . . . A 91 LYS CD . 25762 1 867 . 1 1 91 91 LYS CE C 13 41.6700 0.5 . 1 . . . A 91 LYS CE . 25762 1 868 . 1 1 91 91 LYS N N 15 128.6460 0.5 . 1 . . . A 91 LYS N . 25762 1 869 . 1 1 92 92 ARG H H 1 7.6410 0.04 . 1 . . . A 92 ARG H . 25762 1 870 . 1 1 92 92 ARG HA H 1 4.2200 0.04 . 1 . . . A 92 ARG HA . 25762 1 871 . 1 1 92 92 ARG HB2 H 1 1.6300 0.04 . 2 . . . A 92 ARG HB2 . 25762 1 872 . 1 1 92 92 ARG HG2 H 1 1.4700 0.04 . 2 . . . A 92 ARG HG2 . 25762 1 873 . 1 1 92 92 ARG HD2 H 1 3.1200 0.04 . 2 . . . A 92 ARG HD2 . 25762 1 874 . 1 1 92 92 ARG C C 13 173.2590 0.5 . 1 . . . A 92 ARG C . 25762 1 875 . 1 1 92 92 ARG CA C 13 56.2590 0.5 . 1 . . . A 92 ARG CA . 25762 1 876 . 1 1 92 92 ARG CB C 13 32.6230 0.5 . 1 . . . A 92 ARG CB . 25762 1 877 . 1 1 92 92 ARG CG C 13 26.5900 0.5 . 1 . . . A 92 ARG CG . 25762 1 878 . 1 1 92 92 ARG CD C 13 43.4200 0.5 . 1 . . . A 92 ARG CD . 25762 1 879 . 1 1 92 92 ARG N N 15 118.8340 0.5 . 1 . . . A 92 ARG N . 25762 1 880 . 1 1 93 93 ALA H H 1 8.4510 0.04 . 1 . . . A 93 ALA H . 25762 1 881 . 1 1 93 93 ALA HA H 1 4.8700 0.04 . 1 . . . A 93 ALA HA . 25762 1 882 . 1 1 93 93 ALA HB1 H 1 1.2900 0.04 . 1 . . . A 93 ALA HB1 . 25762 1 883 . 1 1 93 93 ALA HB2 H 1 1.2900 0.04 . 1 . . . A 93 ALA HB2 . 25762 1 884 . 1 1 93 93 ALA HB3 H 1 1.2900 0.04 . 1 . . . A 93 ALA HB3 . 25762 1 885 . 1 1 93 93 ALA C C 13 177.0370 0.5 . 1 . . . A 93 ALA C . 25762 1 886 . 1 1 93 93 ALA CA C 13 50.9490 0.5 . 1 . . . A 93 ALA CA . 25762 1 887 . 1 1 93 93 ALA CB C 13 21.6640 0.5 . 1 . . . A 93 ALA CB . 25762 1 888 . 1 1 93 93 ALA N N 15 127.5740 0.5 . 1 . . . A 93 ALA N . 25762 1 889 . 1 1 94 94 LEU H H 1 8.6540 0.04 . 1 . . . A 94 LEU H . 25762 1 890 . 1 1 94 94 LEU HA H 1 4.2500 0.04 . 1 . . . A 94 LEU HA . 25762 1 891 . 1 1 94 94 LEU HB2 H 1 1.5040 0.04 . 2 . . . A 94 LEU HB2 . 25762 1 892 . 1 1 94 94 LEU HG H 1 1.1600 0.04 . 1 . . . A 94 LEU HG . 25762 1 893 . 1 1 94 94 LEU HD11 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD11 . 25762 1 894 . 1 1 94 94 LEU HD12 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD12 . 25762 1 895 . 1 1 94 94 LEU HD13 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD13 . 25762 1 896 . 1 1 94 94 LEU HD21 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD21 . 25762 1 897 . 1 1 94 94 LEU HD22 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD22 . 25762 1 898 . 1 1 94 94 LEU HD23 H 1 0.7850 0.04 . 2 . . . A 94 LEU HD23 . 25762 1 899 . 1 1 94 94 LEU C C 13 177.2560 0.5 . 1 . . . A 94 LEU C . 25762 1 900 . 1 1 94 94 LEU CA C 13 55.1370 0.5 . 1 . . . A 94 LEU CA . 25762 1 901 . 1 1 94 94 LEU CB C 13 42.6970 0.5 . 1 . . . A 94 LEU CB . 25762 1 902 . 1 1 94 94 LEU CG C 13 27.1700 0.5 . 1 . . . A 94 LEU CG . 25762 1 903 . 1 1 94 94 LEU CD1 C 13 23.1900 0.5 . 2 . . . A 94 LEU CD1 . 25762 1 904 . 1 1 94 94 LEU CD2 C 13 24.7900 0.5 . 2 . . . A 94 LEU CD2 . 25762 1 905 . 1 1 94 94 LEU N N 15 123.2960 0.5 . 1 . . . A 94 LEU N . 25762 1 906 . 1 1 95 95 HIS H H 1 8.6420 0.04 . 1 . . . A 95 HIS H . 25762 1 907 . 1 1 95 95 HIS HA H 1 4.4300 0.04 . 1 . . . A 95 HIS HA . 25762 1 908 . 1 1 95 95 HIS HB2 H 1 3.2100 0.04 . 2 . . . A 95 HIS HB2 . 25762 1 909 . 1 1 95 95 HIS HD2 H 1 7.1700 0.04 . 1 . . . A 95 HIS HD2 . 25762 1 910 . 1 1 95 95 HIS HE1 H 1 8.3600 0.04 . 1 . . . A 95 HIS HE1 . 25762 1 911 . 1 1 95 95 HIS C C 13 174.8010 0.5 . 1 . . . A 95 HIS C . 25762 1 912 . 1 1 95 95 HIS CA C 13 56.4000 0.5 . 1 . . . A 95 HIS CA . 25762 1 913 . 1 1 95 95 HIS CB C 13 28.2180 0.5 . 1 . . . A 95 HIS CB . 25762 1 914 . 1 1 95 95 HIS CD2 C 13 119.8000 0.5 . 1 . . . A 95 HIS CD2 . 25762 1 915 . 1 1 95 95 HIS CE1 C 13 136.5000 0.5 . 1 . . . A 95 HIS CE1 . 25762 1 916 . 1 1 95 95 HIS N N 15 116.4130 0.5 . 1 . . . A 95 HIS N . 25762 1 917 . 1 1 96 96 ASN H H 1 8.4610 0.04 . 1 . . . A 96 ASN H . 25762 1 918 . 1 1 96 96 ASN HA H 1 4.4500 0.04 . 1 . . . A 96 ASN HA . 25762 1 919 . 1 1 96 96 ASN HB2 H 1 2.8700 0.04 . 2 . . . A 96 ASN HB2 . 25762 1 920 . 1 1 96 96 ASN HD21 H 1 7.7800 0.04 . 2 . . . A 96 ASN HD21 . 25762 1 921 . 1 1 96 96 ASN C C 13 175.0260 0.5 . 1 . . . A 96 ASN C . 25762 1 922 . 1 1 96 96 ASN CA C 13 53.6920 0.5 . 1 . . . A 96 ASN CA . 25762 1 923 . 1 1 96 96 ASN CB C 13 38.0560 0.5 . 1 . . . A 96 ASN CB . 25762 1 924 . 1 1 96 96 ASN N N 15 115.8240 0.5 . 1 . . . A 96 ASN N . 25762 1 925 . 1 1 97 97 ALA H H 1 7.7910 0.04 . 1 . . . A 97 ALA H . 25762 1 926 . 1 1 97 97 ALA HA H 1 4.1300 0.04 . 1 . . . A 97 ALA HA . 25762 1 927 . 1 1 97 97 ALA HB1 H 1 1.3700 0.04 . 1 . . . A 97 ALA HB1 . 25762 1 928 . 1 1 97 97 ALA HB2 H 1 1.3700 0.04 . 1 . . . A 97 ALA HB2 . 25762 1 929 . 1 1 97 97 ALA HB3 H 1 1.3700 0.04 . 1 . . . A 97 ALA HB3 . 25762 1 930 . 1 1 97 97 ALA C C 13 177.3370 0.5 . 1 . . . A 97 ALA C . 25762 1 931 . 1 1 97 97 ALA CA C 13 53.4300 0.5 . 1 . . . A 97 ALA CA . 25762 1 932 . 1 1 97 97 ALA CB C 13 20.2040 0.5 . 1 . . . A 97 ALA CB . 25762 1 933 . 1 1 97 97 ALA N N 15 122.5580 0.5 . 1 . . . A 97 ALA N . 25762 1 934 . 1 1 98 98 GLU H H 1 8.4780 0.04 . 1 . . . A 98 GLU H . 25762 1 935 . 1 1 98 98 GLU HA H 1 4.3200 0.04 . 1 . . . A 98 GLU HA . 25762 1 936 . 1 1 98 98 GLU HB2 H 1 1.9500 0.04 . 2 . . . A 98 GLU HB2 . 25762 1 937 . 1 1 98 98 GLU HG2 H 1 2.2500 0.04 . 2 . . . A 98 GLU HG2 . 25762 1 938 . 1 1 98 98 GLU C C 13 176.1540 0.5 . 1 . . . A 98 GLU C . 25762 1 939 . 1 1 98 98 GLU CA C 13 56.6300 0.5 . 1 . . . A 98 GLU CA . 25762 1 940 . 1 1 98 98 GLU CB C 13 29.4960 0.5 . 1 . . . A 98 GLU CB . 25762 1 941 . 1 1 98 98 GLU CG C 13 36.0800 0.5 . 1 . . . A 98 GLU CG . 25762 1 942 . 1 1 98 98 GLU N N 15 120.5040 0.5 . 1 . . . A 98 GLU N . 25762 1 943 . 1 1 99 99 CYS H H 1 7.9780 0.04 . 1 . . . A 99 CYS H . 25762 1 944 . 1 1 99 99 CYS HA H 1 4.8200 0.04 . 1 . . . A 99 CYS HA . 25762 1 945 . 1 1 99 99 CYS HB2 H 1 2.6040 0.04 . 2 . . . A 99 CYS HB2 . 25762 1 946 . 1 1 99 99 CYS HB3 H 1 2.9030 0.04 . 2 . . . A 99 CYS HB3 . 25762 1 947 . 1 1 99 99 CYS C C 13 174.7110 0.5 . 1 . . . A 99 CYS C . 25762 1 948 . 1 1 99 99 CYS CA C 13 53.9850 0.5 . 1 . . . A 99 CYS CA . 25762 1 949 . 1 1 99 99 CYS CB C 13 44.1770 0.5 . 1 . . . A 99 CYS CB . 25762 1 950 . 1 1 99 99 CYS N N 15 122.3990 0.5 . 1 . . . A 99 CYS N . 25762 1 951 . 1 1 100 100 GLN H H 1 8.8640 0.04 . 1 . . . A 100 GLN H . 25762 1 952 . 1 1 100 100 GLN HA H 1 4.3000 0.04 . 1 . . . A 100 GLN HA . 25762 1 953 . 1 1 100 100 GLN HB2 H 1 1.9200 0.04 . 2 . . . A 100 GLN HB2 . 25762 1 954 . 1 1 100 100 GLN HB3 H 1 2.1800 0.04 . 2 . . . A 100 GLN HB3 . 25762 1 955 . 1 1 100 100 GLN HG2 H 1 2.5200 0.04 . 2 . . . A 100 GLN HG2 . 25762 1 956 . 1 1 100 100 GLN C C 13 178.3170 0.5 . 1 . . . A 100 GLN C . 25762 1 957 . 1 1 100 100 GLN CA C 13 56.1570 0.5 . 1 . . . A 100 GLN CA . 25762 1 958 . 1 1 100 100 GLN CB C 13 29.3030 0.5 . 1 . . . A 100 GLN CB . 25762 1 959 . 1 1 100 100 GLN CG C 13 34.1300 0.5 . 1 . . . A 100 GLN CG . 25762 1 960 . 1 1 100 100 GLN N N 15 123.5390 0.5 . 1 . . . A 100 GLN N . 25762 1 961 . 1 1 101 101 LYS H H 1 9.0630 0.04 . 1 . . . A 101 LYS H . 25762 1 962 . 1 1 101 101 LYS HA H 1 4.0200 0.04 . 1 . . . A 101 LYS HA . 25762 1 963 . 1 1 101 101 LYS HB2 H 1 1.9500 0.04 . 2 . . . A 101 LYS HB2 . 25762 1 964 . 1 1 101 101 LYS HG2 H 1 1.6100 0.04 . 2 . . . A 101 LYS HG2 . 25762 1 965 . 1 1 101 101 LYS HD2 H 1 1.7700 0.04 . 2 . . . A 101 LYS HD2 . 25762 1 966 . 1 1 101 101 LYS HE2 H 1 3.0300 0.04 . 2 . . . A 101 LYS HE2 . 25762 1 967 . 1 1 101 101 LYS C C 13 176.6690 0.5 . 1 . . . A 101 LYS C . 25762 1 968 . 1 1 101 101 LYS CA C 13 59.8760 0.5 . 1 . . . A 101 LYS CA . 25762 1 969 . 1 1 101 101 LYS CB C 13 32.7600 0.5 . 1 . . . A 101 LYS CB . 25762 1 970 . 1 1 101 101 LYS CG C 13 25.4600 0.5 . 1 . . . A 101 LYS CG . 25762 1 971 . 1 1 101 101 LYS CD C 13 28.9300 0.5 . 1 . . . A 101 LYS CD . 25762 1 972 . 1 1 101 101 LYS CE C 13 42.0300 0.5 . 1 . . . A 101 LYS CE . 25762 1 973 . 1 1 101 101 LYS N N 15 125.1530 0.5 . 1 . . . A 101 LYS N . 25762 1 974 . 1 1 102 102 THR H H 1 7.7060 0.04 . 1 . . . A 102 THR H . 25762 1 975 . 1 1 102 102 THR HA H 1 5.2600 0.04 . 1 . . . A 102 THR HA . 25762 1 976 . 1 1 102 102 THR HB H 1 3.9800 0.04 . 1 . . . A 102 THR HB . 25762 1 977 . 1 1 102 102 THR HG21 H 1 1.1400 0.04 . 1 . . . A 102 THR HG21 . 25762 1 978 . 1 1 102 102 THR HG22 H 1 1.1400 0.04 . 1 . . . A 102 THR HG22 . 25762 1 979 . 1 1 102 102 THR HG23 H 1 1.1400 0.04 . 1 . . . A 102 THR HG23 . 25762 1 980 . 1 1 102 102 THR C C 13 173.0970 0.5 . 1 . . . A 102 THR C . 25762 1 981 . 1 1 102 102 THR CA C 13 59.9220 0.5 . 1 . . . A 102 THR CA . 25762 1 982 . 1 1 102 102 THR CB C 13 71.7880 0.5 . 1 . . . A 102 THR CB . 25762 1 983 . 1 1 102 102 THR CG2 C 13 21.7600 0.5 . 1 . . . A 102 THR CG2 . 25762 1 984 . 1 1 102 102 THR N N 15 111.2080 0.5 . 1 . . . A 102 THR N . 25762 1 985 . 1 1 103 103 VAL H H 1 8.1920 0.04 . 1 . . . A 103 VAL H . 25762 1 986 . 1 1 103 103 VAL HA H 1 4.5100 0.04 . 1 . . . A 103 VAL HA . 25762 1 987 . 1 1 103 103 VAL HB H 1 1.5400 0.04 . 1 . . . A 103 VAL HB . 25762 1 988 . 1 1 103 103 VAL HG11 H 1 0.2300 0.04 . 2 . . . A 103 VAL HG11 . 25762 1 989 . 1 1 103 103 VAL HG12 H 1 0.2300 0.04 . 2 . . . A 103 VAL HG12 . 25762 1 990 . 1 1 103 103 VAL HG13 H 1 0.2300 0.04 . 2 . . . A 103 VAL HG13 . 25762 1 991 . 1 1 103 103 VAL HG21 H 1 -0.1100 0.04 . 2 . . . A 103 VAL HG21 . 25762 1 992 . 1 1 103 103 VAL HG22 H 1 -0.1100 0.04 . 2 . . . A 103 VAL HG22 . 25762 1 993 . 1 1 103 103 VAL HG23 H 1 -0.1100 0.04 . 2 . . . A 103 VAL HG23 . 25762 1 994 . 1 1 103 103 VAL C C 13 174.1320 0.5 . 1 . . . A 103 VAL C . 25762 1 995 . 1 1 103 103 VAL CA C 13 59.5380 0.5 . 1 . . . A 103 VAL CA . 25762 1 996 . 1 1 103 103 VAL CB C 13 35.5230 0.5 . 1 . . . A 103 VAL CB . 25762 1 997 . 1 1 103 103 VAL CG1 C 13 21.4000 0.5 . 2 . . . A 103 VAL CG1 . 25762 1 998 . 1 1 103 103 VAL CG2 C 13 17.5400 0.5 . 2 . . . A 103 VAL CG2 . 25762 1 999 . 1 1 103 103 VAL N N 15 117.3950 0.5 . 1 . . . A 103 VAL N . 25762 1 1000 . 1 1 104 104 THR H H 1 8.3320 0.04 . 1 . . . A 104 THR H . 25762 1 1001 . 1 1 104 104 THR HA H 1 5.0980 0.04 . 1 . . . A 104 THR HA . 25762 1 1002 . 1 1 104 104 THR HB H 1 3.8600 0.04 . 1 . . . A 104 THR HB . 25762 1 1003 . 1 1 104 104 THR HG21 H 1 1.0800 0.04 . 1 . . . A 104 THR HG21 . 25762 1 1004 . 1 1 104 104 THR HG22 H 1 1.0800 0.04 . 1 . . . A 104 THR HG22 . 25762 1 1005 . 1 1 104 104 THR HG23 H 1 1.0800 0.04 . 1 . . . A 104 THR HG23 . 25762 1 1006 . 1 1 104 104 THR C C 13 173.6460 0.5 . 1 . . . A 104 THR C . 25762 1 1007 . 1 1 104 104 THR CA C 13 61.4580 0.5 . 1 . . . A 104 THR CA . 25762 1 1008 . 1 1 104 104 THR CB C 13 71.1770 0.5 . 1 . . . A 104 THR CB . 25762 1 1009 . 1 1 104 104 THR CG2 C 13 21.6200 0.5 . 1 . . . A 104 THR CG2 . 25762 1 1010 . 1 1 104 104 THR N N 15 117.8620 0.5 . 1 . . . A 104 THR N . 25762 1 1011 . 1 1 105 105 ILE H H 1 8.8680 0.04 . 1 . . . A 105 ILE H . 25762 1 1012 . 1 1 105 105 ILE HA H 1 4.6700 0.04 . 1 . . . A 105 ILE HA . 25762 1 1013 . 1 1 105 105 ILE HB H 1 1.7200 0.04 . 1 . . . A 105 ILE HB . 25762 1 1014 . 1 1 105 105 ILE HG12 H 1 1.2400 0.04 . 2 . . . A 105 ILE HG12 . 25762 1 1015 . 1 1 105 105 ILE HG21 H 1 0.9600 0.04 . 1 . . . A 105 ILE HG21 . 25762 1 1016 . 1 1 105 105 ILE HG22 H 1 0.9600 0.04 . 1 . . . A 105 ILE HG22 . 25762 1 1017 . 1 1 105 105 ILE HG23 H 1 0.9600 0.04 . 1 . . . A 105 ILE HG23 . 25762 1 1018 . 1 1 105 105 ILE HD11 H 1 0.5300 0.04 . 1 . . . A 105 ILE HD11 . 25762 1 1019 . 1 1 105 105 ILE HD12 H 1 0.5300 0.04 . 1 . . . A 105 ILE HD12 . 25762 1 1020 . 1 1 105 105 ILE HD13 H 1 0.5300 0.04 . 1 . . . A 105 ILE HD13 . 25762 1 1021 . 1 1 105 105 ILE C C 13 174.2960 0.5 . 1 . . . A 105 ILE C . 25762 1 1022 . 1 1 105 105 ILE CA C 13 59.6950 0.5 . 1 . . . A 105 ILE CA . 25762 1 1023 . 1 1 105 105 ILE CB C 13 41.1160 0.5 . 1 . . . A 105 ILE CB . 25762 1 1024 . 1 1 105 105 ILE CG1 C 13 27.2200 0.5 . 1 . . . A 105 ILE CG1 . 25762 1 1025 . 1 1 105 105 ILE CG2 C 13 17.9700 0.5 . 1 . . . A 105 ILE CG2 . 25762 1 1026 . 1 1 105 105 ILE CD1 C 13 13.2500 0.5 . 1 . . . A 105 ILE CD1 . 25762 1 1027 . 1 1 105 105 ILE N N 15 124.4310 0.5 . 1 . . . A 105 ILE N . 25762 1 1028 . 1 1 106 106 SER H H 1 8.5590 0.04 . 1 . . . A 106 SER H . 25762 1 1029 . 1 1 106 106 SER HA H 1 3.7600 0.04 . 1 . . . A 106 SER HA . 25762 1 1030 . 1 1 106 106 SER HB2 H 1 3.7600 0.04 . 2 . . . A 106 SER HB2 . 25762 1 1031 . 1 1 106 106 SER C C 13 173.4410 0.5 . 1 . . . A 106 SER C . 25762 1 1032 . 1 1 106 106 SER CA C 13 56.8770 0.5 . 1 . . . A 106 SER CA . 25762 1 1033 . 1 1 106 106 SER CB C 13 67.1150 0.5 . 1 . . . A 106 SER CB . 25762 1 1034 . 1 1 106 106 SER N N 15 118.4300 0.5 . 1 . . . A 106 SER N . 25762 1 1035 . 1 1 107 107 LYS H H 1 9.0600 0.04 . 1 . . . A 107 LYS H . 25762 1 1036 . 1 1 107 107 LYS CA C 13 53.6250 0.5 . 1 . . . A 107 LYS CA . 25762 1 1037 . 1 1 107 107 LYS CB C 13 35.5150 0.5 . 1 . . . A 107 LYS CB . 25762 1 1038 . 1 1 107 107 LYS N N 15 121.9760 0.5 . 1 . . . A 107 LYS N . 25762 1 1039 . 1 1 108 108 PRO HA H 1 4.9400 0.04 . 1 . . . A 108 PRO HA . 25762 1 1040 . 1 1 108 108 PRO HB2 H 1 2.4500 0.04 . 2 . . . A 108 PRO HB2 . 25762 1 1041 . 1 1 108 108 PRO HG2 H 1 1.8100 0.04 . 2 . . . A 108 PRO HG2 . 25762 1 1042 . 1 1 108 108 PRO HG3 H 1 1.9900 0.04 . 2 . . . A 108 PRO HG3 . 25762 1 1043 . 1 1 108 108 PRO HD2 H 1 3.8200 0.04 . 2 . . . A 108 PRO HD2 . 25762 1 1044 . 1 1 108 108 PRO HD3 H 1 4.1600 0.04 . 2 . . . A 108 PRO HD3 . 25762 1 1045 . 1 1 108 108 PRO C C 13 176.7410 0.5 . 1 . . . A 108 PRO C . 25762 1 1046 . 1 1 108 108 PRO CA C 13 62.8700 0.5 . 1 . . . A 108 PRO CA . 25762 1 1047 . 1 1 108 108 PRO CB C 13 32.5900 0.5 . 1 . . . A 108 PRO CB . 25762 1 1048 . 1 1 108 108 PRO CG C 13 27.5300 0.5 . 1 . . . A 108 PRO CG . 25762 1 1049 . 1 1 108 108 PRO CD C 13 51.4900 0.5 . 1 . . . A 108 PRO CD . 25762 1 1050 . 1 1 109 109 CYS H H 1 8.2370 0.04 . 1 . . . A 109 CYS H . 25762 1 1051 . 1 1 109 109 CYS HA H 1 4.5010 0.04 . 1 . . . A 109 CYS HA . 25762 1 1052 . 1 1 109 109 CYS HB2 H 1 2.9500 0.04 . 2 . . . A 109 CYS HB2 . 25762 1 1053 . 1 1 109 109 CYS HB3 H 1 3.2500 0.04 . 2 . . . A 109 CYS HB3 . 25762 1 1054 . 1 1 109 109 CYS C C 13 173.3690 0.5 . 1 . . . A 109 CYS C . 25762 1 1055 . 1 1 109 109 CYS CA C 13 55.9500 0.5 . 1 . . . A 109 CYS CA . 25762 1 1056 . 1 1 109 109 CYS CB C 13 44.6200 0.5 . 1 . . . A 109 CYS CB . 25762 1 1057 . 1 1 109 109 CYS N N 15 118.3130 0.5 . 1 . . . A 109 CYS N . 25762 1 1058 . 1 1 110 110 GLY H H 1 8.2200 0.04 . 1 . . . A 110 GLY H . 25762 1 1059 . 1 1 110 110 GLY HA2 H 1 3.9000 0.04 . 2 . . . A 110 GLY HA2 . 25762 1 1060 . 1 1 110 110 GLY C C 13 173.4550 0.5 . 1 . . . A 110 GLY C . 25762 1 1061 . 1 1 110 110 GLY CA C 13 45.2760 0.5 . 1 . . . A 110 GLY CA . 25762 1 1062 . 1 1 110 110 GLY N N 15 108.6770 0.5 . 1 . . . A 110 GLY N . 25762 1 1063 . 1 1 111 111 LYS H H 1 8.2390 0.04 . 1 . . . A 111 LYS H . 25762 1 1064 . 1 1 111 111 LYS HA H 1 4.2700 0.04 . 1 . . . A 111 LYS HA . 25762 1 1065 . 1 1 111 111 LYS HB2 H 1 1.7500 0.04 . 2 . . . A 111 LYS HB2 . 25762 1 1066 . 1 1 111 111 LYS HG2 H 1 1.4200 0.04 . 2 . . . A 111 LYS HG2 . 25762 1 1067 . 1 1 111 111 LYS HE2 H 1 2.9900 0.04 . 2 . . . A 111 LYS HE2 . 25762 1 1068 . 1 1 111 111 LYS C C 13 176.5970 0.5 . 1 . . . A 111 LYS C . 25762 1 1069 . 1 1 111 111 LYS CA C 13 56.4200 0.5 . 1 . . . A 111 LYS CA . 25762 1 1070 . 1 1 111 111 LYS CB C 13 33.4700 0.5 . 1 . . . A 111 LYS CB . 25762 1 1071 . 1 1 111 111 LYS CG C 13 26.2300 0.5 . 1 . . . A 111 LYS CG . 25762 1 1072 . 1 1 111 111 LYS CD C 13 29.0100 0.5 . 1 . . . A 111 LYS CD . 25762 1 1073 . 1 1 111 111 LYS CE C 13 42.1200 0.5 . 1 . . . A 111 LYS CE . 25762 1 1074 . 1 1 111 111 LYS N N 15 121.3610 0.5 . 1 . . . A 111 LYS N . 25762 1 1075 . 1 1 112 112 LEU H H 1 8.3400 0.04 . 1 . . . A 112 LEU H . 25762 1 1076 . 1 1 112 112 LEU HA H 1 4.4100 0.04 . 1 . . . A 112 LEU HA . 25762 1 1077 . 1 1 112 112 LEU HB2 H 1 1.5900 0.04 . 2 . . . A 112 LEU HB2 . 25762 1 1078 . 1 1 112 112 LEU HD11 H 1 0.8800 0.04 . 2 . . . A 112 LEU HD11 . 25762 1 1079 . 1 1 112 112 LEU HD12 H 1 0.8800 0.04 . 2 . . . A 112 LEU HD12 . 25762 1 1080 . 1 1 112 112 LEU HD13 H 1 0.8800 0.04 . 2 . . . A 112 LEU HD13 . 25762 1 1081 . 1 1 112 112 LEU C C 13 177.4040 0.5 . 1 . . . A 112 LEU C . 25762 1 1082 . 1 1 112 112 LEU CA C 13 55.1500 0.5 . 1 . . . A 112 LEU CA . 25762 1 1083 . 1 1 112 112 LEU CB C 13 42.3490 0.5 . 1 . . . A 112 LEU CB . 25762 1 1084 . 1 1 112 112 LEU CG C 13 26.9900 0.5 . 1 . . . A 112 LEU CG . 25762 1 1085 . 1 1 112 112 LEU CD1 C 13 24.8600 0.5 . 2 . . . A 112 LEU CD1 . 25762 1 1086 . 1 1 112 112 LEU CD2 C 13 23.5600 0.5 . 2 . . . A 112 LEU CD2 . 25762 1 1087 . 1 1 112 112 LEU N N 15 123.9710 0.5 . 1 . . . A 112 LEU N . 25762 1 1088 . 1 1 113 113 THR H H 1 8.1500 0.04 . 1 . . . A 113 THR H . 25762 1 1089 . 1 1 113 113 THR HA H 1 4.3100 0.04 . 1 . . . A 113 THR HA . 25762 1 1090 . 1 1 113 113 THR HB H 1 4.1300 0.04 . 1 . . . A 113 THR HB . 25762 1 1091 . 1 1 113 113 THR HG21 H 1 1.1500 0.04 . 1 . . . A 113 THR HG21 . 25762 1 1092 . 1 1 113 113 THR HG22 H 1 1.1500 0.04 . 1 . . . A 113 THR HG22 . 25762 1 1093 . 1 1 113 113 THR HG23 H 1 1.1500 0.04 . 1 . . . A 113 THR HG23 . 25762 1 1094 . 1 1 113 113 THR C C 13 174.0820 0.5 . 1 . . . A 113 THR C . 25762 1 1095 . 1 1 113 113 THR CA C 13 61.6760 0.5 . 1 . . . A 113 THR CA . 25762 1 1096 . 1 1 113 113 THR CB C 13 69.0900 0.5 . 1 . . . A 113 THR CB . 25762 1 1097 . 1 1 113 113 THR CG2 C 13 21.7600 0.5 . 1 . . . A 113 THR CG2 . 25762 1 1098 . 1 1 113 113 THR N N 15 116.6530 0.5 . 1 . . . A 113 THR N . 25762 1 1099 . 1 1 114 114 LYS H H 1 8.2900 0.04 . 1 . . . A 114 LYS H . 25762 1 1100 . 1 1 114 114 LYS CA C 13 54.1570 0.5 . 1 . . . A 114 LYS CA . 25762 1 1101 . 1 1 114 114 LYS CB C 13 32.8200 0.5 . 1 . . . A 114 LYS CB . 25762 1 1102 . 1 1 114 114 LYS N N 15 125.7700 0.5 . 1 . . . A 114 LYS N . 25762 1 1103 . 1 1 115 115 PRO HA H 1 4.3500 0.04 . 1 . . . A 115 PRO HA . 25762 1 1104 . 1 1 115 115 PRO HB2 H 1 2.2700 0.04 . 2 . . . A 115 PRO HB2 . 25762 1 1105 . 1 1 115 115 PRO HB3 H 1 1.9800 0.04 . 2 . . . A 115 PRO HB3 . 25762 1 1106 . 1 1 115 115 PRO HG2 H 1 1.7800 0.04 . 2 . . . A 115 PRO HG2 . 25762 1 1107 . 1 1 115 115 PRO HD2 H 1 3.5900 0.04 . 2 . . . A 115 PRO HD2 . 25762 1 1108 . 1 1 115 115 PRO HD3 H 1 3.8200 0.04 . 2 . . . A 115 PRO HD3 . 25762 1 1109 . 1 1 115 115 PRO C C 13 176.6790 0.5 . 1 . . . A 115 PRO C . 25762 1 1110 . 1 1 115 115 PRO CA C 13 62.9600 0.5 . 1 . . . A 115 PRO CA . 25762 1 1111 . 1 1 115 115 PRO CB C 13 31.8600 0.5 . 1 . . . A 115 PRO CB . 25762 1 1112 . 1 1 115 115 PRO CG C 13 27.1900 0.5 . 1 . . . A 115 PRO CG . 25762 1 1113 . 1 1 115 115 PRO CD C 13 50.8400 0.5 . 1 . . . A 115 PRO CD . 25762 1 1114 . 1 1 116 116 LYS H H 1 8.4410 0.04 . 1 . . . A 116 LYS H . 25762 1 1115 . 1 1 116 116 LYS CA C 13 54.3380 0.5 . 1 . . . A 116 LYS CA . 25762 1 1116 . 1 1 116 116 LYS CB C 13 32.9130 0.5 . 1 . . . A 116 LYS CB . 25762 1 1117 . 1 1 116 116 LYS N N 15 123.8180 0.5 . 1 . . . A 116 LYS N . 25762 1 1118 . 1 1 117 117 PRO HA H 1 4.4030 0.04 . 1 . . . A 117 PRO HA . 25762 1 1119 . 1 1 117 117 PRO HB2 H 1 2.2900 0.04 . 2 . . . A 117 PRO HB2 . 25762 1 1120 . 1 1 117 117 PRO HG2 H 1 1.9400 0.04 . 2 . . . A 117 PRO HG2 . 25762 1 1121 . 1 1 117 117 PRO HD2 H 1 3.6400 0.04 . 2 . . . A 117 PRO HD2 . 25762 1 1122 . 1 1 117 117 PRO HD3 H 1 3.8200 0.04 . 2 . . . A 117 PRO HD3 . 25762 1 1123 . 1 1 117 117 PRO C C 13 177.0380 0.5 . 1 . . . A 117 PRO C . 25762 1 1124 . 1 1 117 117 PRO CA C 13 63.3600 0.5 . 1 . . . A 117 PRO CA . 25762 1 1125 . 1 1 117 117 PRO CB C 13 32.0600 0.5 . 1 . . . A 117 PRO CB . 25762 1 1126 . 1 1 117 117 PRO CG C 13 27.3900 0.5 . 1 . . . A 117 PRO CG . 25762 1 1127 . 1 1 117 117 PRO CD C 13 50.7200 0.5 . 1 . . . A 117 PRO CD . 25762 1 1128 . 1 1 118 118 GLN H H 1 8.5100 0.04 . 1 . . . A 118 GLN H . 25762 1 1129 . 1 1 118 118 GLN HA H 1 4.2700 0.04 . 1 . . . A 118 GLN HA . 25762 1 1130 . 1 1 118 118 GLN HB2 H 1 2.0300 0.04 . 2 . . . A 118 GLN HB2 . 25762 1 1131 . 1 1 118 118 GLN HG2 H 1 2.3900 0.04 . 2 . . . A 118 GLN HG2 . 25762 1 1132 . 1 1 118 118 GLN C C 13 175.9630 0.5 . 1 . . . A 118 GLN C . 25762 1 1133 . 1 1 118 118 GLN CA C 13 55.9160 0.5 . 1 . . . A 118 GLN CA . 25762 1 1134 . 1 1 118 118 GLN CB C 13 29.7430 0.5 . 1 . . . A 118 GLN CB . 25762 1 1135 . 1 1 118 118 GLN CG C 13 33.7400 0.5 . 1 . . . A 118 GLN CG . 25762 1 1136 . 1 1 118 118 GLN N N 15 121.5960 0.5 . 1 . . . A 118 GLN N . 25762 1 1137 . 1 1 119 119 ALA H H 1 8.3890 0.04 . 1 . . . A 119 ALA H . 25762 1 1138 . 1 1 119 119 ALA HA H 1 4.2700 0.04 . 1 . . . A 119 ALA HA . 25762 1 1139 . 1 1 119 119 ALA HB1 H 1 1.3900 0.04 . 1 . . . A 119 ALA HB1 . 25762 1 1140 . 1 1 119 119 ALA HB2 H 1 1.3900 0.04 . 1 . . . A 119 ALA HB2 . 25762 1 1141 . 1 1 119 119 ALA HB3 H 1 1.3900 0.04 . 1 . . . A 119 ALA HB3 . 25762 1 1142 . 1 1 119 119 ALA C C 13 177.9210 0.5 . 1 . . . A 119 ALA C . 25762 1 1143 . 1 1 119 119 ALA CA C 13 52.7650 0.5 . 1 . . . A 119 ALA CA . 25762 1 1144 . 1 1 119 119 ALA CB C 13 19.5010 0.5 . 1 . . . A 119 ALA CB . 25762 1 1145 . 1 1 119 119 ALA N N 15 126.0730 0.5 . 1 . . . A 119 ALA N . 25762 1 1146 . 1 1 120 120 GLU H H 1 8.4410 0.04 . 1 . . . A 120 GLU H . 25762 1 1147 . 1 1 120 120 GLU HA H 1 4.2600 0.04 . 1 . . . A 120 GLU HA . 25762 1 1148 . 1 1 120 120 GLU HB2 H 1 1.9900 0.04 . 2 . . . A 120 GLU HB2 . 25762 1 1149 . 1 1 120 120 GLU HG2 H 1 2.2700 0.04 . 2 . . . A 120 GLU HG2 . 25762 1 1150 . 1 1 120 120 GLU C C 13 176.8190 0.5 . 1 . . . A 120 GLU C . 25762 1 1151 . 1 1 120 120 GLU CA C 13 56.6800 0.5 . 1 . . . A 120 GLU CA . 25762 1 1152 . 1 1 120 120 GLU CB C 13 30.4820 0.5 . 1 . . . A 120 GLU CB . 25762 1 1153 . 1 1 120 120 GLU CG C 13 36.2000 0.5 . 1 . . . A 120 GLU CG . 25762 1 1154 . 1 1 120 120 GLU N N 15 121.1070 0.5 . 1 . . . A 120 GLU N . 25762 1 1155 . 1 1 121 121 SER H H 1 8.3790 0.04 . 1 . . . A 121 SER H . 25762 1 1156 . 1 1 121 121 SER HA H 1 4.4100 0.04 . 1 . . . A 121 SER HA . 25762 1 1157 . 1 1 121 121 SER HB2 H 1 3.8500 0.04 . 2 . . . A 121 SER HB2 . 25762 1 1158 . 1 1 121 121 SER HB3 H 1 3.8900 0.04 . 2 . . . A 121 SER HB3 . 25762 1 1159 . 1 1 121 121 SER C C 13 174.8920 0.5 . 1 . . . A 121 SER C . 25762 1 1160 . 1 1 121 121 SER CA C 13 58.5480 0.5 . 1 . . . A 121 SER CA . 25762 1 1161 . 1 1 121 121 SER CB C 13 63.6680 0.5 . 1 . . . A 121 SER CB . 25762 1 1162 . 1 1 121 121 SER N N 15 117.7910 0.5 . 1 . . . A 121 SER N . 25762 1 1163 . 1 1 122 122 LYS H H 1 8.3290 0.04 . 1 . . . A 122 LYS H . 25762 1 1164 . 1 1 122 122 LYS CA C 13 56.4740 0.5 . 1 . . . A 122 LYS CA . 25762 1 1165 . 1 1 122 122 LYS CB C 13 33.3350 0.5 . 1 . . . A 122 LYS CB . 25762 1 1166 . 1 1 122 122 LYS N N 15 123.9550 0.5 . 1 . . . A 122 LYS N . 25762 1 1167 . 1 1 125 125 LYS HA H 1 4.3100 0.04 . 1 . . . A 125 LYS HA . 25762 1 1168 . 1 1 125 125 LYS HB2 H 1 1.7900 0.04 . 2 . . . A 125 LYS HB2 . 25762 1 1169 . 1 1 125 125 LYS HG2 H 1 1.4300 0.04 . 2 . . . A 125 LYS HG2 . 25762 1 1170 . 1 1 125 125 LYS HE2 H 1 2.9900 0.04 . 2 . . . A 125 LYS HE2 . 25762 1 1171 . 1 1 125 125 LYS C C 13 176.7210 0.5 . 1 . . . A 125 LYS C . 25762 1 1172 . 1 1 125 125 LYS CA C 13 56.5800 0.5 . 1 . . . A 125 LYS CA . 25762 1 1173 . 1 1 125 125 LYS CB C 13 32.8100 0.5 . 1 . . . A 125 LYS CB . 25762 1 1174 . 1 1 125 125 LYS CG C 13 24.7700 0.5 . 1 . . . A 125 LYS CG . 25762 1 1175 . 1 1 125 125 LYS CD C 13 30.1100 0.5 . 1 . . . A 125 LYS CD . 25762 1 1176 . 1 1 125 125 LYS CE C 13 42.1800 0.5 . 1 . . . A 125 LYS CE . 25762 1 1177 . 1 1 126 126 LYS H H 1 8.1690 0.04 . 1 . . . A 126 LYS H . 25762 1 1178 . 1 1 126 126 LYS HA H 1 4.3200 0.04 . 1 . . . A 126 LYS HA . 25762 1 1179 . 1 1 126 126 LYS HB2 H 1 1.7700 0.04 . 2 . . . A 126 LYS HB2 . 25762 1 1180 . 1 1 126 126 LYS HG2 H 1 1.4400 0.04 . 2 . . . A 126 LYS HG2 . 25762 1 1181 . 1 1 126 126 LYS HE2 H 1 3.0200 0.04 . 2 . . . A 126 LYS HE2 . 25762 1 1182 . 1 1 126 126 LYS C C 13 176.5120 0.5 . 1 . . . A 126 LYS C . 25762 1 1183 . 1 1 126 126 LYS CA C 13 56.4400 0.5 . 1 . . . A 126 LYS CA . 25762 1 1184 . 1 1 126 126 LYS CB C 13 33.0570 0.5 . 1 . . . A 126 LYS CB . 25762 1 1185 . 1 1 126 126 LYS CG C 13 24.7100 0.5 . 1 . . . A 126 LYS CG . 25762 1 1186 . 1 1 126 126 LYS CD C 13 29.2000 0.5 . 1 . . . A 126 LYS CD . 25762 1 1187 . 1 1 126 126 LYS CE C 13 42.1300 0.5 . 1 . . . A 126 LYS CE . 25762 1 1188 . 1 1 126 126 LYS N N 15 122.5690 0.5 . 1 . . . A 126 LYS N . 25762 1 1189 . 1 1 127 127 GLU H H 1 8.4590 0.04 . 1 . . . A 127 GLU H . 25762 1 1190 . 1 1 127 127 GLU HA H 1 4.3100 0.04 . 1 . . . A 127 GLU HA . 25762 1 1191 . 1 1 127 127 GLU HB2 H 1 1.9900 0.04 . 2 . . . A 127 GLU HB2 . 25762 1 1192 . 1 1 127 127 GLU HG2 H 1 2.2700 0.04 . 2 . . . A 127 GLU HG2 . 25762 1 1193 . 1 1 127 127 GLU C C 13 176.8000 0.5 . 1 . . . A 127 GLU C . 25762 1 1194 . 1 1 127 127 GLU CA C 13 56.4740 0.5 . 1 . . . A 127 GLU CA . 25762 1 1195 . 1 1 127 127 GLU CB C 13 30.6200 0.5 . 1 . . . A 127 GLU CB . 25762 1 1196 . 1 1 127 127 GLU CG C 13 36.2100 0.5 . 1 . . . A 127 GLU CG . 25762 1 1197 . 1 1 127 127 GLU N N 15 123.4500 0.5 . 1 . . . A 127 GLU N . 25762 1 1198 . 1 1 128 128 GLY H H 1 8.4400 0.04 . 1 . . . A 128 GLY H . 25762 1 1199 . 1 1 128 128 GLY CA C 13 45.3000 0.5 . 1 . . . A 128 GLY CA . 25762 1 1200 . 1 1 128 128 GLY N N 15 110.8000 0.5 . 1 . . . A 128 GLY N . 25762 1 1201 . 1 1 129 129 LYS HA H 1 4.2700 0.04 . 1 . . . A 129 LYS HA . 25762 1 1202 . 1 1 129 129 LYS HB2 H 1 2.2500 0.04 . 2 . . . A 129 LYS HB2 . 25762 1 1203 . 1 1 129 129 LYS HG2 H 1 1.4100 0.04 . 2 . . . A 129 LYS HG2 . 25762 1 1204 . 1 1 129 129 LYS HD2 H 1 1.7700 0.04 . 2 . . . A 129 LYS HD2 . 25762 1 1205 . 1 1 129 129 LYS HE2 H 1 2.9900 0.04 . 2 . . . A 129 LYS HE2 . 25762 1 1206 . 1 1 129 129 LYS C C 13 176.5160 0.5 . 1 . . . A 129 LYS C . 25762 1 1207 . 1 1 129 129 LYS CA C 13 56.4800 0.5 . 1 . . . A 129 LYS CA . 25762 1 1208 . 1 1 129 129 LYS CB C 13 32.8600 0.5 . 1 . . . A 129 LYS CB . 25762 1 1209 . 1 1 129 129 LYS CG C 13 24.7100 0.5 . 1 . . . A 129 LYS CG . 25762 1 1210 . 1 1 129 129 LYS CD C 13 30.5900 0.5 . 1 . . . A 129 LYS CD . 25762 1 1211 . 1 1 129 129 LYS CE C 13 42.0100 0.5 . 1 . . . A 129 LYS CE . 25762 1 1212 . 1 1 130 130 LYS H H 1 8.4090 0.04 . 1 . . . A 130 LYS H . 25762 1 1213 . 1 1 130 130 LYS HA H 1 4.2700 0.04 . 1 . . . A 130 LYS HA . 25762 1 1214 . 1 1 130 130 LYS HB2 H 1 1.7700 0.04 . 2 . . . A 130 LYS HB2 . 25762 1 1215 . 1 1 130 130 LYS HG2 H 1 1.4200 0.04 . 2 . . . A 130 LYS HG2 . 25762 1 1216 . 1 1 130 130 LYS HE2 H 1 2.9800 0.04 . 2 . . . A 130 LYS HE2 . 25762 1 1217 . 1 1 130 130 LYS C C 13 176.5450 0.5 . 1 . . . A 130 LYS C . 25762 1 1218 . 1 1 130 130 LYS CA C 13 56.4950 0.5 . 1 . . . A 130 LYS CA . 25762 1 1219 . 1 1 130 130 LYS CB C 13 33.0200 0.5 . 1 . . . A 130 LYS CB . 25762 1 1220 . 1 1 130 130 LYS CG C 13 24.5700 0.5 . 1 . . . A 130 LYS CG . 25762 1 1221 . 1 1 130 130 LYS CD C 13 29.0200 0.5 . 1 . . . A 130 LYS CD . 25762 1 1222 . 1 1 130 130 LYS CE C 13 42.1500 0.5 . 1 . . . A 130 LYS CE . 25762 1 1223 . 1 1 130 130 LYS N N 15 124.0710 0.5 . 1 . . . A 130 LYS N . 25762 1 1224 . 1 1 131 131 GLN H H 1 8.4670 0.04 . 1 . . . A 131 GLN H . 25762 1 1225 . 1 1 131 131 GLN HA H 1 4.4400 0.04 . 1 . . . A 131 GLN HA . 25762 1 1226 . 1 1 131 131 GLN HB2 H 1 2.0300 0.04 . 2 . . . A 131 GLN HB2 . 25762 1 1227 . 1 1 131 131 GLN HG2 H 1 2.3600 0.04 . 2 . . . A 131 GLN HG2 . 25762 1 1228 . 1 1 131 131 GLN C C 13 175.8660 0.5 . 1 . . . A 131 GLN C . 25762 1 1229 . 1 1 131 131 GLN CA C 13 56.0160 0.5 . 1 . . . A 131 GLN CA . 25762 1 1230 . 1 1 131 131 GLN CB C 13 29.6630 0.5 . 1 . . . A 131 GLN CB . 25762 1 1231 . 1 1 131 131 GLN CG C 13 33.5300 0.5 . 1 . . . A 131 GLN CG . 25762 1 1232 . 1 1 131 131 GLN N N 15 122.7100 0.5 . 1 . . . A 131 GLN N . 25762 1 1233 . 1 1 132 132 GLU H H 1 8.4900 0.04 . 1 . . . A 132 GLU H . 25762 1 1234 . 1 1 132 132 GLU HA H 1 4.2500 0.04 . 1 . . . A 132 GLU HA . 25762 1 1235 . 1 1 132 132 GLU HB2 H 1 1.9600 0.04 . 2 . . . A 132 GLU HB2 . 25762 1 1236 . 1 1 132 132 GLU HG2 H 1 2.2600 0.04 . 2 . . . A 132 GLU HG2 . 25762 1 1237 . 1 1 132 132 GLU C C 13 176.3540 0.5 . 1 . . . A 132 GLU C . 25762 1 1238 . 1 1 132 132 GLU CA C 13 56.5370 0.5 . 1 . . . A 132 GLU CA . 25762 1 1239 . 1 1 132 132 GLU CB C 13 30.6140 0.5 . 1 . . . A 132 GLU CB . 25762 1 1240 . 1 1 132 132 GLU CG C 13 36.1100 0.5 . 1 . . . A 132 GLU CG . 25762 1 1241 . 1 1 132 132 GLU N N 15 123.5860 0.5 . 1 . . . A 132 GLU N . 25762 1 1242 . 1 1 133 133 LYS H H 1 8.3730 0.04 . 1 . . . A 133 LYS H . 25762 1 1243 . 1 1 133 133 LYS HA H 1 4.2800 0.04 . 1 . . . A 133 LYS HA . 25762 1 1244 . 1 1 133 133 LYS HB2 H 1 1.7600 0.04 . 2 . . . A 133 LYS HB2 . 25762 1 1245 . 1 1 133 133 LYS HG2 H 1 1.4100 0.04 . 2 . . . A 133 LYS HG2 . 25762 1 1246 . 1 1 133 133 LYS HE2 H 1 3.0050 0.04 . 2 . . . A 133 LYS HE2 . 25762 1 1247 . 1 1 133 133 LYS C C 13 176.2320 0.5 . 1 . . . A 133 LYS C . 25762 1 1248 . 1 1 133 133 LYS CA C 13 56.3110 0.5 . 1 . . . A 133 LYS CA . 25762 1 1249 . 1 1 133 133 LYS CB C 13 33.1370 0.5 . 1 . . . A 133 LYS CB . 25762 1 1250 . 1 1 133 133 LYS CG C 13 24.6200 0.5 . 1 . . . A 133 LYS CG . 25762 1 1251 . 1 1 133 133 LYS CD C 13 28.8900 0.5 . 1 . . . A 133 LYS CD . 25762 1 1252 . 1 1 133 133 LYS CE C 13 42.0400 0.5 . 1 . . . A 133 LYS CE . 25762 1 1253 . 1 1 133 133 LYS N N 15 123.9180 0.5 . 1 . . . A 133 LYS N . 25762 1 1254 . 1 1 134 134 MET H H 1 8.4360 0.04 . 1 . . . A 134 MET H . 25762 1 1255 . 1 1 134 134 MET HA H 1 4.4800 0.04 . 1 . . . A 134 MET HA . 25762 1 1256 . 1 1 134 134 MET HB2 H 1 2.0500 0.04 . 2 . . . A 134 MET HB2 . 25762 1 1257 . 1 1 134 134 MET HG2 H 1 2.5700 0.04 . 2 . . . A 134 MET HG2 . 25762 1 1258 . 1 1 134 134 MET C C 13 175.9460 0.5 . 1 . . . A 134 MET C . 25762 1 1259 . 1 1 134 134 MET CA C 13 55.5630 0.5 . 1 . . . A 134 MET CA . 25762 1 1260 . 1 1 134 134 MET CB C 13 32.0100 0.5 . 1 . . . A 134 MET CB . 25762 1 1261 . 1 1 134 134 MET CG C 13 30.6200 0.5 . 1 . . . A 134 MET CG . 25762 1 1262 . 1 1 134 134 MET N N 15 122.9940 0.5 . 1 . . . A 134 MET N . 25762 1 1263 . 1 1 135 135 LEU H H 1 8.2850 0.04 . 1 . . . A 135 LEU H . 25762 1 1264 . 1 1 135 135 LEU HA H 1 4.3800 0.04 . 1 . . . A 135 LEU HA . 25762 1 1265 . 1 1 135 135 LEU HB2 H 1 1.6200 0.04 . 2 . . . A 135 LEU HB2 . 25762 1 1266 . 1 1 135 135 LEU HG H 1 1.4200 0.04 . 1 . . . A 135 LEU HG . 25762 1 1267 . 1 1 135 135 LEU HD11 H 1 0.8900 0.04 . 2 . . . A 135 LEU HD11 . 25762 1 1268 . 1 1 135 135 LEU HD12 H 1 0.8900 0.04 . 2 . . . A 135 LEU HD12 . 25762 1 1269 . 1 1 135 135 LEU HD13 H 1 0.8900 0.04 . 2 . . . A 135 LEU HD13 . 25762 1 1270 . 1 1 135 135 LEU C C 13 176.1580 0.5 . 1 . . . A 135 LEU C . 25762 1 1271 . 1 1 135 135 LEU CA C 13 55.2250 0.5 . 1 . . . A 135 LEU CA . 25762 1 1272 . 1 1 135 135 LEU CB C 13 42.6540 0.5 . 1 . . . A 135 LEU CB . 25762 1 1273 . 1 1 135 135 LEU CG C 13 26.7600 0.5 . 1 . . . A 135 LEU CG . 25762 1 1274 . 1 1 135 135 LEU CD1 C 13 25.0200 0.5 . 2 . . . A 135 LEU CD1 . 25762 1 1275 . 1 1 135 135 LEU CD2 C 13 23.3600 0.5 . 2 . . . A 135 LEU CD2 . 25762 1 1276 . 1 1 135 135 LEU N N 15 124.4540 0.5 . 1 . . . A 135 LEU N . 25762 1 1277 . 1 1 136 136 ASP H H 1 7.8810 0.04 . 1 . . . A 136 ASP H . 25762 1 1278 . 1 1 136 136 ASP CA C 13 55.7290 0.5 . 1 . . . A 136 ASP CA . 25762 1 1279 . 1 1 136 136 ASP CB C 13 42.4150 0.5 . 1 . . . A 136 ASP CB . 25762 1 1280 . 1 1 136 136 ASP N N 15 126.9470 0.5 . 1 . . . A 136 ASP N . 25762 1 stop_ save_